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data_1K1A
#
_entry.id 1K1A
#
_audit_conform.dict_name mmcif_pdbx.dic
_audit_conform.dict_version 5.376
_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic
#
loop_
_database_2.database_id
_database_2.database_code
_database_2.pdbx_database_accession
_database_2.pdbx_DOI
PDB 1K1A pdb_00001k1a 10.2210/pdb1k1a/pdb
RCSB RCSB014434 ? ?
WWPDB D_1000014434 ? ?
#
_pdbx_database_related.db_name PDB
_pdbx_database_related.db_id 1K1B
_pdbx_database_related.details 'Closely related crystal form of BCL3.'
_pdbx_database_related.content_type unspecified
#
_pdbx_database_status.status_code REL
_pdbx_database_status.entry_id 1K1A
_pdbx_database_status.recvd_initial_deposition_date 2001-09-24
_pdbx_database_status.deposit_site RCSB
_pdbx_database_status.process_site RCSB
_pdbx_database_status.SG_entry .
_pdbx_database_status.pdb_format_compatible Y
_pdbx_database_status.status_code_mr ?
_pdbx_database_status.status_code_sf ?
_pdbx_database_status.status_code_cs ?
_pdbx_database_status.status_code_nmr_data ?
_pdbx_database_status.methods_development_category ?
#
loop_
_audit_author.name
_audit_author.pdbx_ordinal
'Michel, F.' 1
'Soler-Lopez, M.' 2
'Petosa, C.' 3
'Cramer, P.' 4
'Siebenlist, U.' 5
'Mueller, C.W.' 6
#
_citation.id primary
_citation.title
'Crystal structure of the ankyrin repeat domain of Bcl-3: a unique member of the IkappaB protein family.'
_citation.journal_abbrev 'EMBO J.'
_citation.journal_volume 20
_citation.page_first 6180
_citation.page_last 6190
_citation.year 2001
_citation.journal_id_ASTM EMJODG
_citation.country UK
_citation.journal_id_ISSN 0261-4189
_citation.journal_id_CSD 0897
_citation.book_publisher ?
_citation.pdbx_database_id_PubMed 11707390
_citation.pdbx_database_id_DOI 10.1093/emboj/20.22.6180
#
loop_
_citation_author.citation_id
_citation_author.name
_citation_author.ordinal
_citation_author.identifier_ORCID
primary 'Michel, F.' 1 ?
primary 'Soler-Lopez, M.' 2 ?
primary 'Petosa, C.' 3 ?
primary 'Cramer, P.' 4 ?
primary 'Siebenlist, U.' 5 ?
primary 'Muller, C.W.' 6 ?
#
_cell.entry_id 1K1A
_cell.length_a 31.703
_cell.length_b 51.218
_cell.length_c 64.680
_cell.angle_alpha 90.00
_cell.angle_beta 102.01
_cell.angle_gamma 90.00
_cell.Z_PDB 2
_cell.pdbx_unique_axis ?
#
_symmetry.entry_id 1K1A
_symmetry.space_group_name_H-M 'P 1 21 1'
_symmetry.pdbx_full_space_group_name_H-M ?
_symmetry.cell_setting ?
_symmetry.Int_Tables_number 4
#
loop_
_entity.id
_entity.type
_entity.src_method
_entity.pdbx_description
_entity.formula_weight
_entity.pdbx_number_of_molecules
_entity.pdbx_ec
_entity.pdbx_mutation
_entity.pdbx_fragment
_entity.details
1 polymer man 'B-cell lymphoma 3-encoded protein' 25829.451 1 ? ? 'ankyrin repeat domain' ?
2 water nat water 18.015 195 ? ? ? ?
#
_entity_name_com.entity_id 1
_entity_name_com.name 'BCL3, BCL-3 protein'
#
_entity_poly.entity_id 1
_entity_poly.type 'polypeptide(L)'
_entity_poly.nstd_linkage no
_entity_poly.nstd_monomer no
_entity_poly.pdbx_seq_one_letter_code
;MATRADEDGDTPLHIAVVQGNLPAVHRLVNLFQQGGRELDIYNNLRQTPLHLAVITTLPSVVRLLVTAGASPMALDRHGQ
TAAHLACEHRSPTCLRALLDSAAPGTLDLEARNYDGLTALHVAVNTECQETVQLLLERGADIDAVDIKSGRSPLIHAVEN
NSLSMVQLLLQHGANVNAQMYSGSSALHSASGRGLLPLVRTLVRSGADSSLKNCHNDTPLMVARSRRVIDILRGKATRPA
S
;
_entity_poly.pdbx_seq_one_letter_code_can
;MATRADEDGDTPLHIAVVQGNLPAVHRLVNLFQQGGRELDIYNNLRQTPLHLAVITTLPSVVRLLVTAGASPMALDRHGQ
TAAHLACEHRSPTCLRALLDSAAPGTLDLEARNYDGLTALHVAVNTECQETVQLLLERGADIDAVDIKSGRSPLIHAVEN
NSLSMVQLLLQHGANVNAQMYSGSSALHSASGRGLLPLVRTLVRSGADSSLKNCHNDTPLMVARSRRVIDILRGKATRPA
S
;
_entity_poly.pdbx_strand_id A
_entity_poly.pdbx_target_identifier ?
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.num
_entity_poly_seq.mon_id
_entity_poly_seq.hetero
1 1 MET n
1 2 ALA n
1 3 THR n
1 4 ARG n
1 5 ALA n
1 6 ASP n
1 7 GLU n
1 8 ASP n
1 9 GLY n
1 10 ASP n
1 11 THR n
1 12 PRO n
1 13 LEU n
1 14 HIS n
1 15 ILE n
1 16 ALA n
1 17 VAL n
1 18 VAL n
1 19 GLN n
1 20 GLY n
1 21 ASN n
1 22 LEU n
1 23 PRO n
1 24 ALA n
1 25 VAL n
1 26 HIS n
1 27 ARG n
1 28 LEU n
1 29 VAL n
1 30 ASN n
1 31 LEU n
1 32 PHE n
1 33 GLN n
1 34 GLN n
1 35 GLY n
1 36 GLY n
1 37 ARG n
1 38 GLU n
1 39 LEU n
1 40 ASP n
1 41 ILE n
1 42 TYR n
1 43 ASN n
1 44 ASN n
1 45 LEU n
1 46 ARG n
1 47 GLN n
1 48 THR n
1 49 PRO n
1 50 LEU n
1 51 HIS n
1 52 LEU n
1 53 ALA n
1 54 VAL n
1 55 ILE n
1 56 THR n
1 57 THR n
1 58 LEU n
1 59 PRO n
1 60 SER n
1 61 VAL n
1 62 VAL n
1 63 ARG n
1 64 LEU n
1 65 LEU n
1 66 VAL n
1 67 THR n
1 68 ALA n
1 69 GLY n
1 70 ALA n
1 71 SER n
1 72 PRO n
1 73 MET n
1 74 ALA n
1 75 LEU n
1 76 ASP n
1 77 ARG n
1 78 HIS n
1 79 GLY n
1 80 GLN n
1 81 THR n
1 82 ALA n
1 83 ALA n
1 84 HIS n
1 85 LEU n
1 86 ALA n
1 87 CYS n
1 88 GLU n
1 89 HIS n
1 90 ARG n
1 91 SER n
1 92 PRO n
1 93 THR n
1 94 CYS n
1 95 LEU n
1 96 ARG n
1 97 ALA n
1 98 LEU n
1 99 LEU n
1 100 ASP n
1 101 SER n
1 102 ALA n
1 103 ALA n
1 104 PRO n
1 105 GLY n
1 106 THR n
1 107 LEU n
1 108 ASP n
1 109 LEU n
1 110 GLU n
1 111 ALA n
1 112 ARG n
1 113 ASN n
1 114 TYR n
1 115 ASP n
1 116 GLY n
1 117 LEU n
1 118 THR n
1 119 ALA n
1 120 LEU n
1 121 HIS n
1 122 VAL n
1 123 ALA n
1 124 VAL n
1 125 ASN n
1 126 THR n
1 127 GLU n
1 128 CYS n
1 129 GLN n
1 130 GLU n
1 131 THR n
1 132 VAL n
1 133 GLN n
1 134 LEU n
1 135 LEU n
1 136 LEU n
1 137 GLU n
1 138 ARG n
1 139 GLY n
1 140 ALA n
1 141 ASP n
1 142 ILE n
1 143 ASP n
1 144 ALA n
1 145 VAL n
1 146 ASP n
1 147 ILE n
1 148 LYS n
1 149 SER n
1 150 GLY n
1 151 ARG n
1 152 SER n
1 153 PRO n
1 154 LEU n
1 155 ILE n
1 156 HIS n
1 157 ALA n
1 158 VAL n
1 159 GLU n
1 160 ASN n
1 161 ASN n
1 162 SER n
1 163 LEU n
1 164 SER n
1 165 MET n
1 166 VAL n
1 167 GLN n
1 168 LEU n
1 169 LEU n
1 170 LEU n
1 171 GLN n
1 172 HIS n
1 173 GLY n
1 174 ALA n
1 175 ASN n
1 176 VAL n
1 177 ASN n
1 178 ALA n
1 179 GLN n
1 180 MET n
1 181 TYR n
1 182 SER n
1 183 GLY n
1 184 SER n
1 185 SER n
1 186 ALA n
1 187 LEU n
1 188 HIS n
1 189 SER n
1 190 ALA n
1 191 SER n
1 192 GLY n
1 193 ARG n
1 194 GLY n
1 195 LEU n
1 196 LEU n
1 197 PRO n
1 198 LEU n
1 199 VAL n
1 200 ARG n
1 201 THR n
1 202 LEU n
1 203 VAL n
1 204 ARG n
1 205 SER n
1 206 GLY n
1 207 ALA n
1 208 ASP n
1 209 SER n
1 210 SER n
1 211 LEU n
1 212 LYS n
1 213 ASN n
1 214 CYS n
1 215 HIS n
1 216 ASN n
1 217 ASP n
1 218 THR n
1 219 PRO n
1 220 LEU n
1 221 MET n
1 222 VAL n
1 223 ALA n
1 224 ARG n
1 225 SER n
1 226 ARG n
1 227 ARG n
1 228 VAL n
1 229 ILE n
1 230 ASP n
1 231 ILE n
1 232 LEU n
1 233 ARG n
1 234 GLY n
1 235 LYS n
1 236 ALA n
1 237 THR n
1 238 ARG n
1 239 PRO n
1 240 ALA n
1 241 SER n
#
_entity_src_gen.entity_id 1
_entity_src_gen.pdbx_src_id 1
_entity_src_gen.pdbx_alt_source_flag sample
_entity_src_gen.pdbx_seq_type ?
_entity_src_gen.pdbx_beg_seq_num ?
_entity_src_gen.pdbx_end_seq_num ?
_entity_src_gen.gene_src_common_name human
_entity_src_gen.gene_src_genus Homo
_entity_src_gen.pdbx_gene_src_gene ?
_entity_src_gen.gene_src_species ?
_entity_src_gen.gene_src_strain ?
_entity_src_gen.gene_src_tissue ?
_entity_src_gen.gene_src_tissue_fraction ?
_entity_src_gen.gene_src_details ?
_entity_src_gen.pdbx_gene_src_fragment ?
_entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens'
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606
_entity_src_gen.pdbx_gene_src_variant ?
_entity_src_gen.pdbx_gene_src_cell_line ?
_entity_src_gen.pdbx_gene_src_atcc ?
_entity_src_gen.pdbx_gene_src_organ ?
_entity_src_gen.pdbx_gene_src_organelle ?
_entity_src_gen.pdbx_gene_src_cell ?
_entity_src_gen.pdbx_gene_src_cellular_location ?
_entity_src_gen.host_org_common_name ?
_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli'
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562
_entity_src_gen.host_org_genus Escherichia
_entity_src_gen.pdbx_host_org_gene ?
_entity_src_gen.pdbx_host_org_organ ?
_entity_src_gen.host_org_species ?
_entity_src_gen.pdbx_host_org_tissue ?
_entity_src_gen.pdbx_host_org_tissue_fraction ?
_entity_src_gen.pdbx_host_org_strain ?
_entity_src_gen.pdbx_host_org_variant ?
_entity_src_gen.pdbx_host_org_cell_line ?
_entity_src_gen.pdbx_host_org_atcc ?
_entity_src_gen.pdbx_host_org_culture_collection ?
_entity_src_gen.pdbx_host_org_cell ?
_entity_src_gen.pdbx_host_org_organelle ?
_entity_src_gen.pdbx_host_org_cellular_location ?
_entity_src_gen.pdbx_host_org_vector_type ?
_entity_src_gen.pdbx_host_org_vector ?
_entity_src_gen.host_org_details ?
_entity_src_gen.expression_system_id ?
_entity_src_gen.plasmid_name ?
_entity_src_gen.plasmid_details ?
_entity_src_gen.pdbx_description ?
#
_struct_ref.id 1
_struct_ref.db_name UNP
_struct_ref.db_code BCL3_HUMAN
_struct_ref.entity_id 1
_struct_ref.pdbx_seq_one_letter_code
;MATRADEDGDTPLHIAVVQGNLPAVHRLVNLFQQGGRELDIYNNLRQTPLHLAVITTLPSVVRLLVTAGASPMALDRHGQ
TAAHLACEHRSPTCLRALLDSAAPGTLDLEARNYDGLTALHVAVNTECQETVQLLLERGADIDAVDIKSGRSPLIHAVEN
NSLSMVQLLLQHGANVNAQMYSGSSALHSASGRGLLPLVRTLVRSGADSSLKNCHNDTPLMVARSRRVIDILRGKATRPA
S
;
_struct_ref.pdbx_align_begin 119
_struct_ref.pdbx_db_accession P20749
_struct_ref.pdbx_db_isoform ?
#
_struct_ref_seq.align_id 1
_struct_ref_seq.ref_id 1
_struct_ref_seq.pdbx_PDB_id_code 1K1A
_struct_ref_seq.pdbx_strand_id A
_struct_ref_seq.seq_align_beg 1
_struct_ref_seq.pdbx_seq_align_beg_ins_code ?
_struct_ref_seq.seq_align_end 241
_struct_ref_seq.pdbx_seq_align_end_ins_code ?
_struct_ref_seq.pdbx_db_accession P20749
_struct_ref_seq.db_align_beg 119
_struct_ref_seq.pdbx_db_align_beg_ins_code ?
_struct_ref_seq.db_align_end 359
_struct_ref_seq.pdbx_db_align_end_ins_code ?
_struct_ref_seq.pdbx_auth_seq_align_beg 119
_struct_ref_seq.pdbx_auth_seq_align_end 359
#
loop_
_chem_comp.id
_chem_comp.type
_chem_comp.mon_nstd_flag
_chem_comp.name
_chem_comp.pdbx_synonyms
_chem_comp.formula
_chem_comp.formula_weight
ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093
ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209
ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118
ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103
CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158
GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129
GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067
HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162
HOH non-polymer . WATER ? 'H2 O' 18.015
ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173
LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173
LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195
MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211
PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189
PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130
SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093
THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119
TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189
VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146
#
_exptl.entry_id 1K1A
_exptl.method 'X-RAY DIFFRACTION'
_exptl.crystals_number 1
#
_exptl_crystal.id 1
_exptl_crystal.density_meas ?
_exptl_crystal.density_Matthews 1.99
_exptl_crystal.density_percent_sol 38.12
_exptl_crystal.description ?
#
_exptl_crystal_grow.crystal_id 1
_exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP'
_exptl_crystal_grow.temp 293
_exptl_crystal_grow.temp_details ?
_exptl_crystal_grow.pH 6.0
_exptl_crystal_grow.pdbx_details 'PEG 6000, MES, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K'
_exptl_crystal_grow.pdbx_pH_range .
#
_diffrn.id 1
_diffrn.ambient_temp 100
_diffrn.ambient_temp_details ?
_diffrn.crystal_id 1
#
_diffrn_detector.diffrn_id 1
_diffrn_detector.detector CCD
_diffrn_detector.type MARRESEARCH
_diffrn_detector.pdbx_collection_date 2000-10-28
_diffrn_detector.details ?
#
_diffrn_radiation.diffrn_id 1
_diffrn_radiation.wavelength_id 1
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M
_diffrn_radiation.monochromator ?
_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH'
_diffrn_radiation.pdbx_scattering_type x-ray
#
_diffrn_radiation_wavelength.id 1
_diffrn_radiation_wavelength.wavelength 0.934
_diffrn_radiation_wavelength.wt 1.0
#
_diffrn_source.diffrn_id 1
_diffrn_source.source SYNCHROTRON
_diffrn_source.type 'ESRF BEAMLINE ID14-1'
_diffrn_source.pdbx_synchrotron_site ESRF
_diffrn_source.pdbx_synchrotron_beamline ID14-1
_diffrn_source.pdbx_wavelength ?
_diffrn_source.pdbx_wavelength_list 0.934
#
_reflns.entry_id 1K1A
_reflns.observed_criterion_sigma_I 0
_reflns.observed_criterion_sigma_F 0
_reflns.d_resolution_low 40
_reflns.d_resolution_high 1.80
_reflns.number_obs 17021
_reflns.number_all 17021
_reflns.percent_possible_obs 89.8
_reflns.pdbx_Rmerge_I_obs ?
_reflns.pdbx_Rsym_value 0.0720000
_reflns.pdbx_netI_over_sigmaI 10.5
_reflns.B_iso_Wilson_estimate ?
_reflns.pdbx_redundancy 2.7
_reflns.R_free_details ?
_reflns.limit_h_max ?
_reflns.limit_h_min ?
_reflns.limit_k_max ?
_reflns.limit_k_min ?
_reflns.limit_l_max ?
_reflns.limit_l_min ?
_reflns.observed_criterion_F_max ?
_reflns.observed_criterion_F_min ?
_reflns.pdbx_diffrn_id 1
_reflns.pdbx_ordinal 1
#
_reflns_shell.d_res_high 1.80
_reflns_shell.d_res_low 1.86
_reflns_shell.percent_possible_all 77.8
_reflns_shell.Rmerge_I_obs ?
_reflns_shell.pdbx_Rsym_value 0.6970000
_reflns_shell.meanI_over_sigI_obs 1.65
_reflns_shell.pdbx_redundancy 1.73
_reflns_shell.percent_possible_obs ?
_reflns_shell.number_unique_all 1479
_reflns_shell.pdbx_diffrn_id ?
_reflns_shell.pdbx_ordinal 1
#
_refine.entry_id 1K1A
_refine.ls_number_reflns_obs 16328
_refine.ls_number_reflns_all 16328
_refine.pdbx_ls_sigma_I ?
_refine.pdbx_ls_sigma_F 0.0
_refine.pdbx_data_cutoff_high_absF ?
_refine.pdbx_data_cutoff_low_absF ?
_refine.ls_d_res_low 20.00
_refine.ls_d_res_high 1.86
_refine.ls_percent_reflns_obs 89.8
_refine.ls_R_factor_obs 0.2004000
_refine.ls_R_factor_all 0.2004000
_refine.ls_R_factor_R_work 0.1989900
_refine.ls_R_factor_R_free 0.2285900
_refine.ls_R_factor_R_free_error ?
_refine.ls_R_factor_R_free_error_details ?
_refine.ls_percent_reflns_R_free 5.0
_refine.ls_number_reflns_R_free 828
_refine.ls_number_parameters ?
_refine.ls_number_restraints ?
_refine.occupancy_min ?
_refine.occupancy_max ?
_refine.B_iso_mean 21.105
_refine.aniso_B[1][1] -0.09
_refine.aniso_B[2][2] -1.27
_refine.aniso_B[3][3] 1.35
_refine.aniso_B[1][2] 0.00
_refine.aniso_B[1][3] -0.04
_refine.aniso_B[2][3] 0.00
_refine.solvent_model_details ?
_refine.solvent_model_param_ksol ?
_refine.solvent_model_param_bsol ?
_refine.pdbx_ls_cross_valid_method THROUGHOUT
_refine.details
;RESIDUES SER178,VAL179,LEU182,GLN251,ARG269,SER307
PRESENT DOUBLE CONFORMATIONS.
;
_refine.pdbx_starting_model 1ikn
_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT'
_refine.pdbx_isotropic_thermal_model ?
_refine.pdbx_stereochemistry_target_values 'Engh & Huber'
_refine.pdbx_stereochem_target_val_spec_case ?
_refine.pdbx_R_Free_selection_details RANDOM
_refine.pdbx_overall_ESU_R_Free 0.15154
_refine.overall_SU_B 3.68115
_refine.ls_redundancy_reflns_obs ?
_refine.B_iso_min ?
_refine.B_iso_max ?
_refine.correlation_coeff_Fo_to_Fc ?
_refine.correlation_coeff_Fo_to_Fc_free ?
_refine.overall_SU_R_Cruickshank_DPI ?
_refine.overall_SU_R_free ?
_refine.overall_SU_ML 0.11055
_refine.pdbx_overall_ESU_R 0.18488
_refine.pdbx_data_cutoff_high_rms_absF ?
_refine.pdbx_refine_id 'X-RAY DIFFRACTION'
_refine.pdbx_diffrn_id 1
_refine.pdbx_TLS_residual_ADP_flag ?
_refine.pdbx_solvent_vdw_probe_radii ?
_refine.pdbx_solvent_ion_probe_radii ?
_refine.pdbx_solvent_shrinkage_radii ?
_refine.pdbx_overall_phase_error ?
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ?
_refine.pdbx_overall_SU_R_Blow_DPI ?
_refine.pdbx_overall_SU_R_free_Blow_DPI ?
#
_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION'
_refine_hist.cycle_id LAST
_refine_hist.pdbx_number_atoms_protein 1729
_refine_hist.pdbx_number_atoms_nucleic_acid 0
_refine_hist.pdbx_number_atoms_ligand 0
_refine_hist.number_atoms_solvent 195
_refine_hist.number_atoms_total 1924
_refine_hist.d_res_high 1.86
_refine_hist.d_res_low 20.00
#
loop_
_refine_ls_restr.type
_refine_ls_restr.dev_ideal
_refine_ls_restr.dev_ideal_target
_refine_ls_restr.weight
_refine_ls_restr.number
_refine_ls_restr.pdbx_refine_id
_refine_ls_restr.pdbx_restraint_function
p_bond_d 0.007 0.021 ? ? 'X-RAY DIFFRACTION' ?
p_mcbond_it 0.578 1.500 ? ? 'X-RAY DIFFRACTION' ?
p_mcangle_it 1.104 2.000 ? ? 'X-RAY DIFFRACTION' ?
p_scbond_it 1.789 3.000 ? ? 'X-RAY DIFFRACTION' ?
p_scangle_it 3.103 4.500 ? ? 'X-RAY DIFFRACTION' ?
p_plane_restr 0.004 0.020 ? ? 'X-RAY DIFFRACTION' ?
p_chiral_restr 0.070 0.200 ? ? 'X-RAY DIFFRACTION' ?
#
_struct.entry_id 1K1A
_struct.title
'Crystal structure of the ankyrin repeat domain of Bcl-3: a unique member of the IkappaB protein family'
_struct.pdbx_model_details ?
_struct.pdbx_CASP_flag ?
_struct.pdbx_model_type_details ?
#
_struct_keywords.entry_id 1K1A
_struct_keywords.pdbx_keywords TRANSCRIPTION
_struct_keywords.text 'Bcl-3, NF-kappaB transcription factors, IkappaB proteins, TRANSCRIPTION'
#
loop_
_struct_asym.id
_struct_asym.pdbx_blank_PDB_chainid_flag
_struct_asym.pdbx_modified
_struct_asym.entity_id
_struct_asym.details
A N N 1 ?
B N N 2 ?
#
_struct_biol.id 1
_struct_biol.pdbx_parent_biol_id ?
_struct_biol.details ?
#
loop_
_struct_conf.conf_type_id
_struct_conf.id
_struct_conf.pdbx_PDB_helix_id
_struct_conf.beg_label_comp_id
_struct_conf.beg_label_asym_id
_struct_conf.beg_label_seq_id
_struct_conf.pdbx_beg_PDB_ins_code
_struct_conf.end_label_comp_id
_struct_conf.end_label_asym_id
_struct_conf.end_label_seq_id
_struct_conf.pdbx_end_PDB_ins_code
_struct_conf.beg_auth_comp_id
_struct_conf.beg_auth_asym_id
_struct_conf.beg_auth_seq_id
_struct_conf.end_auth_comp_id
_struct_conf.end_auth_asym_id
_struct_conf.end_auth_seq_id
_struct_conf.pdbx_PDB_helix_class
_struct_conf.details
_struct_conf.pdbx_PDB_helix_length
HELX_P HELX_P1 1 THR A 11 ? GLN A 19 ? THR A 129 GLN A 137 1 ? 9
HELX_P HELX_P2 2 ASN A 21 ? GLY A 35 ? ASN A 139 GLY A 153 1 ? 15
HELX_P HELX_P3 3 THR A 48 ? THR A 56 ? THR A 166 THR A 174 1 ? 9
HELX_P HELX_P4 4 LEU A 58 ? ALA A 68 ? LEU A 176 ALA A 186 1 ? 11
HELX_P HELX_P5 5 THR A 81 ? HIS A 89 ? THR A 199 HIS A 207 1 ? 9
HELX_P HELX_P6 6 SER A 91 ? ALA A 102 ? SER A 209 ALA A 220 1 ? 12
HELX_P HELX_P7 7 THR A 118 ? GLU A 127 ? THR A 236 GLU A 245 1 ? 10
HELX_P HELX_P8 8 CYS A 128 ? ARG A 138 ? CYS A 246 ARG A 256 1 ? 11
HELX_P HELX_P9 9 SER A 152 ? ASN A 160 ? SER A 270 ASN A 278 1 ? 9
HELX_P HELX_P10 10 SER A 162 ? HIS A 172 ? SER A 280 HIS A 290 1 ? 11
HELX_P HELX_P11 11 SER A 185 ? GLY A 194 ? SER A 303 GLY A 312 1 ? 10
HELX_P HELX_P12 12 LEU A 195 ? SER A 205 ? LEU A 313 SER A 323 1 ? 11
HELX_P HELX_P13 13 SER A 225 ? ARG A 233 ? SER A 343 ARG A 351 1 ? 9
#
_struct_conf_type.id HELX_P
_struct_conf_type.criteria ?
_struct_conf_type.reference ?
#
_database_PDB_matrix.entry_id 1K1A
_database_PDB_matrix.origx[1][1] 1.000000
_database_PDB_matrix.origx[1][2] 0.000000
_database_PDB_matrix.origx[1][3] 0.000000
_database_PDB_matrix.origx[2][1] 0.000000
_database_PDB_matrix.origx[2][2] 1.000000
_database_PDB_matrix.origx[2][3] 0.000000
_database_PDB_matrix.origx[3][1] 0.000000
_database_PDB_matrix.origx[3][2] 0.000000
_database_PDB_matrix.origx[3][3] 1.000000
_database_PDB_matrix.origx_vector[1] 0.00000
_database_PDB_matrix.origx_vector[2] 0.00000
_database_PDB_matrix.origx_vector[3] 0.00000
#
_atom_sites.entry_id 1K1A
_atom_sites.fract_transf_matrix[1][1] 0.031543
_atom_sites.fract_transf_matrix[1][2] 0.000000
_atom_sites.fract_transf_matrix[1][3] 0.006710
_atom_sites.fract_transf_matrix[2][1] 0.000000
_atom_sites.fract_transf_matrix[2][2] 0.019524
_atom_sites.fract_transf_matrix[2][3] 0.000000
_atom_sites.fract_transf_matrix[3][1] 0.000000
_atom_sites.fract_transf_matrix[3][2] 0.000000
_atom_sites.fract_transf_matrix[3][3] 0.015807
_atom_sites.fract_transf_vector[1] 0.00000
_atom_sites.fract_transf_vector[2] 0.00000
_atom_sites.fract_transf_vector[3] 0.00000
#
loop_
_atom_type.symbol
C
N
O
S
#
loop_
_atom_site.group_PDB
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_alt_id
_atom_site.label_comp_id
_atom_site.label_asym_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.pdbx_PDB_ins_code
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
_atom_site.occupancy
_atom_site.B_iso_or_equiv
_atom_site.pdbx_formal_charge
_atom_site.auth_seq_id
_atom_site.auth_comp_id
_atom_site.auth_asym_id
_atom_site.auth_atom_id
_atom_site.pdbx_PDB_model_num
ATOM 1 N N . GLU A 1 7 ? 14.581 13.195 3.479 1.00 22.25 ? 125 GLU A N 1
ATOM 2 C CA . GLU A 1 7 ? 14.496 14.621 3.901 1.00 20.31 ? 125 GLU A CA 1
ATOM 3 C C . GLU A 1 7 ? 14.969 14.841 5.327 1.00 19.84 ? 125 GLU A C 1
ATOM 4 O O . GLU A 1 7 ? 14.624 14.071 6.225 1.00 23.21 ? 125 GLU A O 1
ATOM 5 C CB . GLU A 1 7 ? 13.765 15.508 2.985 1.00 21.39 ? 125 GLU A CB 1
ATOM 6 C CG . GLU A 1 7 ? 14.084 15.489 1.490 1.00 20.87 ? 125 GLU A CG 1
ATOM 7 C CD . GLU A 1 7 ? 14.884 16.707 1.033 1.00 20.86 ? 125 GLU A CD 1
ATOM 8 O OE1 . GLU A 1 7 ? 14.534 17.888 1.416 1.00 25.80 ? 125 GLU A OE1 1
ATOM 9 O OE2 . GLU A 1 7 ? 15.906 16.556 0.268 1.00 25.92 ? 125 GLU A OE2 1
ATOM 10 N N . ASP A 1 8 ? 15.801 16.049 5.369 1.00 20.77 ? 126 ASP A N 1
ATOM 11 C CA . ASP A 1 8 ? 16.385 16.475 6.632 1.00 20.90 ? 126 ASP A CA 1
ATOM 12 C C . ASP A 1 8 ? 15.350 16.558 7.738 1.00 23.20 ? 126 ASP A C 1
ATOM 13 O O . ASP A 1 8 ? 14.313 17.195 7.581 1.00 22.64 ? 126 ASP A O 1
ATOM 14 C CB . ASP A 1 8 ? 17.134 17.790 6.480 1.00 20.72 ? 126 ASP A CB 1
ATOM 15 C CG . ASP A 1 8 ? 18.140 18.064 7.599 1.00 20.54 ? 126 ASP A CG 1
ATOM 16 O OD1 . ASP A 1 8 ? 19.000 17.162 7.926 1.00 25.18 ? 126 ASP A OD1 1
ATOM 17 O OD2 . ASP A 1 8 ? 18.125 19.196 8.214 1.00 24.39 ? 126 ASP A OD2 1
ATOM 18 N N . GLY A 1 9 ? 15.629 15.909 8.864 1.00 30.89 ? 127 GLY A N 1
ATOM 19 C CA . GLY A 1 9 ? 14.683 15.881 9.965 1.00 29.68 ? 127 GLY A CA 1
ATOM 20 C C . GLY A 1 9 ? 13.710 14.732 9.800 1.00 28.95 ? 127 GLY A C 1
ATOM 21 O O . GLY A 1 9 ? 12.809 14.541 10.617 1.00 29.06 ? 127 GLY A O 1
ATOM 22 N N . ASP A 1 10 ? 13.882 13.981 8.718 1.00 28.10 ? 128 ASP A N 1
ATOM 23 C CA . ASP A 1 10 ? 13.082 12.790 8.460 1.00 27.57 ? 128 ASP A CA 1
ATOM 24 C C . ASP A 1 10 ? 13.852 11.549 8.881 1.00 26.16 ? 128 ASP A C 1
ATOM 25 O O . ASP A 1 10 ? 14.836 11.177 8.244 1.00 26.12 ? 128 ASP A O 1
ATOM 26 C CB . ASP A 1 10 ? 12.759 12.666 6.970 1.00 28.21 ? 128 ASP A CB 1
ATOM 27 C CG . ASP A 1 10 ? 11.528 13.439 6.574 1.00 30.26 ? 128 ASP A CG 1
ATOM 28 O OD1 . ASP A 1 10 ? 10.646 13.585 7.446 0.00 36.17 ? 128 ASP A OD1 1
ATOM 29 O OD2 . ASP A 1 10 ? 11.277 13.733 5.379 1.00 34.30 ? 128 ASP A OD2 1
ATOM 30 N N . THR A 1 11 ? 13.406 10.905 9.950 1.00 22.61 ? 129 THR A N 1
ATOM 31 C CA . THR A 1 11 ? 14.029 9.663 10.384 1.00 18.72 ? 129 THR A CA 1
ATOM 32 C C . THR A 1 11 ? 12.964 8.649 10.777 1.00 18.31 ? 129 THR A C 1
ATOM 33 O O . THR A 1 11 ? 12.716 8.413 11.957 1.00 18.02 ? 129 THR A O 1
ATOM 34 C CB . THR A 1 11 ? 14.937 9.920 11.591 1.00 18.43 ? 129 THR A CB 1
ATOM 35 O OG1 . THR A 1 11 ? 14.328 10.867 12.456 1.00 20.73 ? 129 THR A OG1 1
ATOM 36 C CG2 . THR A 1 11 ? 16.308 10.471 11.200 1.00 21.48 ? 129 THR A CG2 1
ATOM 37 N N . PRO A 1 12 ? 12.337 8.051 9.772 1.00 20.18 ? 130 PRO A N 1
ATOM 38 C CA . PRO A 1 12 ? 11.236 7.107 9.988 1.00 19.20 ? 130 PRO A CA 1
ATOM 39 C C . PRO A 1 12 ? 11.675 5.851 10.729 1.00 18.09 ? 130 PRO A C 1
ATOM 40 O O . PRO A 1 12 ? 10.923 5.343 11.570 1.00 18.15 ? 130 PRO A O 1
ATOM 41 C CB . PRO A 1 12 ? 10.797 6.763 8.564 1.00 19.45 ? 130 PRO A CB 1
ATOM 42 C CG . PRO A 1 12 ? 12.017 7.022 7.741 1.00 19.45 ? 130 PRO A CG 1
ATOM 43 C CD . PRO A 1 12 ? 12.617 8.256 8.339 1.00 20.26 ? 130 PRO A CD 1
ATOM 44 N N . LEU A 1 13 ? 12.876 5.360 10.440 1.00 16.95 ? 131 LEU A N 1
ATOM 45 C CA . LEU A 1 13 ? 13.362 4.159 11.101 1.00 15.73 ? 131 LEU A CA 1
ATOM 46 C C . LEU A 1 13 ? 13.678 4.461 12.559 1.00 14.83 ? 131 LEU A C 1
ATOM 47 O O . LEU A 1 13 ? 13.407 3.649 13.442 1.00 14.05 ? 131 LEU A O 1
ATOM 48 C CB . LEU A 1 13 ? 14.589 3.600 10.377 1.00 15.87 ? 131 LEU A CB 1
ATOM 49 C CG . LEU A 1 13 ? 15.085 2.218 10.806 1.00 16.17 ? 131 LEU A CG 1
ATOM 50 C CD1 . LEU A 1 13 ? 13.952 1.200 10.865 1.00 14.80 ? 131 LEU A CD1 1
ATOM 51 C CD2 . LEU A 1 13 ? 16.196 1.735 9.856 1.00 16.50 ? 131 LEU A CD2 1
ATOM 52 N N . HIS A 1 14 ? 14.249 5.632 12.813 1.00 14.56 ? 132 HIS A N 1
ATOM 53 C CA . HIS A 1 14 ? 14.533 6.036 14.184 1.00 14.42 ? 132 HIS A CA 1
ATOM 54 C C . HIS A 1 14 ? 13.237 6.056 14.979 1.00 14.37 ? 132 HIS A C 1
ATOM 55 O O . HIS A 1 14 ? 13.176 5.539 16.088 1.00 14.36 ? 132 HIS A O 1
ATOM 56 C CB . HIS A 1 14 ? 15.196 7.414 14.226 1.00 14.52 ? 132 HIS A CB 1
ATOM 57 C CG . HIS A 1 14 ? 16.567 7.440 13.622 1.00 14.84 ? 132 HIS A CG 1
ATOM 58 N ND1 . HIS A 1 14 ? 17.715 7.526 14.381 1.00 16.82 ? 132 HIS A ND1 1
ATOM 59 C CD2 . HIS A 1 14 ? 16.972 7.397 12.332 1.00 14.27 ? 132 HIS A CD2 1
ATOM 60 C CE1 . HIS A 1 14 ? 18.769 7.525 13.586 1.00 14.24 ? 132 HIS A CE1 1
ATOM 61 N NE2 . HIS A 1 14 ? 18.347 7.458 12.337 1.00 15.75 ? 132 HIS A NE2 1
ATOM 62 N N . ILE A 1 15 ? 12.203 6.651 14.394 1.00 13.76 ? 133 ILE A N 1
ATOM 63 C CA . ILE A 1 15 ? 10.891 6.751 15.040 1.00 14.17 ? 133 ILE A CA 1
ATOM 64 C C . ILE A 1 15 ? 10.277 5.383 15.331 1.00 13.36 ? 133 ILE A C 1
ATOM 65 O O . ILE A 1 15 ? 9.792 5.138 16.436 1.00 13.41 ? 133 ILE A O 1
ATOM 66 C CB . ILE A 1 15 ? 9.928 7.564 14.161 1.00 14.70 ? 133 ILE A CB 1
ATOM 67 C CG1 . ILE A 1 15 ? 10.469 8.970 13.909 1.00 17.09 ? 133 ILE A CG1 1
ATOM 68 C CG2 . ILE A 1 15 ? 8.534 7.584 14.771 1.00 15.13 ? 133 ILE A CG2 1
ATOM 69 C CD1 . ILE A 1 15 ? 10.678 9.792 15.150 1.00 19.85 ? 133 ILE A CD1 1
ATOM 70 N N . ALA A 1 16 ? 10.297 4.499 14.337 1.00 13.23 ? 134 ALA A N 1
ATOM 71 C CA . ALA A 1 16 ? 9.753 3.154 14.490 1.00 12.92 ? 134 ALA A CA 1
ATOM 72 C C . ALA A 1 16 ? 10.407 2.429 15.665 1.00 13.02 ? 134 ALA A C 1
ATOM 73 O O . ALA A 1 16 ? 9.750 1.674 16.385 1.00 13.22 ? 134 ALA A O 1
ATOM 74 C CB . ALA A 1 16 ? 9.928 2.345 13.198 1.00 13.38 ? 134 ALA A CB 1
ATOM 75 N N . VAL A 1 17 ? 11.701 2.681 15.872 1.00 12.50 ? 135 VAL A N 1
ATOM 76 C CA . VAL A 1 17 ? 12.429 2.030 16.954 1.00 11.94 ? 135 VAL A CA 1
ATOM 77 C C . VAL A 1 17 ? 11.992 2.540 18.313 1.00 12.41 ? 135 VAL A C 1
ATOM 78 O O . VAL A 1 17 ? 11.641 1.758 19.188 1.00 13.18 ? 135 VAL A O 1
ATOM 79 C CB . VAL A 1 17 ? 13.951 2.199 16.810 1.00 11.49 ? 135 VAL A CB 1
ATOM 80 C CG1 . VAL A 1 17 ? 14.658 1.722 18.084 1.00 10.51 ? 135 VAL A CG1 1
ATOM 81 C CG2 . VAL A 1 17 ? 14.443 1.431 15.618 1.00 10.56 ? 135 VAL A CG2 1
ATOM 82 N N . VAL A 1 18 ? 11.991 3.856 18.476 1.00 12.69 ? 136 VAL A N 1
ATOM 83 C CA . VAL A 1 18 ? 11.613 4.481 19.734 1.00 13.38 ? 136 VAL A CA 1
ATOM 84 C C . VAL A 1 18 ? 10.152 4.185 20.125 1.00 13.13 ? 136 VAL A C 1
ATOM 85 O O . VAL A 1 18 ? 9.835 4.053 21.316 1.00 12.30 ? 136 VAL A O 1
ATOM 86 C CB . VAL A 1 18 ? 11.880 5.991 19.685 1.00 13.59 ? 136 VAL A CB 1
ATOM 87 C CG1 . VAL A 1 18 ? 11.173 6.726 20.818 1.00 15.64 ? 136 VAL A CG1 1
ATOM 88 C CG2 . VAL A 1 18 ? 13.374 6.247 19.731 1.00 15.12 ? 136 VAL A CG2 1
ATOM 89 N N . GLN A 1 19 ? 9.291 4.016 19.123 1.00 12.73 ? 137 GLN A N 1
ATOM 90 C CA . GLN A 1 19 ? 7.873 3.710 19.368 1.00 13.06 ? 137 GLN A CA 1
ATOM 91 C C . GLN A 1 19 ? 7.630 2.224 19.619 1.00 13.19 ? 137 GLN A C 1
ATOM 92 O O . GLN A 1 19 ? 6.487 1.792 19.855 1.00 13.00 ? 137 GLN A O 1
ATOM 93 C CB . GLN A 1 19 ? 7.004 4.210 18.208 1.00 12.98 ? 137 GLN A CB 1
ATOM 94 C CG . GLN A 1 19 ? 7.035 5.725 18.044 1.00 14.07 ? 137 GLN A CG 1
ATOM 95 C CD . GLN A 1 19 ? 6.055 6.225 16.991 1.00 15.26 ? 137 GLN A CD 1
ATOM 96 O OE1 . GLN A 1 19 ? 5.588 5.459 16.154 1.00 14.86 ? 137 GLN A OE1 1
ATOM 97 N NE2 . GLN A 1 19 ? 5.742 7.510 17.041 1.00 16.79 ? 137 GLN A NE2 1
ATOM 98 N N . GLY A 1 20 ? 8.700 1.435 19.555 1.00 13.60 ? 138 GLY A N 1
ATOM 99 C CA . GLY A 1 20 ? 8.629 0.015 19.843 1.00 14.58 ? 138 GLY A CA 1
ATOM 100 C C . GLY A 1 20 ? 7.747 -0.752 18.881 1.00 14.83 ? 138 GLY A C 1
ATOM 101 O O . GLY A 1 20 ? 7.079 -1.698 19.257 1.00 15.75 ? 138 GLY A O 1
ATOM 102 N N . ASN A 1 21 ? 7.765 -0.354 17.624 1.00 14.88 ? 139 ASN A N 1
ATOM 103 C CA . ASN A 1 21 ? 6.940 -0.992 16.618 1.00 14.60 ? 139 ASN A CA 1
ATOM 104 C C . ASN A 1 21 ? 7.786 -1.900 15.731 1.00 14.68 ? 139 ASN A C 1
ATOM 105 O O . ASN A 1 21 ? 8.239 -1.484 14.661 1.00 14.09 ? 139 ASN A O 1
ATOM 106 C CB . ASN A 1 21 ? 6.250 0.090 15.785 1.00 14.22 ? 139 ASN A CB 1
ATOM 107 C CG . ASN A 1 21 ? 5.149 -0.458 14.896 1.00 14.40 ? 139 ASN A CG 1
ATOM 108 O OD1 . ASN A 1 21 ? 5.148 -1.629 14.534 1.00 13.63 ? 139 ASN A OD1 1
ATOM 109 N ND2 . ASN A 1 21 ? 4.218 0.409 14.516 1.00 13.39 ? 139 ASN A ND2 1
ATOM 110 N N . LEU A 1 22 ? 7.981 -3.146 16.176 1.00 14.99 ? 140 LEU A N 1
ATOM 111 C CA . LEU A 1 22 ? 8.816 -4.114 15.458 1.00 15.78 ? 140 LEU A CA 1
ATOM 112 C C . LEU A 1 22 ? 8.377 -4.359 14.004 1.00 15.73 ? 140 LEU A C 1
ATOM 113 O O . LEU A 1 22 ? 9.210 -4.380 13.106 1.00 15.26 ? 140 LEU A O 1
ATOM 114 C CB . LEU A 1 22 ? 8.918 -5.437 16.238 1.00 16.94 ? 140 LEU A CB 1
ATOM 115 C CG . LEU A 1 22 ? 9.855 -6.534 15.715 1.00 18.13 ? 140 LEU A CG 1
ATOM 116 C CD1 . LEU A 1 22 ? 11.295 -6.108 15.779 1.00 20.05 ? 140 LEU A CD1 1
ATOM 117 C CD2 . LEU A 1 22 ? 9.666 -7.819 16.505 1.00 20.81 ? 140 LEU A CD2 1
ATOM 118 N N . PRO A 1 23 ? 7.079 -4.560 13.772 1.00 15.34 ? 141 PRO A N 1
ATOM 119 C CA . PRO A 1 23 ? 6.576 -4.745 12.405 1.00 15.34 ? 141 PRO A CA 1
ATOM 120 C C . PRO A 1 23 ? 6.957 -3.587 11.475 1.00 15.24 ? 141 PRO A C 1
ATOM 121 O O . PRO A 1 23 ? 7.347 -3.840 10.331 1.00 15.77 ? 141 PRO A O 1
ATOM 122 C CB . PRO A 1 23 ? 5.051 -4.805 12.595 1.00 15.71 ? 141 PRO A CB 1
ATOM 123 C CG . PRO A 1 23 ? 4.867 -5.287 13.988 1.00 15.61 ? 141 PRO A CG 1
ATOM 124 C CD . PRO A 1 23 ? 6.013 -4.684 14.778 1.00 15.53 ? 141 PRO A CD 1
ATOM 125 N N . ALA A 1 24 ? 6.850 -2.345 11.950 1.00 14.96 ? 142 ALA A N 1
ATOM 126 C CA . ALA A 1 24 ? 7.221 -1.188 11.129 1.00 14.29 ? 142 ALA A CA 1
ATOM 127 C C . ALA A 1 24 ? 8.723 -1.188 10.841 1.00 14.83 ? 142 ALA A C 1
ATOM 128 O O . ALA A 1 24 ? 9.158 -0.861 9.726 1.00 14.51 ? 142 ALA A O 1
ATOM 129 C CB . ALA A 1 24 ? 6.795 0.120 11.792 1.00 14.11 ? 142 ALA A CB 1
ATOM 130 N N . VAL A 1 25 ? 9.507 -1.578 11.839 1.00 14.04 ? 143 VAL A N 1
ATOM 131 C CA . VAL A 1 25 ? 10.956 -1.656 11.678 1.00 14.85 ? 143 VAL A CA 1
ATOM 132 C C . VAL A 1 25 ? 11.302 -2.635 10.570 1.00 15.47 ? 143 VAL A C 1
ATOM 133 O O . VAL A 1 25 ? 12.101 -2.328 9.682 1.00 15.51 ? 143 VAL A O 1
ATOM 134 C CB . VAL A 1 25 ? 11.637 -2.099 12.977 1.00 14.70 ? 143 VAL A CB 1
ATOM 135 C CG1 . VAL A 1 25 ? 13.116 -2.441 12.731 1.00 13.78 ? 143 VAL A CG1 1
ATOM 136 C CG2 . VAL A 1 25 ? 11.496 -1.009 14.028 1.00 14.53 ? 143 VAL A CG2 1
ATOM 137 N N . HIS A 1 26 ? 10.691 -3.813 10.621 1.00 15.97 ? 144 HIS A N 1
ATOM 138 C CA . HIS A 1 26 ? 10.917 -4.833 9.612 1.00 17.43 ? 144 HIS A CA 1
ATOM 139 C C . HIS A 1 26 ? 10.580 -4.292 8.220 1.00 17.64 ? 144 HIS A C 1
ATOM 140 O O . HIS A 1 26 ? 11.369 -4.417 7.279 1.00 17.01 ? 144 HIS A O 1
ATOM 141 C CB . HIS A 1 26 ? 10.068 -6.066 9.921 1.00 18.15 ? 144 HIS A CB 1
ATOM 142 C CG . HIS A 1 26 ? 10.567 -7.324 9.282 1.00 21.56 ? 144 HIS A CG 1
ATOM 143 N ND1 . HIS A 1 26 ? 11.433 -8.188 9.918 1.00 23.75 ? 144 HIS A ND1 1
ATOM 144 C CD2 . HIS A 1 26 ? 10.300 -7.879 8.075 1.00 24.66 ? 144 HIS A CD2 1
ATOM 145 C CE1 . HIS A 1 26 ? 11.692 -9.212 9.124 1.00 26.41 ? 144 HIS A CE1 1
ATOM 146 N NE2 . HIS A 1 26 ? 11.014 -9.051 8.000 1.00 26.66 ? 144 HIS A NE2 1
ATOM 147 N N . ARG A 1 27 ? 9.404 -3.691 8.092 1.00 17.43 ? 145 ARG A N 1
ATOM 148 C CA . ARG A 1 27 ? 8.979 -3.137 6.810 1.00 18.36 ? 145 ARG A CA 1
ATOM 149 C C . ARG A 1 27 ? 9.993 -2.121 6.278 1.00 17.91 ? 145 ARG A C 1
ATOM 150 O O . ARG A 1 27 ? 10.398 -2.177 5.107 1.00 17.66 ? 145 ARG A O 1
ATOM 151 C CB . ARG A 1 27 ? 7.597 -2.496 6.947 1.00 18.42 ? 145 ARG A CB 1
ATOM 152 C CG . ARG A 1 27 ? 7.263 -1.461 5.876 1.00 22.14 ? 145 ARG A CG 1
ATOM 153 C CD . ARG A 1 27 ? 5.793 -1.007 5.892 1.00 27.00 ? 145 ARG A CD 1
ATOM 154 N NE . ARG A 1 27 ? 5.532 0.231 6.641 1.00 31.37 ? 145 ARG A NE 1
ATOM 155 C CZ . ARG A 1 27 ? 6.197 0.646 7.723 1.00 33.21 ? 145 ARG A CZ 1
ATOM 156 N NH1 . ARG A 1 27 ? 5.850 1.784 8.310 1.00 34.62 ? 145 ARG A NH1 1
ATOM 157 N NH2 . ARG A 1 27 ? 7.201 -0.062 8.219 1.00 33.52 ? 145 ARG A NH2 1
ATOM 158 N N . LEU A 1 28 ? 10.415 -1.212 7.149 1.00 17.50 ? 146 LEU A N 1
ATOM 159 C CA . LEU A 1 28 ? 11.380 -0.176 6.795 1.00 18.10 ? 146 LEU A CA 1
ATOM 160 C C . LEU A 1 28 ? 12.772 -0.732 6.459 1.00 18.34 ? 146 LEU A C 1
ATOM 161 O O . LEU A 1 28 ? 13.468 -0.208 5.582 1.00 18.02 ? 146 LEU A O 1
ATOM 162 C CB . LEU A 1 28 ? 11.490 0.845 7.926 1.00 18.09 ? 146 LEU A CB 1
ATOM 163 C CG . LEU A 1 28 ? 10.324 1.820 8.044 1.00 18.77 ? 146 LEU A CG 1
ATOM 164 C CD1 . LEU A 1 28 ? 10.438 2.620 9.330 1.00 19.60 ? 146 LEU A CD1 1
ATOM 165 C CD2 . LEU A 1 28 ? 10.298 2.746 6.842 1.00 18.96 ? 146 LEU A CD2 1
ATOM 166 N N . VAL A 1 29 ? 13.186 -1.770 7.174 1.00 18.63 ? 147 VAL A N 1
ATOM 167 C CA . VAL A 1 29 ? 14.468 -2.406 6.887 1.00 19.42 ? 147 VAL A CA 1
ATOM 168 C C . VAL A 1 29 ? 14.457 -3.008 5.472 1.00 20.61 ? 147 VAL A C 1
ATOM 169 O O . VAL A 1 29 ? 15.413 -2.841 4.708 1.00 20.26 ? 147 VAL A O 1
ATOM 170 C CB . VAL A 1 29 ? 14.834 -3.459 7.944 1.00 19.27 ? 147 VAL A CB 1
ATOM 171 C CG1 . VAL A 1 29 ? 15.922 -4.400 7.418 1.00 18.58 ? 147 VAL A CG1 1
ATOM 172 C CG2 . VAL A 1 29 ? 15.283 -2.762 9.244 1.00 18.05 ? 147 VAL A CG2 1
ATOM 173 N N . ASN A 1 30 ? 13.357 -3.670 5.122 1.00 21.91 ? 148 ASN A N 1
ATOM 174 C CA . ASN A 1 30 ? 13.181 -4.208 3.775 1.00 23.66 ? 148 ASN A CA 1
ATOM 175 C C . ASN A 1 30 ? 13.218 -3.103 2.719 1.00 24.03 ? 148 ASN A C 1
ATOM 176 O O . ASN A 1 30 ? 13.863 -3.246 1.682 1.00 24.04 ? 148 ASN A O 1
ATOM 177 C CB . ASN A 1 30 ? 11.870 -5.003 3.674 1.00 24.29 ? 148 ASN A CB 1
ATOM 178 C CG . ASN A 1 30 ? 11.910 -6.297 4.467 1.00 26.38 ? 148 ASN A CG 1
ATOM 179 O OD1 . ASN A 1 30 ? 12.981 -6.875 4.685 1.00 30.20 ? 148 ASN A OD1 1
ATOM 180 N ND2 . ASN A 1 30 ? 10.745 -6.755 4.916 1.00 28.18 ? 148 ASN A ND2 1
ATOM 181 N N . LEU A 1 31 ? 12.536 -1.997 2.997 1.00 24.62 ? 149 LEU A N 1
ATOM 182 C CA . LEU A 1 31 ? 12.507 -0.849 2.093 1.00 25.56 ? 149 LEU A CA 1
ATOM 183 C C . LEU A 1 31 ? 13.896 -0.238 1.889 1.00 25.68 ? 149 LEU A C 1
ATOM 184 O O . LEU A 1 31 ? 14.268 0.113 0.772 1.00 25.52 ? 149 LEU A O 1
ATOM 185 C CB . LEU A 1 31 ? 11.555 0.219 2.629 1.00 25.86 ? 149 LEU A CB 1
ATOM 186 C CG . LEU A 1 31 ? 10.275 0.492 1.841 1.00 28.50 ? 149 LEU A CG 1
ATOM 187 C CD1 . LEU A 1 31 ? 9.052 0.324 2.730 1.00 29.31 ? 149 LEU A CD1 1
ATOM 188 C CD2 . LEU A 1 31 ? 10.321 1.915 1.260 1.00 30.13 ? 149 LEU A CD2 1
ATOM 189 N N . PHE A 1 32 ? 14.651 -0.111 2.976 1.00 25.74 ? 150 PHE A N 1
ATOM 190 C CA . PHE A 1 32 ? 15.996 0.458 2.920 1.00 26.49 ? 150 PHE A CA 1
ATOM 191 C C . PHE A 1 32 ? 16.923 -0.390 2.064 1.00 27.15 ? 150 PHE A C 1
ATOM 192 O O . PHE A 1 32 ? 17.673 0.137 1.237 1.00 27.06 ? 150 PHE A O 1
ATOM 193 C CB . PHE A 1 32 ? 16.593 0.588 4.328 1.00 26.11 ? 150 PHE A CB 1
ATOM 194 C CG . PHE A 1 32 ? 16.256 1.880 5.016 1.00 25.88 ? 150 PHE A CG 1
ATOM 195 C CD1 . PHE A 1 32 ? 14.974 2.401 4.954 1.00 25.42 ? 150 PHE A CD1 1
ATOM 196 C CD2 . PHE A 1 32 ? 17.223 2.574 5.727 1.00 25.18 ? 150 PHE A CD2 1
ATOM 197 C CE1 . PHE A 1 32 ? 14.659 3.592 5.592 1.00 26.11 ? 150 PHE A CE1 1
ATOM 198 C CE2 . PHE A 1 32 ? 16.916 3.766 6.363 1.00 26.35 ? 150 PHE A CE2 1
ATOM 199 C CZ . PHE A 1 32 ? 15.634 4.278 6.294 1.00 25.97 ? 150 PHE A CZ 1
ATOM 200 N N . GLN A 1 33 ? 16.870 -1.697 2.283 1.00 27.96 ? 151 GLN A N 1
ATOM 201 C CA . GLN A 1 33 ? 17.723 -2.651 1.581 1.00 29.27 ? 151 GLN A CA 1
ATOM 202 C C . GLN A 1 33 ? 17.431 -2.708 0.085 1.00 29.90 ? 151 GLN A C 1
ATOM 203 O O . GLN A 1 33 ? 18.328 -2.946 -0.718 1.00 30.15 ? 151 GLN A O 1
ATOM 204 C CB . GLN A 1 33 ? 17.592 -4.041 2.201 1.00 29.20 ? 151 GLN A CB 1
ATOM 205 C CG . GLN A 1 33 ? 18.166 -4.152 3.607 1.00 30.72 ? 151 GLN A CG 1
ATOM 206 C CD . GLN A 1 33 ? 18.070 -5.557 4.169 1.00 31.93 ? 151 GLN A CD 1
ATOM 207 O OE1 . GLN A 1 33 ? 18.974 -6.010 4.876 1.00 33.15 ? 151 GLN A OE1 1
ATOM 208 N NE2 . GLN A 1 33 ? 16.979 -6.252 3.856 1.00 32.13 ? 151 GLN A NE2 1
ATOM 209 N N . GLN A 1 34 ? 16.178 -2.473 -0.286 1.00 30.37 ? 152 GLN A N 1
ATOM 210 C CA . GLN A 1 34 ? 15.790 -2.471 -1.690 1.00 30.93 ? 152 GLN A CA 1
ATOM 211 C C . GLN A 1 34 ? 16.376 -1.271 -2.423 1.00 31.15 ? 152 GLN A C 1
ATOM 212 O O . GLN A 1 34 ? 16.602 -1.323 -3.633 1.00 31.44 ? 152 GLN A O 1
ATOM 213 C CB . GLN A 1 34 ? 14.269 -2.457 -1.826 1.00 31.08 ? 152 GLN A CB 1
ATOM 214 C CG . GLN A 1 34 ? 13.594 -3.742 -1.404 1.00 31.87 ? 152 GLN A CG 1
ATOM 215 C CD . GLN A 1 34 ? 12.090 -3.698 -1.617 1.00 33.49 ? 152 GLN A CD 1
ATOM 216 O OE1 . GLN A 1 34 ? 11.265 -4.331 -0.761 0.00 35.08 ? 152 GLN A OE1 1
ATOM 217 N NE2 . GLN A 1 34 ? 11.649 -2.819 -2.514 1.00 33.82 ? 152 GLN A NE2 1
ATOM 218 N N . GLY A 1 35 ? 16.626 -0.190 -1.689 1.00 31.08 ? 153 GLY A N 1
ATOM 219 C CA . GLY A 1 35 ? 17.141 1.027 -2.287 1.00 31.13 ? 153 GLY A CA 1
ATOM 220 C C . GLY A 1 35 ? 18.617 1.273 -2.034 1.00 31.26 ? 153 GLY A C 1
ATOM 221 O O . GLY A 1 35 ? 19.126 2.366 -2.295 1.00 31.27 ? 153 GLY A O 1
ATOM 222 N N . GLY A 1 36 ? 19.303 0.263 -1.519 1.00 31.01 ? 154 GLY A N 1
ATOM 223 C CA . GLY A 1 36 ? 20.720 0.374 -1.226 1.00 31.13 ? 154 GLY A CA 1
ATOM 224 C C . GLY A 1 36 ? 21.060 1.340 -0.101 1.00 30.84 ? 154 GLY A C 1
ATOM 225 O O . GLY A 1 36 ? 22.220 1.711 0.069 1.00 31.27 ? 154 GLY A O 1
ATOM 226 N N . ARG A 1 37 ? 20.057 1.739 0.675 1.00 30.41 ? 155 ARG A N 1
ATOM 227 C CA . ARG A 1 37 ? 20.274 2.678 1.774 1.00 29.90 ? 155 ARG A CA 1
ATOM 228 C C . ARG A 1 37 ? 20.903 1.993 2.981 1.00 29.15 ? 155 ARG A C 1
ATOM 229 O O . ARG A 1 37 ? 20.572 0.852 3.299 1.00 28.95 ? 155 ARG A O 1
ATOM 230 C CB . ARG A 1 37 ? 18.959 3.335 2.193 1.00 30.33 ? 155 ARG A CB 1
ATOM 231 C CG . ARG A 1 37 ? 18.149 3.901 1.050 1.00 32.20 ? 155 ARG A CG 1
ATOM 232 C CD . ARG A 1 37 ? 16.758 4.347 1.453 1.00 35.15 ? 155 ARG A CD 1
ATOM 233 N NE . ARG A 1 37 ? 16.786 5.323 2.538 1.00 37.40 ? 155 ARG A NE 1
ATOM 234 C CZ . ARG A 1 37 ? 15.715 5.964 2.983 1.00 38.95 ? 155 ARG A CZ 1
ATOM 235 N NH1 . ARG A 1 37 ? 14.525 5.725 2.436 1.00 39.28 ? 155 ARG A NH1 1
ATOM 236 N NH2 . ARG A 1 37 ? 15.827 6.842 3.974 1.00 39.32 ? 155 ARG A NH2 1
ATOM 237 N N . GLU A 1 38 ? 21.814 2.700 3.644 1.00 28.27 ? 156 GLU A N 1
ATOM 238 C CA . GLU A 1 38 ? 22.452 2.211 4.857 1.00 27.47 ? 156 GLU A CA 1
ATOM 239 C C . GLU A 1 38 ? 21.452 2.181 6.005 1.00 26.28 ? 156 GLU A C 1
ATOM 240 O O . GLU A 1 38 ? 20.561 3.025 6.079 1.00 26.02 ? 156 GLU A O 1
ATOM 241 C CB . GLU A 1 38 ? 23.617 3.126 5.245 1.00 27.95 ? 156 GLU A CB 1
ATOM 242 C CG . GLU A 1 38 ? 24.790 3.101 4.284 1.00 30.01 ? 156 GLU A CG 1
ATOM 243 C CD . GLU A 1 38 ? 25.543 1.784 4.325 1.00 32.83 ? 156 GLU A CD 1
ATOM 244 O OE1 . GLU A 1 38 ? 26.203 1.500 5.349 1.00 34.01 ? 156 GLU A OE1 1
ATOM 245 O OE2 . GLU A 1 38 ? 25.466 1.025 3.338 1.00 34.86 ? 156 GLU A OE2 1
ATOM 246 N N . LEU A 1 39 ? 21.607 1.215 6.905 1.00 25.02 ? 157 LEU A N 1
ATOM 247 C CA . LEU A 1 39 ? 20.780 1.144 8.103 1.00 23.74 ? 157 LEU A CA 1
ATOM 248 C C . LEU A 1 39 ? 21.403 1.991 9.200 1.00 23.30 ? 157 LEU A C 1
ATOM 249 O O . LEU A 1 39 ? 20.738 2.377 10.156 1.00 22.92 ? 157 LEU A O 1
ATOM 250 C CB . LEU A 1 39 ? 20.658 -0.295 8.592 1.00 23.79 ? 157 LEU A CB 1
ATOM 251 C CG . LEU A 1 39 ? 19.878 -1.264 7.716 1.00 22.90 ? 157 LEU A CG 1
ATOM 252 C CD1 . LEU A 1 39 ? 19.731 -2.592 8.446 1.00 24.16 ? 157 LEU A CD1 1
ATOM 253 C CD2 . LEU A 1 39 ? 18.523 -0.683 7.382 1.00 23.61 ? 157 LEU A CD2 1
ATOM 254 N N . ASP A 1 40 ? 22.696 2.262 9.065 1.00 22.79 ? 158 ASP A N 1
ATOM 255 C CA . ASP A 1 40 ? 23.409 3.066 10.047 1.00 22.10 ? 158 ASP A CA 1
ATOM 256 C C . ASP A 1 40 ? 23.363 4.537 9.678 1.00 21.41 ? 158 ASP A C 1
ATOM 257 O O . ASP A 1 40 ? 24.391 5.147 9.379 1.00 21.76 ? 158 ASP A O 1
ATOM 258 C CB . ASP A 1 40 ? 24.854 2.592 10.186 1.00 22.64 ? 158 ASP A CB 1
ATOM 259 C CG . ASP A 1 40 ? 24.960 1.259 10.911 1.00 24.08 ? 158 ASP A CG 1
ATOM 260 O OD1 . ASP A 1 40 ? 24.155 1.017 11.844 1.00 25.87 ? 158 ASP A OD1 1
ATOM 261 O OD2 . ASP A 1 40 ? 25.817 0.395 10.624 1.00 26.00 ? 158 ASP A OD2 1
ATOM 262 N N . ILE A 1 41 ? 22.155 5.091 9.682 1.00 20.09 ? 159 ILE A N 1
ATOM 263 C CA . ILE A 1 41 ? 21.938 6.494 9.380 1.00 19.28 ? 159 ILE A CA 1
ATOM 264 C C . ILE A 1 41 ? 21.795 7.275 10.674 1.00 18.08 ? 159 ILE A C 1
ATOM 265 O O . ILE A 1 41 ? 21.073 6.876 11.580 1.00 17.49 ? 159 ILE A O 1
ATOM 266 C CB . ILE A 1 41 ? 20.688 6.682 8.504 1.00 19.93 ? 159 ILE A CB 1
ATOM 267 C CG1 . ILE A 1 41 ? 19.521 5.844 9.028 1.00 20.91 ? 159 ILE A CG1 1
ATOM 268 C CG2 . ILE A 1 41 ? 20.996 6.303 7.060 1.00 21.06 ? 159 ILE A CG2 1
ATOM 269 C CD1 . ILE A 1 41 ? 19.319 4.556 8.278 1.00 25.27 ? 159 ILE A CD1 1
ATOM 270 N N . TYR A 1 42 ? 22.500 8.384 10.757 1.00 16.86 ? 160 TYR A N 1
ATOM 271 C CA . TYR A 1 42 ? 22.495 9.205 11.958 1.00 16.84 ? 160 TYR A CA 1
ATOM 272 C C . TYR A 1 42 ? 21.377 10.249 11.979 1.00 16.50 ? 160 TYR A C 1
ATOM 273 O O . TYR A 1 42 ? 21.040 10.821 10.946 1.00 16.48 ? 160 TYR A O 1
ATOM 274 C CB . TYR A 1 42 ? 23.831 9.935 12.068 1.00 16.89 ? 160 TYR A CB 1
ATOM 275 C CG . TYR A 1 42 ? 25.010 9.064 12.450 1.00 17.94 ? 160 TYR A CG 1
ATOM 276 C CD1 . TYR A 1 42 ? 25.109 8.522 13.722 1.00 19.18 ? 160 TYR A CD1 1
ATOM 277 C CD2 . TYR A 1 42 ? 26.042 8.816 11.547 1.00 21.22 ? 160 TYR A CD2 1
ATOM 278 C CE1 . TYR A 1 42 ? 26.198 7.740 14.093 1.00 19.71 ? 160 TYR A CE1 1
ATOM 279 C CE2 . TYR A 1 42 ? 27.142 8.037 11.909 1.00 22.80 ? 160 TYR A CE2 1
ATOM 280 C CZ . TYR A 1 42 ? 27.209 7.507 13.192 1.00 22.08 ? 160 TYR A CZ 1
ATOM 281 O OH . TYR A 1 42 ? 28.286 6.735 13.574 1.00 23.30 ? 160 TYR A OH 1
ATOM 282 N N . ASN A 1 43 ? 20.799 10.483 13.158 1.00 16.23 ? 161 ASN A N 1
ATOM 283 C CA . ASN A 1 43 ? 19.926 11.640 13.362 1.00 16.31 ? 161 ASN A CA 1
ATOM 284 C C . ASN A 1 43 ? 20.830 12.791 13.831 1.00 16.96 ? 161 ASN A C 1
ATOM 285 O O . ASN A 1 43 ? 22.054 12.661 13.799 1.00 16.32 ? 161 ASN A O 1
ATOM 286 C CB . ASN A 1 43 ? 18.797 11.339 14.373 1.00 16.19 ? 161 ASN A CB 1
ATOM 287 C CG . ASN A 1 43 ? 19.325 10.999 15.763 1.00 15.06 ? 161 ASN A CG 1
ATOM 288 O OD1 . ASN A 1 43 ? 20.495 11.196 16.045 1.00 13.15 ? 161 ASN A OD1 1
ATOM 289 N ND2 . ASN A 1 43 ? 18.452 10.487 16.634 1.00 14.28 ? 161 ASN A ND2 1
ATOM 290 N N . ASN A 1 44 ? 20.260 13.911 14.270 1.00 17.48 ? 162 ASN A N 1
ATOM 291 C CA . ASN A 1 44 ? 21.104 15.045 14.655 1.00 18.53 ? 162 ASN A CA 1
ATOM 292 C C . ASN A 1 44 ? 21.778 14.902 15.999 1.00 18.49 ? 162 ASN A C 1
ATOM 293 O O . ASN A 1 44 ? 22.580 15.750 16.397 1.00 19.37 ? 162 ASN A O 1
ATOM 294 C CB . ASN A 1 44 ? 20.341 16.359 14.577 1.00 18.99 ? 162 ASN A CB 1
ATOM 295 C CG . ASN A 1 44 ? 20.234 16.851 13.183 1.00 20.84 ? 162 ASN A CG 1
ATOM 296 O OD1 . ASN A 1 44 ? 19.534 16.260 12.362 1.00 24.15 ? 162 ASN A OD1 1
ATOM 297 N ND2 . ASN A 1 44 ? 20.955 17.912 12.876 1.00 22.03 ? 162 ASN A ND2 1
ATOM 298 N N . LEU A 1 45 ? 21.467 13.811 16.679 1.00 18.08 ? 163 LEU A N 1
ATOM 299 C CA . LEU A 1 45 ? 22.081 13.491 17.962 1.00 17.73 ? 163 LEU A CA 1
ATOM 300 C C . LEU A 1 45 ? 23.191 12.482 17.763 1.00 16.98 ? 163 LEU A C 1
ATOM 301 O O . LEU A 1 45 ? 23.794 12.004 18.722 1.00 17.30 ? 163 LEU A O 1
ATOM 302 C CB . LEU A 1 45 ? 21.024 12.932 18.914 1.00 17.68 ? 163 LEU A CB 1
ATOM 303 C CG . LEU A 1 45 ? 20.010 13.984 19.354 1.00 18.06 ? 163 LEU A CG 1
ATOM 304 C CD1 . LEU A 1 45 ? 18.869 13.350 20.142 1.00 18.34 ? 163 LEU A CD1 1
ATOM 305 C CD2 . LEU A 1 45 ? 20.717 15.049 20.183 1.00 17.95 ? 163 LEU A CD2 1
ATOM 306 N N . ARG A 1 46 ? 23.473 12.181 16.504 1.00 16.65 ? 164 ARG A N 1
ATOM 307 C CA . ARG A 1 46 ? 24.469 11.176 16.138 1.00 15.93 ? 164 ARG A CA 1
ATOM 308 C C . ARG A 1 46 ? 24.139 9.782 16.682 1.00 15.28 ? 164 ARG A C 1
ATOM 309 O O . ARG A 1 46 ? 25.025 9.052 17.155 1.00 15.08 ? 164 ARG A O 1
ATOM 310 C CB . ARG A 1 46 ? 25.889 11.602 16.532 1.00 16.41 ? 164 ARG A CB 1
ATOM 311 C CG . ARG A 1 46 ? 26.935 10.771 15.830 1.00 17.84 ? 164 ARG A CG 1
ATOM 312 C CD . ARG A 1 46 ? 28.353 11.182 16.078 1.00 22.08 ? 164 ARG A CD 1
ATOM 313 N NE . ARG A 1 46 ? 28.687 12.439 15.422 1.00 23.71 ? 164 ARG A NE 1
ATOM 314 C CZ . ARG A 1 46 ? 29.739 13.167 15.742 1.00 24.53 ? 164 ARG A CZ 1
ATOM 315 N NH1 . ARG A 1 46 ? 30.550 12.749 16.702 1.00 25.25 ? 164 ARG A NH1 1
ATOM 316 N NH2 . ARG A 1 46 ? 29.988 14.304 15.109 1.00 25.82 ? 164 ARG A NH2 1
ATOM 317 N N . GLN A 1 47 ? 22.860 9.424 16.607 1.00 13.96 ? 165 GLN A N 1
ATOM 318 C CA . GLN A 1 47 ? 22.394 8.092 16.963 1.00 13.49 ? 165 GLN A CA 1
ATOM 319 C C . GLN A 1 47 ? 21.904 7.374 15.716 1.00 12.98 ? 165 GLN A C 1
ATOM 320 O O . GLN A 1 47 ? 21.183 7.953 14.904 1.00 12.99 ? 165 GLN A O 1
ATOM 321 C CB . GLN A 1 47 ? 21.210 8.174 17.938 1.00 13.71 ? 165 GLN A CB 1
ATOM 322 C CG . GLN A 1 47 ? 21.439 9.048 19.154 1.00 13.58 ? 165 GLN A CG 1
ATOM 323 C CD . GLN A 1 47 ? 20.169 9.272 19.949 1.00 13.58 ? 165 GLN A CD 1
ATOM 324 O OE1 . GLN A 1 47 ? 19.118 9.567 19.380 1.00 15.18 ? 165 GLN A OE1 1
ATOM 325 N NE2 . GLN A 1 47 ? 20.259 9.127 21.263 1.00 14.74 ? 165 GLN A NE2 1
ATOM 326 N N . THR A 1 48 ? 22.290 6.115 15.565 1.00 12.27 ? 166 THR A N 1
ATOM 327 C CA . THR A 1 48 ? 21.708 5.267 14.540 1.00 11.74 ? 166 THR A CA 1
ATOM 328 C C . THR A 1 48 ? 20.495 4.602 15.157 1.00 11.33 ? 166 THR A C 1
ATOM 329 O O . THR A 1 48 ? 20.302 4.660 16.374 1.00 11.34 ? 166 THR A O 1
ATOM 330 C CB . THR A 1 48 ? 22.689 4.174 14.103 1.00 11.75 ? 166 THR A CB 1
ATOM 331 O OG1 . THR A 1 48 ? 22.977 3.311 15.216 1.00 12.05 ? 166 THR A OG1 1
ATOM 332 C CG2 . THR A 1 48 ? 24.054 4.766 13.726 1.00 12.04 ? 166 THR A CG2 1
ATOM 333 N N . PRO A 1 49 ? 19.660 3.989 14.329 1.00 10.65 ? 167 PRO A N 1
ATOM 334 C CA . PRO A 1 49 ? 18.538 3.191 14.836 1.00 10.32 ? 167 PRO A CA 1
ATOM 335 C C . PRO A 1 49 ? 18.974 2.101 15.830 1.00 10.25 ? 167 PRO A C 1
ATOM 336 O O . PRO A 1 49 ? 18.247 1.853 16.794 1.00 9.36 ? 167 PRO A O 1
ATOM 337 C CB . PRO A 1 49 ? 17.948 2.583 13.567 1.00 10.89 ? 167 PRO A CB 1
ATOM 338 C CG . PRO A 1 49 ? 18.218 3.620 12.528 1.00 10.71 ? 167 PRO A CG 1
ATOM 339 C CD . PRO A 1 49 ? 19.642 4.102 12.858 1.00 10.72 ? 167 PRO A CD 1
ATOM 340 N N . LEU A 1 50 ? 20.156 1.500 15.635 1.00 9.34 ? 168 LEU A N 1
ATOM 341 C CA . LEU A 1 50 ? 20.632 0.470 16.554 1.00 9.46 ? 168 LEU A CA 1
ATOM 342 C C . LEU A 1 50 ? 20.935 1.055 17.938 1.00 9.67 ? 168 LEU A C 1
ATOM 343 O O . LEU A 1 50 ? 20.592 0.452 18.962 1.00 9.47 ? 168 LEU A O 1
ATOM 344 C CB . LEU A 1 50 ? 21.863 -0.264 15.989 1.00 9.47 ? 168 LEU A CB 1
ATOM 345 C CG . LEU A 1 50 ? 22.484 -1.387 16.841 1.00 9.85 ? 168 LEU A CG 1
ATOM 346 C CD1 . LEU A 1 50 ? 21.452 -2.485 17.161 1.00 10.96 ? 168 LEU A CD1 1
ATOM 347 C CD2 . LEU A 1 50 ? 23.678 -1.973 16.139 1.00 9.52 ? 168 LEU A CD2 1
ATOM 348 N N . HIS A 1 51 ? 21.584 2.216 17.967 1.00 9.81 ? 169 HIS A N 1
ATOM 349 C CA . HIS A 1 51 ? 21.850 2.894 19.228 1.00 10.69 ? 169 HIS A CA 1
ATOM 350 C C . HIS A 1 51 ? 20.525 3.059 19.956 1.00 10.73 ? 169 HIS A C 1
ATOM 351 O O . HIS A 1 51 ? 20.433 2.827 21.156 1.00 10.57 ? 169 HIS A O 1
ATOM 352 C CB . HIS A 1 51 ? 22.436 4.293 19.000 1.00 10.78 ? 169 HIS A CB 1
ATOM 353 C CG . HIS A 1 51 ? 23.822 4.303 18.421 1.00 12.30 ? 169 HIS A CG 1
ATOM 354 N ND1 . HIS A 1 51 ? 24.834 3.479 18.868 1.00 16.39 ? 169 HIS A ND1 1
ATOM 355 C CD2 . HIS A 1 51 ? 24.369 5.076 17.453 1.00 13.01 ? 169 HIS A CD2 1
ATOM 356 C CE1 . HIS A 1 51 ? 25.937 3.729 18.185 1.00 13.62 ? 169 HIS A CE1 1
ATOM 357 N NE2 . HIS A 1 51 ? 25.681 4.690 17.317 1.00 15.57 ? 169 HIS A NE2 1
ATOM 358 N N . LEU A 1 52 ? 19.506 3.503 19.220 1.00 10.93 ? 170 LEU A N 1
ATOM 359 C CA . LEU A 1 52 ? 18.191 3.751 19.804 1.00 11.11 ? 170 LEU A CA 1
ATOM 360 C C . LEU A 1 52 ? 17.516 2.481 20.317 1.00 11.15 ? 170 LEU A C 1
ATOM 361 O O . LEU A 1 52 ? 16.811 2.505 21.333 1.00 11.05 ? 170 LEU A O 1
ATOM 362 C CB . LEU A 1 52 ? 17.290 4.484 18.809 1.00 11.71 ? 170 LEU A CB 1
ATOM 363 C CG . LEU A 1 52 ? 17.631 5.969 18.665 1.00 12.43 ? 170 LEU A CG 1
ATOM 364 C CD1 . LEU A 1 52 ? 16.716 6.656 17.634 1.00 14.28 ? 170 LEU A CD1 1
ATOM 365 C CD2 . LEU A 1 52 ? 17.545 6.655 20.018 1.00 14.70 ? 170 LEU A CD2 1
ATOM 366 N N . ALA A 1 53 ? 17.737 1.374 19.621 1.00 10.87 ? 171 ALA A N 1
ATOM 367 C CA . ALA A 1 53 ? 17.175 0.097 20.039 1.00 11.54 ? 171 ALA A CA 1
ATOM 368 C C . ALA A 1 53 ? 17.744 -0.327 21.386 1.00 12.29 ? 171 ALA A C 1
ATOM 369 O O . ALA A 1 53 ? 17.029 -0.886 22.211 1.00 12.47 ? 171 ALA A O 1
ATOM 370 C CB . ALA A 1 53 ? 17.430 -0.965 18.998 1.00 11.41 ? 171 ALA A CB 1
ATOM 371 N N . VAL A 1 54 ? 19.030 -0.064 21.601 1.00 12.53 ? 172 VAL A N 1
ATOM 372 C CA . VAL A 1 54 ? 19.675 -0.406 22.865 1.00 13.94 ? 172 VAL A CA 1
ATOM 373 C C . VAL A 1 54 ? 19.220 0.551 23.965 1.00 14.79 ? 172 VAL A C 1
ATOM 374 O O . VAL A 1 54 ? 18.905 0.135 25.088 1.00 15.02 ? 172 VAL A O 1
ATOM 375 C CB . VAL A 1 54 ? 21.199 -0.335 22.748 1.00 14.08 ? 172 VAL A CB 1
ATOM 376 C CG1 . VAL A 1 54 ? 21.848 -0.514 24.119 1.00 14.51 ? 172 VAL A CG1 1
ATOM 377 C CG2 . VAL A 1 54 ? 21.701 -1.370 21.760 1.00 14.02 ? 172 VAL A CG2 1
ATOM 378 N N . ILE A 1 55 ? 19.166 1.833 23.631 1.00 15.88 ? 173 ILE A N 1
ATOM 379 C CA . ILE A 1 55 ? 18.738 2.853 24.578 1.00 17.35 ? 173 ILE A CA 1
ATOM 380 C C . ILE A 1 55 ? 17.278 2.641 25.016 1.00 17.60 ? 173 ILE A C 1
ATOM 381 O O . ILE A 1 55 ? 16.927 2.906 26.160 1.00 17.93 ? 173 ILE A O 1
ATOM 382 C CB . ILE A 1 55 ? 18.923 4.258 23.959 1.00 17.28 ? 173 ILE A CB 1
ATOM 383 C CG1 . ILE A 1 55 ? 20.398 4.675 23.987 1.00 18.52 ? 173 ILE A CG1 1
ATOM 384 C CG2 . ILE A 1 55 ? 18.049 5.283 24.673 1.00 18.61 ? 173 ILE A CG2 1
ATOM 385 C CD1 . ILE A 1 55 ? 20.766 5.697 22.917 1.00 20.02 ? 173 ILE A CD1 1
ATOM 386 N N . THR A 1 56 ? 16.439 2.159 24.105 1.00 18.03 ? 174 THR A N 1
ATOM 387 C CA . THR A 1 56 ? 15.022 1.920 24.408 1.00 18.76 ? 174 THR A CA 1
ATOM 388 C C . THR A 1 56 ? 14.831 0.572 25.117 1.00 18.61 ? 174 THR A C 1
ATOM 389 O O . THR A 1 56 ? 13.763 0.294 25.653 1.00 18.39 ? 174 THR A O 1
ATOM 390 C CB . THR A 1 56 ? 14.158 1.937 23.112 1.00 18.31 ? 174 THR A CB 1
ATOM 391 O OG1 . THR A 1 56 ? 14.370 3.151 22.382 1.00 20.05 ? 174 THR A OG1 1
ATOM 392 C CG2 . THR A 1 56 ? 12.668 2.011 23.454 1.00 20.12 ? 174 THR A CG2 1
ATOM 393 N N . THR A 1 57 ? 15.888 -0.239 25.128 1.00 18.58 ? 175 THR A N 1
ATOM 394 C CA . THR A 1 57 ? 15.860 -1.619 25.642 1.00 18.91 ? 175 THR A CA 1
ATOM 395 C C . THR A 1 57 ? 14.914 -2.542 24.864 1.00 18.02 ? 175 THR A C 1
ATOM 396 O O . THR A 1 57 ? 13.974 -3.099 25.415 1.00 18.91 ? 175 THR A O 1
ATOM 397 C CB . THR A 1 57 ? 15.586 -1.686 27.166 1.00 19.44 ? 175 THR A CB 1
ATOM 398 O OG1 . THR A 1 57 ? 14.238 -1.274 27.451 1.00 21.18 ? 175 THR A OG1 1
ATOM 399 C CG2 . THR A 1 57 ? 16.445 -0.677 27.902 1.00 21.00 ? 175 THR A CG2 1
ATOM 400 N N . LEU A 1 58 ? 15.193 -2.708 23.580 1.00 17.03 ? 176 LEU A N 1
ATOM 401 C CA . LEU A 1 58 ? 14.396 -3.565 22.709 1.00 15.97 ? 176 LEU A CA 1
ATOM 402 C C . LEU A 1 58 ? 15.273 -4.645 22.089 1.00 15.32 ? 176 LEU A C 1
ATOM 403 O O . LEU A 1 58 ? 15.702 -4.519 20.938 1.00 15.01 ? 176 LEU A O 1
ATOM 404 C CB . LEU A 1 58 ? 13.770 -2.722 21.602 1.00 15.59 ? 176 LEU A CB 1
ATOM 405 C CG . LEU A 1 58 ? 12.773 -1.657 22.050 1.00 16.20 ? 176 LEU A CG 1
ATOM 406 C CD1 . LEU A 1 58 ? 12.479 -0.681 20.907 1.00 15.65 ? 176 LEU A CD1 1
ATOM 407 C CD2 . LEU A 1 58 ? 11.488 -2.320 22.550 1.00 16.18 ? 176 LEU A CD2 1
ATOM 408 N N . PRO A 1 59 ? 15.535 -5.711 22.839 1.00 15.17 ? 177 PRO A N 1
ATOM 409 C CA . PRO A 1 59 ? 16.418 -6.785 22.366 1.00 14.63 ? 177 PRO A CA 1
ATOM 410 C C . PRO A 1 59 ? 15.993 -7.385 21.014 1.00 14.33 ? 177 PRO A C 1
ATOM 411 O O . PRO A 1 59 ? 16.852 -7.663 20.171 1.00 14.10 ? 177 PRO A O 1
ATOM 412 C CB . PRO A 1 59 ? 16.337 -7.823 23.490 1.00 15.81 ? 177 PRO A CB 1
ATOM 413 C CG . PRO A 1 59 ? 15.076 -7.472 24.235 1.00 16.55 ? 177 PRO A CG 1
ATOM 414 C CD . PRO A 1 59 ? 15.005 -5.983 24.188 1.00 15.35 ? 177 PRO A CD 1
ATOM 415 N N . SER A 1 60 ? 14.691 -7.548 20.781 1.00 13.42 ? 178 SER A N 1
ATOM 416 C CA . SER A 1 60 ? 14.239 -8.102 19.504 1.00 12.99 ? 178 SER A CA 1
ATOM 417 C C . SER A 1 60 ? 14.579 -7.200 18.317 1.00 12.50 ? 178 SER A C 1
ATOM 418 O O . SER A 1 60 ? 14.858 -7.685 17.222 1.00 12.15 ? 178 SER A O 1
ATOM 419 C CB . SER A 1 60 ? 12.737 -8.359 19.516 1.00 13.11 ? 178 SER A CB 1
ATOM 420 O OG A SER A 1 60 ? 12.415 -9.420 20.390 0.72 13.35 ? 178 SER A OG 1
ATOM 421 O OG B SER A 1 60 ? 12.316 -8.813 18.243 0.28 13.19 ? 178 SER A OG 1
ATOM 422 N N . VAL A 1 61 ? 14.526 -5.889 18.534 1.00 12.11 ? 179 VAL A N 1
ATOM 423 C CA . VAL A 1 61 ? 14.869 -4.935 17.489 1.00 12.06 ? 179 VAL A CA 1
ATOM 424 C C . VAL A 1 61 ? 16.378 -4.940 17.241 1.00 12.49 ? 179 VAL A C 1
ATOM 425 O O . VAL A 1 61 ? 16.838 -4.865 16.091 1.00 11.22 ? 179 VAL A O 1
ATOM 426 C CB . VAL A 1 61 ? 14.363 -3.531 17.834 1.00 12.35 ? 179 VAL A CB 1
ATOM 427 C CG1 A VAL A 1 61 ? 14.647 -2.555 16.699 0.50 12.35 ? 179 VAL A CG1 1
ATOM 428 C CG1 B VAL A 1 61 ? 14.950 -2.495 16.885 0.50 12.14 ? 179 VAL A CG1 1
ATOM 429 C CG2 A VAL A 1 61 ? 12.864 -3.579 18.143 0.50 11.95 ? 179 VAL A CG2 1
ATOM 430 C CG2 B VAL A 1 61 ? 12.837 -3.502 17.793 0.50 12.08 ? 179 VAL A CG2 1
ATOM 431 N N . VAL A 1 62 ? 17.142 -5.043 18.323 1.00 12.45 ? 180 VAL A N 1
ATOM 432 C CA . VAL A 1 62 ? 18.592 -5.122 18.220 1.00 12.90 ? 180 VAL A CA 1
ATOM 433 C C . VAL A 1 62 ? 18.977 -6.293 17.309 1.00 13.14 ? 180 VAL A C 1
ATOM 434 O O . VAL A 1 62 ? 19.798 -6.152 16.404 1.00 13.22 ? 180 VAL A O 1
ATOM 435 C CB . VAL A 1 62 ? 19.238 -5.333 19.601 1.00 12.80 ? 180 VAL A CB 1
ATOM 436 C CG1 . VAL A 1 62 ? 20.720 -5.710 19.454 1.00 12.92 ? 180 VAL A CG1 1
ATOM 437 C CG2 . VAL A 1 62 ? 19.072 -4.084 20.488 1.00 12.78 ? 180 VAL A CG2 1
ATOM 438 N N . ARG A 1 63 ? 18.375 -7.449 17.560 1.00 13.74 ? 181 ARG A N 1
ATOM 439 C CA . ARG A 1 63 ? 18.631 -8.659 16.777 1.00 13.82 ? 181 ARG A CA 1
ATOM 440 C C . ARG A 1 63 ? 18.310 -8.487 15.289 1.00 13.58 ? 181 ARG A C 1
ATOM 441 O O . ARG A 1 63 ? 19.083 -8.902 14.422 1.00 13.39 ? 181 ARG A O 1
ATOM 442 C CB . ARG A 1 63 ? 17.804 -9.833 17.326 1.00 14.51 ? 181 ARG A CB 1
ATOM 443 C CG . ARG A 1 63 ? 18.294 -10.406 18.665 1.00 16.84 ? 181 ARG A CG 1
ATOM 444 C CD . ARG A 1 63 ? 17.612 -11.724 19.075 1.00 20.98 ? 181 ARG A CD 1
ATOM 445 N NE . ARG A 1 63 ? 17.951 -12.108 20.452 1.00 25.13 ? 181 ARG A NE 1
ATOM 446 C CZ . ARG A 1 63 ? 18.974 -12.891 20.779 1.00 26.84 ? 181 ARG A CZ 1
ATOM 447 N NH1 . ARG A 1 63 ? 19.762 -13.377 19.832 1.00 27.88 ? 181 ARG A NH1 1
ATOM 448 N NH2 . ARG A 1 63 ? 19.217 -13.184 22.054 1.00 28.14 ? 181 ARG A NH2 1
ATOM 449 N N . LEU A 1 64 ? 17.148 -7.912 15.002 1.00 12.74 ? 182 LEU A N 1
ATOM 450 C CA . LEU A 1 64 ? 16.718 -7.679 13.622 1.00 12.90 ? 182 LEU A CA 1
ATOM 451 C C . LEU A 1 64 ? 17.706 -6.772 12.897 1.00 12.33 ? 182 LEU A C 1
ATOM 452 O O . LEU A 1 64 ? 18.152 -7.081 11.791 1.00 12.11 ? 182 LEU A O 1
ATOM 453 C CB A LEU A 1 64 ? 15.318 -7.052 13.586 0.50 12.91 ? 182 LEU A CB 1
ATOM 454 C CB B LEU A 1 64 ? 15.315 -7.052 13.616 0.50 13.01 ? 182 LEU A CB 1
ATOM 455 C CG A LEU A 1 64 ? 14.716 -6.709 12.213 0.50 13.45 ? 182 LEU A CG 1
ATOM 456 C CG B LEU A 1 64 ? 14.549 -6.841 12.300 0.50 13.89 ? 182 LEU A CG 1
ATOM 457 C CD1 A LEU A 1 64 ? 13.250 -6.322 12.353 0.50 13.18 ? 182 LEU A CD1 1
ATOM 458 C CD1 B LEU A 1 64 ? 14.950 -5.545 11.615 0.50 14.93 ? 182 LEU A CD1 1
ATOM 459 C CD2 A LEU A 1 64 ? 15.494 -5.597 11.517 0.50 14.52 ? 182 LEU A CD2 1
ATOM 460 C CD2 B LEU A 1 64 ? 14.701 -8.027 11.369 0.50 14.37 ? 182 LEU A CD2 1
ATOM 461 N N . LEU A 1 65 ? 18.044 -5.656 13.531 1.00 11.62 ? 183 LEU A N 1
ATOM 462 C CA . LEU A 1 65 ? 18.928 -4.671 12.925 1.00 11.97 ? 183 LEU A CA 1
ATOM 463 C C . LEU A 1 65 ? 20.331 -5.214 12.686 1.00 12.24 ? 183 LEU A C 1
ATOM 464 O O . LEU A 1 65 ? 20.900 -5.020 11.617 1.00 12.13 ? 183 LEU A O 1
ATOM 465 C CB . LEU A 1 65 ? 18.993 -3.389 13.774 1.00 11.60 ? 183 LEU A CB 1
ATOM 466 C CG . LEU A 1 65 ? 17.733 -2.507 13.786 1.00 12.03 ? 183 LEU A CG 1
ATOM 467 C CD1 . LEU A 1 65 ? 17.926 -1.337 14.738 1.00 12.00 ? 183 LEU A CD1 1
ATOM 468 C CD2 . LEU A 1 65 ? 17.399 -2.003 12.392 1.00 12.89 ? 183 LEU A CD2 1
ATOM 469 N N . VAL A 1 66 ? 20.886 -5.893 13.683 1.00 12.38 ? 184 VAL A N 1
ATOM 470 C CA . VAL A 1 66 ? 22.236 -6.441 13.542 1.00 13.36 ? 184 VAL A CA 1
ATOM 471 C C . VAL A 1 66 ? 22.287 -7.522 12.459 1.00 14.17 ? 184 VAL A C 1
ATOM 472 O O . VAL A 1 66 ? 23.168 -7.508 11.597 1.00 14.76 ? 184 VAL A O 1
ATOM 473 C CB . VAL A 1 66 ? 22.768 -6.964 14.872 1.00 13.23 ? 184 VAL A CB 1
ATOM 474 C CG1 . VAL A 1 66 ? 24.148 -7.625 14.675 1.00 12.92 ? 184 VAL A CG1 1
ATOM 475 C CG2 . VAL A 1 66 ? 22.872 -5.793 15.866 1.00 12.94 ? 184 VAL A CG2 1
ATOM 476 N N . THR A 1 67 ? 21.307 -8.422 12.465 1.00 15.02 ? 185 THR A N 1
ATOM 477 C CA . THR A 1 67 ? 21.268 -9.477 11.466 1.00 15.94 ? 185 THR A CA 1
ATOM 478 C C . THR A 1 67 ? 21.087 -8.891 10.051 1.00 16.38 ? 185 THR A C 1
ATOM 479 O O . THR A 1 67 ? 21.567 -9.462 9.063 1.00 16.54 ? 185 THR A O 1
ATOM 480 C CB . THR A 1 67 ? 20.177 -10.531 11.806 1.00 15.80 ? 185 THR A CB 1
ATOM 481 O OG1 . THR A 1 67 ? 18.911 -9.887 11.958 1.00 19.72 ? 185 THR A OG1 1
ATOM 482 C CG2 . THR A 1 67 ? 20.415 -11.126 13.185 1.00 15.11 ? 185 THR A CG2 1
ATOM 483 N N . ALA A 1 68 ? 20.433 -7.737 9.958 1.00 16.72 ? 186 ALA A N 1
ATOM 484 C CA . ALA A 1 68 ? 20.230 -7.078 8.663 1.00 17.53 ? 186 ALA A CA 1
ATOM 485 C C . ALA A 1 68 ? 21.448 -6.287 8.154 1.00 17.70 ? 186 ALA A C 1
ATOM 486 O O . ALA A 1 68 ? 21.435 -5.780 7.031 1.00 18.25 ? 186 ALA A O 1
ATOM 487 C CB . ALA A 1 68 ? 18.984 -6.183 8.696 1.00 17.20 ? 186 ALA A CB 1
ATOM 488 N N . GLY A 1 69 ? 22.483 -6.154 8.983 1.00 17.86 ? 187 GLY A N 1
ATOM 489 C CA . GLY A 1 69 ? 23.702 -5.484 8.549 1.00 17.35 ? 187 GLY A CA 1
ATOM 490 C C . GLY A 1 69 ? 24.082 -4.196 9.266 1.00 17.46 ? 187 GLY A C 1
ATOM 491 O O . GLY A 1 69 ? 25.072 -3.540 8.895 1.00 16.68 ? 187 GLY A O 1
ATOM 492 N N . ALA A 1 70 ? 23.291 -3.793 10.258 1.00 17.05 ? 188 ALA A N 1
ATOM 493 C CA . ALA A 1 70 ? 23.652 -2.608 11.048 1.00 17.40 ? 188 ALA A CA 1
ATOM 494 C C . ALA A 1 70 ? 24.909 -2.922 11.857 1.00 17.80 ? 188 ALA A C 1
ATOM 495 O O . ALA A 1 70 ? 25.004 -3.980 12.474 1.00 18.19 ? 188 ALA A O 1
ATOM 496 C CB . ALA A 1 70 ? 22.517 -2.199 11.968 1.00 17.02 ? 188 ALA A CB 1
ATOM 497 N N . SER A 1 71 ? 25.852 -1.988 11.880 1.00 18.39 ? 189 SER A N 1
ATOM 498 C CA . SER A 1 71 ? 27.142 -2.218 12.531 1.00 18.66 ? 189 SER A CA 1
ATOM 499 C C . SER A 1 71 ? 27.134 -1.973 14.034 1.00 18.34 ? 189 SER A C 1
ATOM 500 O O . SER A 1 71 ? 26.750 -0.905 14.498 1.00 18.36 ? 189 SER A O 1
ATOM 501 C CB . SER A 1 71 ? 28.228 -1.347 11.886 1.00 19.18 ? 189 SER A CB 1
ATOM 502 O OG . SER A 1 71 ? 29.466 -1.481 12.580 1.00 18.97 ? 189 SER A OG 1
ATOM 503 N N . PRO A 1 72 ? 27.584 -2.969 14.789 1.00 18.49 ? 190 PRO A N 1
ATOM 504 C CA . PRO A 1 72 ? 27.736 -2.836 16.238 1.00 18.19 ? 190 PRO A CA 1
ATOM 505 C C . PRO A 1 72 ? 28.868 -1.868 16.596 1.00 17.60 ? 190 PRO A C 1
ATOM 506 O O . PRO A 1 72 ? 28.956 -1.456 17.746 1.00 17.83 ? 190 PRO A O 1
ATOM 507 C CB . PRO A 1 72 ? 28.111 -4.258 16.681 1.00 18.75 ? 190 PRO A CB 1
ATOM 508 C CG . PRO A 1 72 ? 27.725 -5.128 15.549 1.00 19.14 ? 190 PRO A CG 1
ATOM 509 C CD . PRO A 1 72 ? 27.962 -4.311 14.313 1.00 18.63 ? 190 PRO A CD 1
ATOM 510 N N . MET A 1 73 ? 29.714 -1.508 15.630 1.00 16.76 ? 191 MET A N 1
ATOM 511 C CA . MET A 1 73 ? 30.824 -0.593 15.911 1.00 16.15 ? 191 MET A CA 1
ATOM 512 C C . MET A 1 73 ? 30.565 0.887 15.558 1.00 15.44 ? 191 MET A C 1
ATOM 513 O O . MET A 1 73 ? 31.427 1.729 15.791 1.00 15.38 ? 191 MET A O 1
ATOM 514 C CB . MET A 1 73 ? 32.124 -1.070 15.244 1.00 15.98 ? 191 MET A CB 1
ATOM 515 C CG . MET A 1 73 ? 32.608 -2.447 15.707 1.00 16.58 ? 191 MET A CG 1
ATOM 516 S SD . MET A 1 73 ? 33.036 -2.499 17.458 1.00 17.78 ? 191 MET A SD 1
ATOM 517 C CE . MET A 1 73 ? 34.529 -1.479 17.467 1.00 16.03 ? 191 MET A CE 1
ATOM 518 N N . ALA A 1 74 ? 29.404 1.205 14.982 1.00 14.75 ? 192 ALA A N 1
ATOM 519 C CA . ALA A 1 74 ? 29.086 2.608 14.685 1.00 14.26 ? 192 ALA A CA 1
ATOM 520 C C . ALA A 1 74 ? 29.128 3.401 15.987 1.00 14.08 ? 192 ALA A C 1
ATOM 521 O O . ALA A 1 74 ? 28.599 2.953 17.010 1.00 14.31 ? 192 ALA A O 1
ATOM 522 C CB . ALA A 1 74 ? 27.714 2.736 14.031 1.00 14.04 ? 192 ALA A CB 1
ATOM 523 N N . LEU A 1 75 ? 29.752 4.573 15.957 1.00 13.72 ? 193 LEU A N 1
ATOM 524 C CA . LEU A 1 75 ? 29.919 5.371 17.173 1.00 14.03 ? 193 LEU A CA 1
ATOM 525 C C . LEU A 1 75 ? 28.838 6.423 17.351 1.00 13.80 ? 193 LEU A C 1
ATOM 526 O O . LEU A 1 75 ? 28.428 7.055 16.389 1.00 13.96 ? 193 LEU A O 1
ATOM 527 C CB . LEU A 1 75 ? 31.279 6.070 17.152 1.00 13.99 ? 193 LEU A CB 1
ATOM 528 C CG . LEU A 1 75 ? 32.468 5.136 16.959 1.00 14.47 ? 193 LEU A CG 1
ATOM 529 C CD1 . LEU A 1 75 ? 33.777 5.932 17.030 1.00 18.36 ? 193 LEU A CD1 1
ATOM 530 C CD2 . LEU A 1 75 ? 32.431 4.041 18.011 1.00 15.57 ? 193 LEU A CD2 1
ATOM 531 N N . ASP A 1 76 ? 28.396 6.628 18.590 1.00 13.80 ? 194 ASP A N 1
ATOM 532 C CA . ASP A 1 76 ? 27.478 7.731 18.878 1.00 14.46 ? 194 ASP A CA 1
ATOM 533 C C . ASP A 1 76 ? 28.240 9.028 19.210 1.00 14.36 ? 194 ASP A C 1
ATOM 534 O O . ASP A 1 76 ? 29.456 9.109 18.993 1.00 13.72 ? 194 ASP A O 1
ATOM 535 C CB . ASP A 1 76 ? 26.460 7.352 19.959 1.00 14.50 ? 194 ASP A CB 1
ATOM 536 C CG . ASP A 1 76 ? 27.032 7.387 21.355 1.00 16.59 ? 194 ASP A CG 1
ATOM 537 O OD1 . ASP A 1 76 ? 28.219 7.757 21.537 1.00 15.80 ? 194 ASP A OD1 1
ATOM 538 O OD2 . ASP A 1 76 ? 26.338 7.074 22.349 1.00 19.07 ? 194 ASP A OD2 1
ATOM 539 N N . ARG A 1 77 ? 27.527 10.033 19.717 1.00 14.44 ? 195 ARG A N 1
ATOM 540 C CA . ARG A 1 77 ? 28.109 11.359 19.964 1.00 15.03 ? 195 ARG A CA 1
ATOM 541 C C . ARG A 1 77 ? 29.311 11.329 20.919 1.00 14.38 ? 195 ARG A C 1
ATOM 542 O O . ARG A 1 77 ? 30.236 12.150 20.815 1.00 14.51 ? 195 ARG A O 1
ATOM 543 C CB . ARG A 1 77 ? 27.025 12.308 20.493 1.00 15.69 ? 195 ARG A CB 1
ATOM 544 C CG . ARG A 1 77 ? 27.475 13.732 20.710 1.00 19.21 ? 195 ARG A CG 1
ATOM 545 C CD . ARG A 1 77 ? 26.485 14.557 21.536 1.00 25.34 ? 195 ARG A CD 1
ATOM 546 N NE . ARG A 1 77 ? 26.893 15.952 21.661 1.00 28.74 ? 195 ARG A NE 1
ATOM 547 C CZ . ARG A 1 77 ? 27.018 16.767 20.630 1.00 30.61 ? 195 ARG A CZ 1
ATOM 548 N NH1 . ARG A 1 77 ? 26.760 16.319 19.407 1.00 31.86 ? 195 ARG A NH1 1
ATOM 549 N NH2 . ARG A 1 77 ? 27.394 18.027 20.811 1.00 31.81 ? 195 ARG A NH2 1
ATOM 550 N N . HIS A 1 78 ? 29.291 10.383 21.844 1.00 13.85 ? 196 HIS A N 1
ATOM 551 C CA . HIS A 1 78 ? 30.347 10.248 22.824 1.00 14.08 ? 196 HIS A CA 1
ATOM 552 C C . HIS A 1 78 ? 31.267 9.073 22.505 1.00 13.48 ? 196 HIS A C 1
ATOM 553 O O . HIS A 1 78 ? 32.036 8.626 23.351 1.00 13.80 ? 196 HIS A O 1
ATOM 554 C CB . HIS A 1 78 ? 29.744 10.123 24.217 1.00 14.87 ? 196 HIS A CB 1
ATOM 555 C CG . HIS A 1 78 ? 28.832 11.254 24.566 1.00 17.78 ? 196 HIS A CG 1
ATOM 556 N ND1 . HIS A 1 78 ? 27.460 11.128 24.570 1.00 22.69 ? 196 HIS A ND1 1
ATOM 557 C CD2 . HIS A 1 78 ? 29.093 12.548 24.864 1.00 20.79 ? 196 HIS A CD2 1
ATOM 558 C CE1 . HIS A 1 78 ? 26.916 12.291 24.887 1.00 23.19 ? 196 HIS A CE1 1
ATOM 559 N NE2 . HIS A 1 78 ? 27.886 13.169 25.070 1.00 22.24 ? 196 HIS A NE2 1
ATOM 560 N N . GLY A 1 79 ? 31.192 8.589 21.273 1.00 12.89 ? 197 GLY A N 1
ATOM 561 C CA . GLY A 1 79 ? 32.054 7.504 20.833 1.00 12.76 ? 197 GLY A CA 1
ATOM 562 C C . GLY A 1 79 ? 31.667 6.144 21.404 1.00 12.32 ? 197 GLY A C 1
ATOM 563 O O . GLY A 1 79 ? 32.490 5.225 21.451 1.00 11.99 ? 197 GLY A O 1
ATOM 564 N N . GLN A 1 80 ? 30.423 6.024 21.864 1.00 11.86 ? 198 GLN A N 1
ATOM 565 C CA . GLN A 1 80 ? 29.916 4.746 22.399 1.00 12.08 ? 198 GLN A CA 1
ATOM 566 C C . GLN A 1 80 ? 29.517 3.801 21.284 1.00 11.22 ? 198 GLN A C 1
ATOM 567 O O . GLN A 1 80 ? 28.852 4.211 20.336 1.00 11.07 ? 198 GLN A O 1
ATOM 568 C CB . GLN A 1 80 ? 28.684 4.973 23.290 1.00 11.74 ? 198 GLN A CB 1
ATOM 569 C CG . GLN A 1 80 ? 28.898 5.925 24.468 1.00 15.80 ? 198 GLN A CG 1
ATOM 570 C CD . GLN A 1 80 ? 29.473 5.234 25.690 1.00 19.55 ? 198 GLN A CD 1
ATOM 571 O OE1 . GLN A 1 80 ? 28.775 5.039 26.688 1.00 23.36 ? 198 GLN A OE1 1
ATOM 572 N NE2 . GLN A 1 80 ? 30.738 4.859 25.616 1.00 20.47 ? 198 GLN A NE2 1
ATOM 573 N N . THR A 1 81 ? 29.923 2.536 21.396 1.00 11.46 ? 199 THR A N 1
ATOM 574 C CA . THR A 1 81 ? 29.425 1.494 20.498 1.00 11.08 ? 199 THR A CA 1
ATOM 575 C C . THR A 1 81 ? 28.134 0.965 21.100 1.00 10.91 ? 199 THR A C 1
ATOM 576 O O . THR A 1 81 ? 27.760 1.349 22.202 1.00 10.53 ? 199 THR A O 1
ATOM 577 C CB . THR A 1 81 ? 30.423 0.315 20.362 1.00 11.69 ? 199 THR A CB 1
ATOM 578 O OG1 . THR A 1 81 ? 30.636 -0.296 21.651 1.00 10.36 ? 199 THR A OG1 1
ATOM 579 C CG2 . THR A 1 81 ? 31.832 0.809 19.934 1.00 12.97 ? 199 THR A CG2 1
ATOM 580 N N . ALA A 1 82 ? 27.454 0.086 20.374 1.00 10.45 ? 200 ALA A N 1
ATOM 581 C CA . ALA A 1 82 ? 26.245 -0.550 20.884 1.00 10.64 ? 200 ALA A CA 1
ATOM 582 C C . ALA A 1 82 ? 26.514 -1.229 22.234 1.00 10.73 ? 200 ALA A C 1
ATOM 583 O O . ALA A 1 82 ? 25.695 -1.155 23.158 1.00 10.67 ? 200 ALA A O 1
ATOM 584 C CB . ALA A 1 82 ? 25.738 -1.552 19.882 1.00 11.51 ? 200 ALA A CB 1
ATOM 585 N N . ALA A 1 83 ? 27.664 -1.886 22.342 1.00 10.58 ? 201 ALA A N 1
ATOM 586 C CA . ALA A 1 83 ? 28.041 -2.581 23.568 1.00 10.44 ? 201 ALA A CA 1
ATOM 587 C C . ALA A 1 83 ? 28.187 -1.631 24.753 1.00 10.55 ? 201 ALA A C 1
ATOM 588 O O . ALA A 1 83 ? 27.740 -1.949 25.859 1.00 9.64 ? 201 ALA A O 1
ATOM 589 C CB . ALA A 1 83 ? 29.322 -3.390 23.364 1.00 11.11 ? 201 ALA A CB 1
ATOM 590 N N . HIS A 1 84 ? 28.826 -0.476 24.525 1.00 10.64 ? 202 HIS A N 1
ATOM 591 C CA . HIS A 1 84 ? 28.991 0.533 25.570 1.00 11.33 ? 202 HIS A CA 1
ATOM 592 C C . HIS A 1 84 ? 27.618 0.974 26.065 1.00 11.29 ? 202 HIS A C 1
ATOM 593 O O . HIS A 1 84 ? 27.396 1.142 27.265 1.00 10.88 ? 202 HIS A O 1
ATOM 594 C CB . HIS A 1 84 ? 29.704 1.800 25.040 1.00 11.32 ? 202 HIS A CB 1
ATOM 595 C CG . HIS A 1 84 ? 31.172 1.638 24.758 1.00 11.91 ? 202 HIS A CG 1
ATOM 596 N ND1 . HIS A 1 84 ? 32.143 1.748 25.737 1.00 13.04 ? 202 HIS A ND1 1
ATOM 597 C CD2 . HIS A 1 84 ? 31.839 1.488 23.590 1.00 12.23 ? 202 HIS A CD2 1
ATOM 598 C CE1 . HIS A 1 84 ? 33.339 1.621 25.187 1.00 9.45 ? 202 HIS A CE1 1
ATOM 599 N NE2 . HIS A 1 84 ? 33.183 1.465 23.885 1.00 13.52 ? 202 HIS A NE2 1
ATOM 600 N N . LEU A 1 85 ? 26.709 1.215 25.128 1.00 10.78 ? 203 LEU A N 1
ATOM 601 C CA . LEU A 1 85 ? 25.378 1.714 25.482 1.00 11.19 ? 203 LEU A CA 1
ATOM 602 C C . LEU A 1 85 ? 24.566 0.681 26.251 1.00 10.66 ? 203 LEU A C 1
ATOM 603 O O . LEU A 1 85 ? 23.829 1.034 27.177 1.00 10.97 ? 203 LEU A O 1
ATOM 604 C CB . LEU A 1 85 ? 24.614 2.181 24.237 1.00 11.26 ? 203 LEU A CB 1
ATOM 605 C CG . LEU A 1 85 ? 25.153 3.444 23.559 1.00 12.36 ? 203 LEU A CG 1
ATOM 606 C CD1 . LEU A 1 85 ? 24.376 3.723 22.283 1.00 13.63 ? 203 LEU A CD1 1
ATOM 607 C CD2 . LEU A 1 85 ? 25.069 4.644 24.511 1.00 13.15 ? 203 LEU A CD2 1
ATOM 608 N N . ALA A 1 86 ? 24.697 -0.591 25.876 1.00 10.92 ? 204 ALA A N 1
ATOM 609 C CA . ALA A 1 86 ? 24.022 -1.663 26.611 1.00 11.09 ? 204 ALA A CA 1
ATOM 610 C C . ALA A 1 86 ? 24.504 -1.701 28.058 1.00 11.35 ? 204 ALA A C 1
ATOM 611 O O . ALA A 1 86 ? 23.707 -1.904 28.976 1.00 11.39 ? 204 ALA A O 1
ATOM 612 C CB . ALA A 1 86 ? 24.217 -3.014 25.936 1.00 10.96 ? 204 ALA A CB 1
ATOM 613 N N . CYS A 1 87 ? 25.801 -1.476 28.273 1.00 11.73 ? 205 CYS A N 1
ATOM 614 C CA . CYS A 1 87 ? 26.328 -1.464 29.641 1.00 12.84 ? 205 CYS A CA 1
ATOM 615 C C . CYS A 1 87 ? 25.945 -0.207 30.461 1.00 13.70 ? 205 CYS A C 1
ATOM 616 O O . CYS A 1 87 ? 25.606 -0.305 31.641 1.00 13.96 ? 205 CYS A O 1
ATOM 617 C CB . CYS A 1 87 ? 27.839 -1.717 29.657 1.00 12.81 ? 205 CYS A CB 1
ATOM 618 S SG . CYS A 1 87 ? 28.328 -3.313 28.982 1.00 13.30 ? 205 CYS A SG 1
ATOM 619 N N . GLU A 1 88 ? 25.976 0.976 29.861 1.00 14.97 ? 206 GLU A N 1
ATOM 620 C CA . GLU A 1 88 ? 25.561 2.135 30.635 1.00 16.52 ? 206 GLU A CA 1
ATOM 621 C C . GLU A 1 88 ? 24.058 2.077 30.952 1.00 16.69 ? 206 GLU A C 1
ATOM 622 O O . GLU A 1 88 ? 23.602 2.668 31.923 1.00 16.54 ? 206 GLU A O 1
ATOM 623 C CB . GLU A 1 88 ? 25.968 3.453 29.972 1.00 17.86 ? 206 GLU A CB 1
ATOM 624 C CG . GLU A 1 88 ? 25.307 3.739 28.642 1.00 21.43 ? 206 GLU A CG 1
ATOM 625 C CD . GLU A 1 88 ? 25.554 5.167 28.167 1.00 27.20 ? 206 GLU A CD 1
ATOM 626 O OE1 . GLU A 1 88 ? 25.340 6.114 28.956 1.00 29.87 ? 206 GLU A OE1 1
ATOM 627 O OE2 . GLU A 1 88 ? 25.968 5.343 27.005 1.00 30.39 ? 206 GLU A OE2 1
ATOM 628 N N . HIS A 1 89 ? 23.303 1.310 30.169 1.00 16.28 ? 207 HIS A N 1
ATOM 629 C CA . HIS A 1 89 ? 21.867 1.180 30.419 1.00 17.22 ? 207 HIS A CA 1
ATOM 630 C C . HIS A 1 89 ? 21.532 -0.081 31.206 1.00 17.25 ? 207 HIS A C 1
ATOM 631 O O . HIS A 1 89 ? 20.371 -0.483 31.283 1.00 18.17 ? 207 HIS A O 1
ATOM 632 C CB . HIS A 1 89 ? 21.065 1.228 29.116 1.00 17.04 ? 207 HIS A CB 1
ATOM 633 C CG . HIS A 1 89 ? 20.902 2.606 28.561 1.00 17.84 ? 207 HIS A CG 1
ATOM 634 N ND1 . HIS A 1 89 ? 19.794 3.389 28.817 1.00 20.48 ? 207 HIS A ND1 1
ATOM 635 C CD2 . HIS A 1 89 ? 21.708 3.345 27.763 1.00 18.83 ? 207 HIS A CD2 1
ATOM 636 C CE1 . HIS A 1 89 ? 19.926 4.549 28.197 1.00 19.36 ? 207 HIS A CE1 1
ATOM 637 N NE2 . HIS A 1 89 ? 21.082 4.549 27.557 1.00 20.23 ? 207 HIS A NE2 1
ATOM 638 N N . ARG A 1 90 ? 22.556 -0.698 31.788 1.00 17.50 ? 208 ARG A N 1
ATOM 639 C CA . ARG A 1 90 ? 22.382 -1.901 32.600 1.00 17.99 ? 208 ARG A CA 1
ATOM 640 C C . ARG A 1 90 ? 21.444 -2.928 31.949 1.00 18.28 ? 208 ARG A C 1
ATOM 641 O O . ARG A 1 90 ? 20.518 -3.421 32.595 1.00 18.35 ? 208 ARG A O 1
ATOM 642 C CB . ARG A 1 90 ? 21.836 -1.526 33.986 1.00 18.15 ? 208 ARG A CB 1
ATOM 643 C CG . ARG A 1 90 ? 22.655 -0.477 34.744 1.00 18.72 ? 208 ARG A CG 1
ATOM 644 C CD . ARG A 1 90 ? 22.055 -0.112 36.099 1.00 22.27 ? 208 ARG A CD 1
ATOM 645 N NE . ARG A 1 90 ? 22.961 0.674 36.943 1.00 24.02 ? 208 ARG A NE 1
ATOM 646 C CZ . ARG A 1 90 ? 22.992 1.999 36.976 1.00 26.09 ? 208 ARG A CZ 1
ATOM 647 N NH1 . ARG A 1 90 ? 22.184 2.704 36.205 1.00 26.81 ? 208 ARG A NH1 1
ATOM 648 N NH2 . ARG A 1 90 ? 23.848 2.627 37.773 1.00 27.59 ? 208 ARG A NH2 1
ATOM 649 N N . SER A 1 91 ? 21.694 -3.261 30.684 1.00 18.02 ? 209 SER A N 1
ATOM 650 C CA . SER A 1 91 ? 20.792 -4.130 29.933 1.00 17.92 ? 209 SER A CA 1
ATOM 651 C C . SER A 1 91 ? 21.488 -5.367 29.413 1.00 17.52 ? 209 SER A C 1
ATOM 652 O O . SER A 1 91 ? 21.944 -5.402 28.275 1.00 17.38 ? 209 SER A O 1
ATOM 653 C CB . SER A 1 91 ? 20.159 -3.359 28.767 1.00 18.05 ? 209 SER A CB 1
ATOM 654 O OG . SER A 1 91 ? 19.235 -4.169 28.062 1.00 19.60 ? 209 SER A OG 1
ATOM 655 N N . PRO A 1 92 ? 21.565 -6.386 30.257 1.00 17.45 ? 210 PRO A N 1
ATOM 656 C CA . PRO A 1 92 ? 22.164 -7.664 29.875 1.00 16.82 ? 210 PRO A CA 1
ATOM 657 C C . PRO A 1 92 ? 21.466 -8.320 28.678 1.00 16.54 ? 210 PRO A C 1
ATOM 658 O O . PRO A 1 92 ? 22.121 -9.019 27.915 1.00 15.64 ? 210 PRO A O 1
ATOM 659 C CB . PRO A 1 92 ? 21.956 -8.534 31.121 1.00 17.34 ? 210 PRO A CB 1
ATOM 660 C CG . PRO A 1 92 ? 21.749 -7.582 32.232 1.00 17.96 ? 210 PRO A CG 1
ATOM 661 C CD . PRO A 1 92 ? 21.108 -6.376 31.656 1.00 17.55 ? 210 PRO A CD 1
ATOM 662 N N . THR A 1 93 ? 20.161 -8.119 28.529 1.00 16.68 ? 211 THR A N 1
ATOM 663 C CA . THR A 1 93 ? 19.452 -8.747 27.415 1.00 16.85 ? 211 THR A CA 1
ATOM 664 C C . THR A 1 93 ? 19.817 -8.114 26.082 1.00 16.18 ? 211 THR A C 1
ATOM 665 O O . THR A 1 93 ? 19.936 -8.808 25.078 1.00 16.24 ? 211 THR A O 1
ATOM 666 C CB . THR A 1 93 ? 17.926 -8.741 27.625 1.00 17.45 ? 211 THR A CB 1
ATOM 667 O OG1 . THR A 1 93 ? 17.474 -7.403 27.845 1.00 19.28 ? 211 THR A OG1 1
ATOM 668 C CG2 . THR A 1 93 ? 17.574 -9.461 28.919 1.00 17.65 ? 211 THR A CG2 1
ATOM 669 N N . CYS A 1 94 ? 19.988 -6.795 26.065 1.00 15.25 ? 212 CYS A N 1
ATOM 670 C CA . CYS A 1 94 ? 20.405 -6.132 24.837 1.00 15.09 ? 212 CYS A CA 1
ATOM 671 C C . CYS A 1 94 ? 21.851 -6.489 24.512 1.00 14.02 ? 212 CYS A C 1
ATOM 672 O O . CYS A 1 94 ? 22.211 -6.658 23.348 1.00 13.62 ? 212 CYS A O 1
ATOM 673 C CB . CYS A 1 94 ? 20.229 -4.620 24.935 1.00 15.13 ? 212 CYS A CB 1
ATOM 674 S SG . CYS A 1 94 ? 18.531 -4.073 24.674 1.00 19.29 ? 212 CYS A SG 1
ATOM 675 N N . LEU A 1 95 ? 22.678 -6.609 25.544 1.00 12.90 ? 213 LEU A N 1
ATOM 676 C CA . LEU A 1 95 ? 24.070 -6.984 25.334 1.00 12.40 ? 213 LEU A CA 1
ATOM 677 C C . LEU A 1 95 ? 24.136 -8.391 24.757 1.00 12.45 ? 213 LEU A C 1
ATOM 678 O O . LEU A 1 95 ? 24.907 -8.664 23.841 1.00 11.64 ? 213 LEU A O 1
ATOM 679 C CB . LEU A 1 95 ? 24.863 -6.890 26.637 1.00 12.26 ? 213 LEU A CB 1
ATOM 680 C CG . LEU A 1 95 ? 26.348 -7.245 26.551 1.00 12.96 ? 213 LEU A CG 1
ATOM 681 C CD1 . LEU A 1 95 ? 27.062 -6.357 25.529 1.00 12.63 ? 213 LEU A CD1 1
ATOM 682 C CD2 . LEU A 1 95 ? 26.998 -7.113 27.932 1.00 12.16 ? 213 LEU A CD2 1
ATOM 683 N N . ARG A 1 96 ? 23.318 -9.286 25.302 1.00 12.85 ? 214 ARG A N 1
ATOM 684 C CA . ARG A 1 96 ? 23.248 -10.643 24.797 1.00 13.96 ? 214 ARG A CA 1
ATOM 685 C C . ARG A 1 96 ? 22.761 -10.650 23.347 1.00 14.00 ? 214 ARG A C 1
ATOM 686 O O . ARG A 1 96 ? 23.300 -11.359 22.510 1.00 14.16 ? 214 ARG A O 1
ATOM 687 C CB . ARG A 1 96 ? 22.315 -11.486 25.668 1.00 14.76 ? 214 ARG A CB 1
ATOM 688 C CG . ARG A 1 96 ? 22.375 -12.975 25.371 1.00 17.56 ? 214 ARG A CG 1
ATOM 689 C CD . ARG A 1 96 ? 21.600 -13.827 26.352 1.00 22.82 ? 214 ARG A CD 1
ATOM 690 N NE . ARG A 1 96 ? 22.235 -13.875 27.667 1.00 25.89 ? 214 ARG A NE 1
ATOM 691 C CZ . ARG A 1 96 ? 23.239 -14.686 27.975 1.00 28.40 ? 214 ARG A CZ 1
ATOM 692 N NH1 . ARG A 1 96 ? 23.726 -15.516 27.063 1.00 30.61 ? 214 ARG A NH1 1
ATOM 693 N NH2 . ARG A 1 96 ? 23.755 -14.674 29.195 1.00 29.04 ? 214 ARG A NH2 1
ATOM 694 N N . ALA A 1 97 ? 21.739 -9.856 23.049 1.00 13.47 ? 215 ALA A N 1
ATOM 695 C CA . ALA A 1 97 ? 21.228 -9.811 21.681 1.00 13.94 ? 215 ALA A CA 1
ATOM 696 C C . ALA A 1 97 ? 22.319 -9.358 20.696 1.00 13.85 ? 215 ALA A C 1
ATOM 697 O O . ALA A 1 97 ? 22.445 -9.905 19.602 1.00 14.17 ? 215 ALA A O 1
ATOM 698 C CB . ALA A 1 97 ? 20.006 -8.913 21.594 1.00 13.82 ? 215 ALA A CB 1
ATOM 699 N N . LEU A 1 98 ? 23.122 -8.382 21.109 1.00 13.52 ? 216 LEU A N 1
ATOM 700 C CA . LEU A 1 98 ? 24.190 -7.856 20.269 1.00 14.37 ? 216 LEU A CA 1
ATOM 701 C C . LEU A 1 98 ? 25.279 -8.898 20.030 1.00 14.15 ? 216 LEU A C 1
ATOM 702 O O . LEU A 1 98 ? 25.658 -9.162 18.900 1.00 14.52 ? 216 LEU A O 1
ATOM 703 C CB . LEU A 1 98 ? 24.818 -6.621 20.927 1.00 14.05 ? 216 LEU A CB 1
ATOM 704 C CG . LEU A 1 98 ? 24.166 -5.264 20.713 1.00 16.56 ? 216 LEU A CG 1
ATOM 705 C CD1 . LEU A 1 98 ? 24.737 -4.262 21.722 1.00 17.00 ? 216 LEU A CD1 1
ATOM 706 C CD2 . LEU A 1 98 ? 24.406 -4.792 19.287 1.00 15.59 ? 216 LEU A CD2 1
ATOM 707 N N . LEU A 1 99 ? 25.773 -9.488 21.112 1.00 14.99 ? 217 LEU A N 1
ATOM 708 C CA . LEU A 1 99 ? 26.865 -10.450 21.028 1.00 16.10 ? 217 LEU A CA 1
ATOM 709 C C . LEU A 1 99 ? 26.472 -11.727 20.291 1.00 16.70 ? 217 LEU A C 1
ATOM 710 O O . LEU A 1 99 ? 27.311 -12.339 19.638 1.00 17.44 ? 217 LEU A O 1
ATOM 711 C CB . LEU A 1 99 ? 27.417 -10.778 22.422 1.00 16.09 ? 217 LEU A CB 1
ATOM 712 C CG . LEU A 1 99 ? 27.941 -9.602 23.264 1.00 16.33 ? 217 LEU A CG 1
ATOM 713 C CD1 . LEU A 1 99 ? 28.437 -10.108 24.592 1.00 16.80 ? 217 LEU A CD1 1
ATOM 714 C CD2 . LEU A 1 99 ? 29.040 -8.826 22.547 1.00 19.63 ? 217 LEU A CD2 1
ATOM 715 N N . ASP A 1 100 ? 25.200 -12.111 20.378 1.00 17.04 ? 218 ASP A N 1
ATOM 716 C CA . ASP A 1 100 ? 24.714 -13.305 19.691 1.00 17.60 ? 218 ASP A CA 1
ATOM 717 C C . ASP A 1 100 ? 24.434 -13.041 18.201 1.00 17.42 ? 218 ASP A C 1
ATOM 718 O O . ASP A 1 100 ? 24.558 -13.948 17.374 1.00 17.08 ? 218 ASP A O 1
ATOM 719 C CB . ASP A 1 100 ? 23.434 -13.863 20.361 1.00 18.14 ? 218 ASP A CB 1
ATOM 720 C CG . ASP A 1 100 ? 23.714 -14.615 21.678 1.00 21.10 ? 218 ASP A CG 1
ATOM 721 O OD1 . ASP A 1 100 ? 24.878 -14.628 22.160 1.00 22.13 ? 218 ASP A OD1 1
ATOM 722 O OD2 . ASP A 1 100 ? 22.812 -15.225 22.300 1.00 23.67 ? 218 ASP A OD2 1
ATOM 723 N N . SER A 1 101 ? 24.061 -11.808 17.857 1.00 17.12 ? 219 SER A N 1
ATOM 724 C CA . SER A 1 101 ? 23.672 -11.500 16.480 1.00 17.55 ? 219 SER A CA 1
ATOM 725 C C . SER A 1 101 ? 24.803 -11.033 15.577 1.00 17.54 ? 219 SER A C 1
ATOM 726 O O . SER A 1 101 ? 24.725 -11.179 14.358 1.00 17.12 ? 219 SER A O 1
ATOM 727 C CB . SER A 1 101 ? 22.529 -10.475 16.448 1.00 17.92 ? 219 SER A CB 1
ATOM 728 O OG . SER A 1 101 ? 21.481 -10.857 17.317 1.00 18.68 ? 219 SER A OG 1
ATOM 729 N N . ALA A 1 102 ? 25.848 -10.459 16.164 1.00 17.90 ? 220 ALA A N 1
ATOM 730 C CA . ALA A 1 102 ? 26.946 -9.917 15.367 1.00 18.55 ? 220 ALA A CA 1
ATOM 731 C C . ALA A 1 102 ? 27.682 -10.996 14.587 1.00 19.30 ? 220 ALA A C 1
ATOM 732 O O . ALA A 1 102 ? 27.906 -12.098 15.085 1.00 19.86 ? 220 ALA A O 1
ATOM 733 C CB . ALA A 1 102 ? 27.917 -9.127 16.243 1.00 18.53 ? 220 ALA A CB 1
ATOM 734 N N . ALA A 1 103 ? 28.058 -10.673 13.356 1.00 20.33 ? 221 ALA A N 1
ATOM 735 C CA . ALA A 1 103 ? 28.850 -11.583 12.546 1.00 20.89 ? 221 ALA A CA 1
ATOM 736 C C . ALA A 1 103 ? 30.251 -11.715 13.146 1.00 21.42 ? 221 ALA A C 1
ATOM 737 O O . ALA A 1 103 ? 30.788 -10.764 13.708 1.00 20.93 ? 221 ALA A O 1
ATOM 738 C CB . ALA A 1 103 ? 28.920 -11.088 11.108 1.00 20.79 ? 221 ALA A CB 1
ATOM 739 N N . PRO A 1 104 ? 30.830 -12.907 13.056 1.00 22.28 ? 222 PRO A N 1
ATOM 740 C CA . PRO A 1 104 ? 32.166 -13.140 13.608 1.00 22.45 ? 222 PRO A CA 1
ATOM 741 C C . PRO A 1 104 ? 33.164 -12.137 13.044 1.00 22.94 ? 222 PRO A C 1
ATOM 742 O O . PRO A 1 104 ? 33.173 -11.890 11.840 1.00 23.17 ? 222 PRO A O 1
ATOM 743 C CB . PRO A 1 104 ? 32.494 -14.560 13.143 1.00 22.96 ? 222 PRO A CB 1
ATOM 744 C CG . PRO A 1 104 ? 31.137 -15.216 12.965 1.00 22.40 ? 222 PRO A CG 1
ATOM 745 C CD . PRO A 1 104 ? 30.249 -14.119 12.440 1.00 22.18 ? 222 PRO A CD 1
ATOM 746 N N . GLY A 1 105 ? 33.969 -11.544 13.917 1.00 23.15 ? 223 GLY A N 1
ATOM 747 C CA . GLY A 1 105 ? 34.974 -10.579 13.504 1.00 23.60 ? 223 GLY A CA 1
ATOM 748 C C . GLY A 1 105 ? 34.488 -9.158 13.235 1.00 23.63 ? 223 GLY A C 1
ATOM 749 O O . GLY A 1 105 ? 35.232 -8.346 12.682 1.00 24.49 ? 223 GLY A O 1
ATOM 750 N N . THR A 1 106 ? 33.253 -8.840 13.609 1.00 22.93 ? 224 THR A N 1
ATOM 751 C CA . THR A 1 106 ? 32.756 -7.481 13.385 1.00 22.36 ? 224 THR A CA 1
ATOM 752 C C . THR A 1 106 ? 32.611 -6.674 14.682 1.00 21.67 ? 224 THR A C 1
ATOM 753 O O . THR A 1 106 ? 32.520 -5.458 14.649 1.00 21.90 ? 224 THR A O 1
ATOM 754 C CB . THR A 1 106 ? 31.414 -7.490 12.618 1.00 22.52 ? 224 THR A CB 1
ATOM 755 O OG1 . THR A 1 106 ? 30.382 -8.033 13.450 1.00 22.45 ? 224 THR A OG1 1
ATOM 756 C CG2 . THR A 1 106 ? 31.475 -8.455 11.434 1.00 23.15 ? 224 THR A CG2 1
ATOM 757 N N . LEU A 1 107 ? 32.569 -7.356 15.817 1.00 20.66 ? 225 LEU A N 1
ATOM 758 C CA . LEU A 1 107 ? 32.387 -6.674 17.098 1.00 20.51 ? 225 LEU A CA 1
ATOM 759 C C . LEU A 1 107 ? 33.640 -6.803 17.960 1.00 19.73 ? 225 LEU A C 1
ATOM 760 O O . LEU A 1 107 ? 34.123 -7.904 18.181 1.00 20.23 ? 225 LEU A O 1
ATOM 761 C CB . LEU A 1 107 ? 31.172 -7.254 17.830 1.00 20.24 ? 225 LEU A CB 1
ATOM 762 C CG . LEU A 1 107 ? 30.503 -6.418 18.923 1.00 21.55 ? 225 LEU A CG 1
ATOM 763 C CD1 . LEU A 1 107 ? 29.091 -6.938 19.213 1.00 22.23 ? 225 LEU A CD1 1
ATOM 764 C CD2 . LEU A 1 107 ? 31.331 -6.402 20.190 1.00 21.81 ? 225 LEU A CD2 1
ATOM 765 N N . ASP A 1 108 ? 34.151 -5.676 18.453 1.00 18.84 ? 226 ASP A N 1
ATOM 766 C CA . ASP A 1 108 ? 35.391 -5.667 19.236 1.00 17.67 ? 226 ASP A CA 1
ATOM 767 C C . ASP A 1 108 ? 35.111 -5.117 20.618 1.00 16.33 ? 226 ASP A C 1
ATOM 768 O O . ASP A 1 108 ? 34.794 -3.938 20.769 1.00 15.37 ? 226 ASP A O 1
ATOM 769 C CB . ASP A 1 108 ? 36.437 -4.789 18.538 1.00 18.32 ? 226 ASP A CB 1
ATOM 770 C CG . ASP A 1 108 ? 37.853 -5.013 19.066 1.00 20.41 ? 226 ASP A CG 1
ATOM 771 O OD1 . ASP A 1 108 ? 38.027 -5.514 20.212 1.00 21.62 ? 226 ASP A OD1 1
ATOM 772 O OD2 . ASP A 1 108 ? 38.860 -4.713 18.390 1.00 22.53 ? 226 ASP A OD2 1
ATOM 773 N N . LEU A 1 109 ? 35.226 -5.960 21.636 1.00 14.75 ? 227 LEU A N 1
ATOM 774 C CA . LEU A 1 109 ? 34.919 -5.510 23.000 1.00 14.44 ? 227 LEU A CA 1
ATOM 775 C C . LEU A 1 109 ? 36.013 -4.645 23.600 1.00 14.10 ? 227 LEU A C 1
ATOM 776 O O . LEU A 1 109 ? 35.869 -4.119 24.711 1.00 14.36 ? 227 LEU A O 1
ATOM 777 C CB . LEU A 1 109 ? 34.600 -6.696 23.916 1.00 14.27 ? 227 LEU A CB 1
ATOM 778 C CG . LEU A 1 109 ? 33.311 -7.465 23.583 1.00 14.84 ? 227 LEU A CG 1
ATOM 779 C CD1 . LEU A 1 109 ? 33.213 -8.747 24.410 1.00 15.66 ? 227 LEU A CD1 1
ATOM 780 C CD2 . LEU A 1 109 ? 32.066 -6.600 23.776 1.00 14.84 ? 227 LEU A CD2 1
ATOM 781 N N . GLU A 1 110 ? 37.106 -4.475 22.873 1.00 13.89 ? 228 GLU A N 1
ATOM 782 C CA . GLU A 1 110 ? 38.178 -3.607 23.364 1.00 14.02 ? 228 GLU A CA 1
ATOM 783 C C . GLU A 1 110 ? 37.999 -2.164 22.890 1.00 13.59 ? 228 GLU A C 1
ATOM 784 O O . GLU A 1 110 ? 38.835 -1.300 23.161 1.00 12.36 ? 228 GLU A O 1
ATOM 785 C CB . GLU A 1 110 ? 39.545 -4.159 22.969 1.00 14.54 ? 228 GLU A CB 1
ATOM 786 C CG . GLU A 1 110 ? 39.877 -5.469 23.669 1.00 16.61 ? 228 GLU A CG 1
ATOM 787 C CD . GLU A 1 110 ? 39.288 -5.548 25.068 1.00 20.05 ? 228 GLU A CD 1
ATOM 788 O OE1 . GLU A 1 110 ? 38.550 -6.517 25.345 1.00 22.06 ? 228 GLU A OE1 1
ATOM 789 O OE2 . GLU A 1 110 ? 39.561 -4.651 25.898 1.00 21.60 ? 228 GLU A OE2 1
ATOM 790 N N . ALA A 1 111 ? 36.882 -1.902 22.214 1.00 13.49 ? 229 ALA A N 1
ATOM 791 C CA . ALA A 1 111 ? 36.561 -0.545 21.750 1.00 13.16 ? 229 ALA A CA 1
ATOM 792 C C . ALA A 1 111 ? 36.634 0.490 22.879 1.00 13.10 ? 229 ALA A C 1
ATOM 793 O O . ALA A 1 111 ? 36.130 0.259 23.980 1.00 12.67 ? 229 ALA A O 1
ATOM 794 C CB . ALA A 1 111 ? 35.167 -0.520 21.101 1.00 12.73 ? 229 ALA A CB 1
ATOM 795 N N . ARG A 1 112 ? 37.235 1.641 22.595 1.00 13.51 ? 230 ARG A N 1
ATOM 796 C CA . ARG A 1 112 ? 37.353 2.711 23.591 1.00 13.57 ? 230 ARG A CA 1
ATOM 797 C C . ARG A 1 112 ? 36.475 3.902 23.200 1.00 13.15 ? 230 ARG A C 1
ATOM 798 O O . ARG A 1 112 ? 36.561 4.382 22.068 1.00 13.15 ? 230 ARG A O 1
ATOM 799 C CB . ARG A 1 112 ? 38.813 3.175 23.732 1.00 13.53 ? 230 ARG A CB 1
ATOM 800 C CG . ARG A 1 112 ? 39.858 2.031 23.855 1.00 17.07 ? 230 ARG A CG 1
ATOM 801 C CD . ARG A 1 112 ? 39.649 1.132 25.056 1.00 19.55 ? 230 ARG A CD 1
ATOM 802 N NE . ARG A 1 112 ? 40.607 0.014 25.120 1.00 20.45 ? 230 ARG A NE 1
ATOM 803 C CZ . ARG A 1 112 ? 41.844 0.121 25.598 1.00 22.69 ? 230 ARG A CZ 1
ATOM 804 N NH1 . ARG A 1 112 ? 42.293 1.295 26.020 1.00 23.18 ? 230 ARG A NH1 1
ATOM 805 N NH2 . ARG A 1 112 ? 42.642 -0.943 25.638 1.00 23.87 ? 230 ARG A NH2 1
ATOM 806 N N . ASN A 1 113 ? 35.625 4.370 24.120 1.00 12.90 ? 231 ASN A N 1
ATOM 807 C CA . ASN A 1 113 ? 34.824 5.565 23.836 1.00 13.18 ? 231 ASN A CA 1
ATOM 808 C C . ASN A 1 113 ? 35.696 6.807 23.935 1.00 13.42 ? 231 ASN A C 1
ATOM 809 O O . ASN A 1 113 ? 36.878 6.710 24.280 1.00 12.41 ? 231 ASN A O 1
ATOM 810 C CB . ASN A 1 113 ? 33.554 5.662 24.719 1.00 12.74 ? 231 ASN A CB 1
ATOM 811 C CG . ASN A 1 113 ? 33.870 5.796 26.216 1.00 12.74 ? 231 ASN A CG 1
ATOM 812 O OD1 . ASN A 1 113 ? 34.981 6.146 26.607 1.00 12.71 ? 231 ASN A OD1 1
ATOM 813 N ND2 . ASN A 1 113 ? 32.874 5.529 27.052 1.00 10.94 ? 231 ASN A ND2 1
ATOM 814 N N . TYR A 1 114 ? 35.130 7.970 23.636 1.00 13.96 ? 232 TYR A N 1
ATOM 815 C CA . TYR A 1 114 ? 35.939 9.184 23.576 1.00 15.53 ? 232 TYR A CA 1
ATOM 816 C C . TYR A 1 114 ? 36.603 9.497 24.917 1.00 16.74 ? 232 TYR A C 1
ATOM 817 O O . TYR A 1 114 ? 37.702 10.059 24.957 1.00 17.58 ? 232 TYR A O 1
ATOM 818 C CB . TYR A 1 114 ? 35.126 10.376 23.046 1.00 14.71 ? 232 TYR A CB 1
ATOM 819 C CG . TYR A 1 114 ? 34.769 10.261 21.573 1.00 14.22 ? 232 TYR A CG 1
ATOM 820 C CD1 . TYR A 1 114 ? 35.537 9.486 20.697 1.00 13.36 ? 232 TYR A CD1 1
ATOM 821 C CD2 . TYR A 1 114 ? 33.669 10.927 21.059 1.00 12.00 ? 232 TYR A CD2 1
ATOM 822 C CE1 . TYR A 1 114 ? 35.202 9.389 19.341 1.00 13.06 ? 232 TYR A CE1 1
ATOM 823 C CE2 . TYR A 1 114 ? 33.328 10.830 19.722 1.00 11.51 ? 232 TYR A CE2 1
ATOM 824 C CZ . TYR A 1 114 ? 34.089 10.075 18.867 1.00 12.97 ? 232 TYR A CZ 1
ATOM 825 O OH . TYR A 1 114 ? 33.729 9.999 17.535 1.00 12.65 ? 232 TYR A OH 1
ATOM 826 N N . ASP A 1 115 ? 35.953 9.103 26.004 1.00 17.89 ? 233 ASP A N 1
ATOM 827 C CA . ASP A 1 115 ? 36.537 9.245 27.335 1.00 19.44 ? 233 ASP A CA 1
ATOM 828 C C . ASP A 1 115 ? 37.694 8.265 27.545 1.00 19.22 ? 233 ASP A C 1
ATOM 829 O O . ASP A 1 115 ? 38.547 8.481 28.404 1.00 20.25 ? 233 ASP A O 1
ATOM 830 C CB . ASP A 1 115 ? 35.478 9.030 28.410 1.00 19.86 ? 233 ASP A CB 1
ATOM 831 C CG . ASP A 1 115 ? 34.512 10.182 28.507 1.00 22.97 ? 233 ASP A CG 1
ATOM 832 O OD1 . ASP A 1 115 ? 34.951 11.340 28.335 1.00 27.76 ? 233 ASP A OD1 1
ATOM 833 O OD2 . ASP A 1 115 ? 33.292 10.034 28.750 1.00 26.70 ? 233 ASP A OD2 1
ATOM 834 N N . GLY A 1 116 ? 37.706 7.180 26.776 1.00 18.68 ? 234 GLY A N 1
ATOM 835 C CA . GLY A 1 116 ? 38.793 6.211 26.829 1.00 17.98 ? 234 GLY A CA 1
ATOM 836 C C . GLY A 1 116 ? 38.449 4.861 27.446 1.00 17.73 ? 234 GLY A C 1
ATOM 837 O O . GLY A 1 116 ? 39.299 3.958 27.492 1.00 18.78 ? 234 GLY A O 1
ATOM 838 N N . LEU A 1 117 ? 37.202 4.701 27.885 1.00 16.23 ? 235 LEU A N 1
ATOM 839 C CA . LEU A 1 117 ? 36.783 3.481 28.573 1.00 15.26 ? 235 LEU A CA 1
ATOM 840 C C . LEU A 1 117 ? 36.283 2.384 27.650 1.00 14.09 ? 235 LEU A C 1
ATOM 841 O O . LEU A 1 117 ? 35.696 2.660 26.595 1.00 13.10 ? 235 LEU A O 1
ATOM 842 C CB . LEU A 1 117 ? 35.669 3.802 29.584 1.00 15.18 ? 235 LEU A CB 1
ATOM 843 C CG . LEU A 1 117 ? 35.958 4.856 30.652 1.00 17.45 ? 235 LEU A CG 1
ATOM 844 C CD1 . LEU A 1 117 ? 34.735 5.062 31.534 1.00 17.84 ? 235 LEU A CD1 1
ATOM 845 C CD2 . LEU A 1 117 ? 37.158 4.454 31.488 1.00 18.74 ? 235 LEU A CD2 1
ATOM 846 N N . THR A 1 118 ? 36.502 1.135 28.065 1.00 12.66 ? 236 THR A N 1
ATOM 847 C CA . THR A 1 118 ? 35.915 -0.010 27.385 1.00 11.96 ? 236 THR A CA 1
ATOM 848 C C . THR A 1 118 ? 34.534 -0.239 27.963 1.00 11.28 ? 236 THR A C 1
ATOM 849 O O . THR A 1 118 ? 34.176 0.358 28.975 1.00 10.26 ? 236 THR A O 1
ATOM 850 C CB . THR A 1 118 ? 36.731 -1.284 27.636 1.00 12.12 ? 236 THR A CB 1
ATOM 851 O OG1 . THR A 1 118 ? 36.662 -1.622 29.034 1.00 12.08 ? 236 THR A OG1 1
ATOM 852 C CG2 . THR A 1 118 ? 38.209 -1.049 27.380 1.00 11.57 ? 236 THR A CG2 1
ATOM 853 N N . ALA A 1 119 ? 33.770 -1.115 27.316 1.00 10.26 ? 237 ALA A N 1
ATOM 854 C CA . ALA A 1 119 ? 32.468 -1.522 27.820 1.00 9.96 ? 237 ALA A CA 1
ATOM 855 C C . ALA A 1 119 ? 32.587 -2.112 29.229 1.00 9.65 ? 237 ALA A C 1
ATOM 856 O O . ALA A 1 119 ? 31.730 -1.873 30.080 1.00 9.95 ? 237 ALA A O 1
ATOM 857 C CB . ALA A 1 119 ? 31.835 -2.518 26.880 1.00 9.66 ? 237 ALA A CB 1
ATOM 858 N N . LEU A 1 120 ? 33.653 -2.871 29.471 1.00 9.46 ? 238 LEU A N 1
ATOM 859 C CA . LEU A 1 120 ? 33.888 -3.460 30.792 1.00 10.14 ? 238 LEU A CA 1
ATOM 860 C C . LEU A 1 120 ? 34.039 -2.401 31.894 1.00 10.28 ? 238 LEU A C 1
ATOM 861 O O . LEU A 1 120 ? 33.489 -2.552 32.993 1.00 10.93 ? 238 LEU A O 1
ATOM 862 C CB . LEU A 1 120 ? 35.098 -4.408 30.770 1.00 9.64 ? 238 LEU A CB 1
ATOM 863 C CG . LEU A 1 120 ? 35.412 -5.099 32.094 1.00 10.52 ? 238 LEU A CG 1
ATOM 864 C CD1 . LEU A 1 120 ? 34.178 -5.861 32.573 1.00 10.52 ? 238 LEU A CD1 1
ATOM 865 C CD2 . LEU A 1 120 ? 36.596 -6.041 31.944 1.00 9.75 ? 238 LEU A CD2 1
ATOM 866 N N . HIS A 1 121 ? 34.786 -1.336 31.610 1.00 11.04 ? 239 HIS A N 1
ATOM 867 C CA . HIS A 1 121 ? 34.927 -0.231 32.566 1.00 11.69 ? 239 HIS A CA 1
ATOM 868 C C . HIS A 1 121 ? 33.556 0.345 32.907 1.00 11.69 ? 239 HIS A C 1
ATOM 869 O O . HIS A 1 121 ? 33.230 0.545 34.069 1.00 12.14 ? 239 HIS A O 1
ATOM 870 C CB . HIS A 1 121 ? 35.808 0.896 32.007 1.00 12.18 ? 239 HIS A CB 1
ATOM 871 C CG . HIS A 1 121 ? 37.261 0.546 31.901 1.00 13.52 ? 239 HIS A CG 1
ATOM 872 N ND1 . HIS A 1 121 ? 38.079 0.401 33.003 1.00 16.15 ? 239 HIS A ND1 1
ATOM 873 C CD2 . HIS A 1 121 ? 38.054 0.354 30.820 1.00 14.04 ? 239 HIS A CD2 1
ATOM 874 C CE1 . HIS A 1 121 ? 39.306 0.116 32.604 1.00 14.56 ? 239 HIS A CE1 1
ATOM 875 N NE2 . HIS A 1 121 ? 39.315 0.071 31.285 1.00 15.98 ? 239 HIS A NE2 1
ATOM 876 N N . VAL A 1 122 ? 32.766 0.637 31.877 1.00 11.52 ? 240 VAL A N 1
ATOM 877 C CA . VAL A 1 122 ? 31.416 1.159 32.062 1.00 11.34 ? 240 VAL A CA 1
ATOM 878 C C . VAL A 1 122 ? 30.559 0.212 32.908 1.00 11.12 ? 240 VAL A C 1
ATOM 879 O O . VAL A 1 122 ? 29.904 0.639 33.860 1.00 11.03 ? 240 VAL A O 1
ATOM 880 C CB . VAL A 1 122 ? 30.716 1.402 30.710 1.00 11.39 ? 240 VAL A CB 1
ATOM 881 C CG1 . VAL A 1 122 ? 29.264 1.799 30.926 1.00 10.85 ? 240 VAL A CG1 1
ATOM 882 C CG2 . VAL A 1 122 ? 31.446 2.488 29.919 1.00 12.16 ? 240 VAL A CG2 1
ATOM 883 N N . ALA A 1 123 ? 30.583 -1.073 32.575 1.00 11.24 ? 241 ALA A N 1
ATOM 884 C CA . ALA A 1 123 ? 29.792 -2.052 33.309 1.00 11.82 ? 241 ALA A CA 1
ATOM 885 C C . ALA A 1 123 ? 30.174 -2.113 34.796 1.00 12.76 ? 241 ALA A C 1
ATOM 886 O O . ALA A 1 123 ? 29.305 -2.161 35.674 1.00 12.54 ? 241 ALA A O 1
ATOM 887 C CB . ALA A 1 123 ? 29.913 -3.439 32.665 1.00 11.48 ? 241 ALA A CB 1
ATOM 888 N N . VAL A 1 124 ? 31.472 -2.133 35.066 1.00 13.33 ? 242 VAL A N 1
ATOM 889 C CA . VAL A 1 124 ? 31.961 -2.204 36.444 1.00 14.47 ? 242 VAL A CA 1
ATOM 890 C C . VAL A 1 124 ? 31.500 -0.975 37.223 1.00 15.58 ? 242 VAL A C 1
ATOM 891 O O . VAL A 1 124 ? 31.065 -1.083 38.375 1.00 15.79 ? 242 VAL A O 1
ATOM 892 C CB . VAL A 1 124 ? 33.497 -2.345 36.482 1.00 14.48 ? 242 VAL A CB 1
ATOM 893 C CG1 . VAL A 1 124 ? 34.045 -2.140 37.919 1.00 15.22 ? 242 VAL A CG1 1
ATOM 894 C CG2 . VAL A 1 124 ? 33.918 -3.707 35.942 1.00 13.31 ? 242 VAL A CG2 1
ATOM 895 N N . ASN A 1 125 ? 31.555 0.182 36.570 1.00 16.57 ? 243 ASN A N 1
ATOM 896 C CA . ASN A 1 125 ? 31.102 1.434 37.163 1.00 18.20 ? 243 ASN A CA 1
ATOM 897 C C . ASN A 1 125 ? 29.613 1.445 37.525 1.00 19.24 ? 243 ASN A C 1
ATOM 898 O O . ASN A 1 125 ? 29.225 2.053 38.516 1.00 19.46 ? 243 ASN A O 1
ATOM 899 C CB . ASN A 1 125 ? 31.480 2.621 36.281 1.00 18.66 ? 243 ASN A CB 1
ATOM 900 C CG . ASN A 1 125 ? 32.968 2.931 36.339 1.00 20.32 ? 243 ASN A CG 1
ATOM 901 O OD1 . ASN A 1 125 ? 33.666 2.486 37.254 1.00 22.98 ? 243 ASN A OD1 1
ATOM 902 N ND2 . ASN A 1 125 ? 33.462 3.691 35.363 1.00 20.79 ? 243 ASN A ND2 1
ATOM 903 N N . THR A 1 126 ? 28.785 0.755 36.742 1.00 19.88 ? 244 THR A N 1
ATOM 904 C CA . THR A 1 126 ? 27.377 0.622 37.091 1.00 21.00 ? 244 THR A CA 1
ATOM 905 C C . THR A 1 126 ? 27.230 -0.457 38.156 1.00 22.06 ? 244 THR A C 1
ATOM 906 O O . THR A 1 126 ? 26.186 -0.569 38.792 1.00 22.13 ? 244 THR A O 1
ATOM 907 C CB . THR A 1 126 ? 26.512 0.231 35.876 1.00 20.90 ? 244 THR A CB 1
ATOM 908 O OG1 . THR A 1 126 ? 26.786 -1.128 35.510 1.00 20.16 ? 244 THR A OG1 1
ATOM 909 C CG2 . THR A 1 126 ? 26.874 1.042 34.638 1.00 19.82 ? 244 THR A CG2 1
ATOM 910 N N . GLU A 1 127 ? 28.277 -1.261 38.320 1.00 23.48 ? 245 GLU A N 1
ATOM 911 C CA . GLU A 1 127 ? 28.273 -2.380 39.264 1.00 25.16 ? 245 GLU A CA 1
ATOM 912 C C . GLU A 1 127 ? 27.209 -3.423 38.948 1.00 25.36 ? 245 GLU A C 1
ATOM 913 O O . GLU A 1 127 ? 26.770 -4.167 39.829 1.00 26.12 ? 245 GLU A O 1
ATOM 914 C CB . GLU A 1 127 ? 28.127 -1.880 40.696 1.00 26.10 ? 245 GLU A CB 1
ATOM 915 C CG . GLU A 1 127 ? 29.185 -0.863 41.080 1.00 27.81 ? 245 GLU A CG 1
ATOM 916 C CD . GLU A 1 127 ? 28.869 -0.172 42.375 1.00 29.67 ? 245 GLU A CD 1
ATOM 917 O OE1 . GLU A 1 127 ? 27.667 -0.053 42.700 1.00 32.69 ? 245 GLU A OE1 1
ATOM 918 O OE2 . GLU A 1 127 ? 29.815 0.253 43.063 1.00 30.73 ? 245 GLU A OE2 1
ATOM 919 N N . CYS A 1 128 ? 26.794 -3.478 37.688 1.00 25.25 ? 246 CYS A N 1
ATOM 920 C CA . CYS A 1 128 ? 25.843 -4.488 37.251 1.00 24.31 ? 246 CYS A CA 1
ATOM 921 C C . CYS A 1 128 ? 26.586 -5.801 37.055 1.00 23.83 ? 246 CYS A C 1
ATOM 922 O O . CYS A 1 128 ? 27.390 -5.946 36.131 1.00 23.90 ? 246 CYS A O 1
ATOM 923 C CB . CYS A 1 128 ? 25.156 -4.055 35.958 1.00 24.80 ? 246 CYS A CB 1
ATOM 924 S SG . CYS A 1 128 ? 23.977 -5.262 35.304 1.00 24.40 ? 246 CYS A SG 1
ATOM 925 N N . GLN A 1 129 ? 26.326 -6.759 37.936 1.00 22.71 ? 247 GLN A N 1
ATOM 926 C CA . GLN A 1 129 ? 27.028 -8.025 37.898 1.00 22.04 ? 247 GLN A CA 1
ATOM 927 C C . GLN A 1 129 ? 26.741 -8.813 36.626 1.00 20.97 ? 247 GLN A C 1
ATOM 928 O O . GLN A 1 129 ? 27.607 -9.529 36.124 1.00 20.16 ? 247 GLN A O 1
ATOM 929 C CB . GLN A 1 129 ? 26.688 -8.851 39.137 1.00 22.50 ? 247 GLN A CB 1
ATOM 930 C CG . GLN A 1 129 ? 27.052 -8.126 40.442 1.00 24.74 ? 247 GLN A CG 1
ATOM 931 C CD . GLN A 1 129 ? 26.483 -8.787 41.672 1.00 26.12 ? 247 GLN A CD 1
ATOM 932 O OE1 . GLN A 1 129 ? 26.217 -9.987 41.674 1.00 27.35 ? 247 GLN A OE1 1
ATOM 933 N NE2 . GLN A 1 129 ? 26.308 -8.009 42.733 1.00 26.57 ? 247 GLN A NE2 1
ATOM 934 N N . GLU A 1 130 ? 25.531 -8.657 36.099 1.00 19.85 ? 248 GLU A N 1
ATOM 935 C CA . GLU A 1 130 ? 25.100 -9.429 34.932 1.00 19.43 ? 248 GLU A CA 1
ATOM 936 C C . GLU A 1 130 ? 25.838 -9.043 33.642 1.00 18.37 ? 248 GLU A C 1
ATOM 937 O O . GLU A 1 130 ? 26.236 -9.910 32.862 1.00 18.25 ? 248 GLU A O 1
ATOM 938 C CB . GLU A 1 130 ? 23.586 -9.308 34.743 1.00 19.66 ? 248 GLU A CB 1
ATOM 939 C CG . GLU A 1 130 ? 22.757 -9.964 35.841 1.00 21.61 ? 248 GLU A CG 1
ATOM 940 C CD . GLU A 1 130 ? 22.844 -9.241 37.179 1.00 25.14 ? 248 GLU A CD 1
ATOM 941 O OE1 . GLU A 1 130 ? 22.866 -7.993 37.200 1.00 27.11 ? 248 GLU A OE1 1
ATOM 942 O OE2 . GLU A 1 130 ? 22.891 -9.927 38.218 1.00 27.97 ? 248 GLU A OE2 1
ATOM 943 N N . THR A 1 131 ? 26.015 -7.745 33.423 1.00 17.09 ? 249 THR A N 1
ATOM 944 C CA . THR A 1 131 ? 26.728 -7.273 32.236 1.00 15.84 ? 249 THR A CA 1
ATOM 945 C C . THR A 1 131 ? 28.226 -7.545 32.354 1.00 15.15 ? 249 THR A C 1
ATOM 946 O O . THR A 1 131 ? 28.866 -7.936 31.382 1.00 14.13 ? 249 THR A O 1
ATOM 947 C CB . THR A 1 131 ? 26.457 -5.779 31.977 1.00 15.92 ? 249 THR A CB 1
ATOM 948 O OG1 . THR A 1 131 ? 26.778 -5.025 33.150 1.00 16.03 ? 249 THR A OG1 1
ATOM 949 C CG2 . THR A 1 131 ? 24.967 -5.533 31.789 1.00 16.45 ? 249 THR A CG2 1
ATOM 950 N N . VAL A 1 132 ? 28.787 -7.360 33.551 1.00 14.23 ? 250 VAL A N 1
ATOM 951 C CA . VAL A 1 132 ? 30.196 -7.654 33.748 1.00 13.94 ? 250 VAL A CA 1
ATOM 952 C C . VAL A 1 132 ? 30.467 -9.117 33.420 1.00 14.28 ? 250 VAL A C 1
ATOM 953 O O . VAL A 1 132 ? 31.357 -9.430 32.633 1.00 13.56 ? 250 VAL A O 1
ATOM 954 C CB . VAL A 1 132 ? 30.676 -7.308 35.196 1.00 13.63 ? 250 VAL A CB 1
ATOM 955 C CG1 . VAL A 1 132 ? 32.088 -7.804 35.436 1.00 13.79 ? 250 VAL A CG1 1
ATOM 956 C CG2 . VAL A 1 132 ? 30.594 -5.801 35.424 1.00 13.01 ? 250 VAL A CG2 1
ATOM 957 N N . GLN A 1 133 ? 29.670 -10.011 33.997 1.00 14.75 ? 251 GLN A N 1
ATOM 958 C CA . GLN A 1 133 ? 29.855 -11.435 33.770 1.00 15.55 ? 251 GLN A CA 1
ATOM 959 C C . GLN A 1 133 ? 29.802 -11.799 32.295 1.00 14.90 ? 251 GLN A C 1
ATOM 960 O O . GLN A 1 133 ? 30.669 -12.502 31.796 1.00 15.26 ? 251 GLN A O 1
ATOM 961 C CB . GLN A 1 133 ? 28.821 -12.269 34.539 1.00 15.93 ? 251 GLN A CB 1
ATOM 962 C CG A GLN A 1 133 ? 29.135 -13.764 34.502 0.60 17.71 ? 251 GLN A CG 1
ATOM 963 C CG B GLN A 1 133 ? 29.000 -13.772 34.394 0.40 17.41 ? 251 GLN A CG 1
ATOM 964 C CD A GLN A 1 133 ? 28.202 -14.597 35.358 0.60 18.85 ? 251 GLN A CD 1
ATOM 965 C CD B GLN A 1 133 ? 29.919 -14.352 35.449 0.40 18.58 ? 251 GLN A CD 1
ATOM 966 O OE1 A GLN A 1 133 ? 28.047 -14.336 36.553 0.60 20.54 ? 251 GLN A OE1 1
ATOM 967 O OE1 B GLN A 1 133 ? 30.289 -13.666 36.398 0.40 20.34 ? 251 GLN A OE1 1
ATOM 968 N NE2 A GLN A 1 133 ? 27.593 -15.611 34.756 0.60 19.18 ? 251 GLN A NE2 1
ATOM 969 N NE2 B GLN A 1 133 ? 30.281 -15.620 35.293 0.40 19.24 ? 251 GLN A NE2 1
ATOM 970 N N . LEU A 1 134 ? 28.789 -11.313 31.597 1.00 14.41 ? 252 LEU A N 1
ATOM 971 C CA . LEU A 1 134 ? 28.629 -11.662 30.192 1.00 14.00 ? 252 LEU A CA 1
ATOM 972 C C . LEU A 1 134 ? 29.798 -11.140 29.348 1.00 13.68 ? 252 LEU A C 1
ATOM 973 O O . LEU A 1 134 ? 30.329 -11.865 28.519 1.00 14.19 ? 252 LEU A O 1
ATOM 974 C CB . LEU A 1 134 ? 27.302 -11.133 29.660 1.00 14.10 ? 252 LEU A CB 1
ATOM 975 C CG . LEU A 1 134 ? 26.982 -11.405 28.196 1.00 14.81 ? 252 LEU A CG 1
ATOM 976 C CD1 . LEU A 1 134 ? 27.002 -12.914 27.927 1.00 13.39 ? 252 LEU A CD1 1
ATOM 977 C CD2 . LEU A 1 134 ? 25.629 -10.779 27.847 1.00 15.88 ? 252 LEU A CD2 1
ATOM 978 N N . LEU A 1 135 ? 30.201 -9.887 29.563 1.00 12.84 ? 253 LEU A N 1
ATOM 979 C CA . LEU A 1 135 ? 31.351 -9.342 28.844 1.00 12.56 ? 253 LEU A CA 1
ATOM 980 C C . LEU A 1 135 ? 32.581 -10.249 29.022 1.00 12.86 ? 253 LEU A C 1
ATOM 981 O O . LEU A 1 135 ? 33.271 -10.574 28.064 1.00 12.30 ? 253 LEU A O 1
ATOM 982 C CB . LEU A 1 135 ? 31.676 -7.929 29.339 1.00 12.42 ? 253 LEU A CB 1
ATOM 983 C CG . LEU A 1 135 ? 30.684 -6.831 28.932 1.00 12.15 ? 253 LEU A CG 1
ATOM 984 C CD1 . LEU A 1 135 ? 30.987 -5.560 29.688 1.00 12.40 ? 253 LEU A CD1 1
ATOM 985 C CD2 . LEU A 1 135 ? 30.711 -6.586 27.418 1.00 13.20 ? 253 LEU A CD2 1
ATOM 986 N N . LEU A 1 136 ? 32.838 -10.651 30.260 1.00 13.17 ? 254 LEU A N 1
ATOM 987 C CA . LEU A 1 136 ? 33.993 -11.488 30.565 1.00 14.45 ? 254 LEU A CA 1
ATOM 988 C C . LEU A 1 136 ? 33.899 -12.880 29.937 1.00 14.89 ? 254 LEU A C 1
ATOM 989 O O . LEU A 1 136 ? 34.910 -13.459 29.535 1.00 15.52 ? 254 LEU A O 1
ATOM 990 C CB . LEU A 1 136 ? 34.187 -11.595 32.078 1.00 14.24 ? 254 LEU A CB 1
ATOM 991 C CG . LEU A 1 136 ? 34.563 -10.276 32.770 1.00 13.94 ? 254 LEU A CG 1
ATOM 992 C CD1 . LEU A 1 136 ? 34.568 -10.450 34.271 1.00 15.06 ? 254 LEU A CD1 1
ATOM 993 C CD2 . LEU A 1 136 ? 35.930 -9.758 32.274 1.00 13.37 ? 254 LEU A CD2 1
ATOM 994 N N . GLU A 1 137 ? 32.683 -13.410 29.852 1.00 15.91 ? 255 GLU A N 1
ATOM 995 C CA . GLU A 1 137 ? 32.466 -14.732 29.267 1.00 16.65 ? 255 GLU A CA 1
ATOM 996 C C . GLU A 1 137 ? 32.652 -14.682 27.753 1.00 16.82 ? 255 GLU A C 1
ATOM 997 O O . GLU A 1 137 ? 32.941 -15.700 27.113 1.00 17.01 ? 255 GLU A O 1
ATOM 998 C CB . GLU A 1 137 ? 31.062 -15.240 29.597 1.00 17.04 ? 255 GLU A CB 1
ATOM 999 C CG . GLU A 1 137 ? 30.883 -15.698 31.034 1.00 19.61 ? 255 GLU A CG 1
ATOM 1000 C CD . GLU A 1 137 ? 29.444 -16.055 31.357 1.00 23.81 ? 255 GLU A CD 1
ATOM 1001 O OE1 . GLU A 1 137 ? 28.532 -15.556 30.665 1.00 25.96 ? 255 GLU A OE1 1
ATOM 1002 O OE2 . GLU A 1 137 ? 29.223 -16.826 32.314 1.00 25.56 ? 255 GLU A OE2 1
ATOM 1003 N N . ARG A 1 138 ? 32.493 -13.496 27.174 1.00 16.88 ? 256 ARG A N 1
ATOM 1004 C CA . ARG A 1 138 ? 32.589 -13.370 25.721 1.00 17.03 ? 256 ARG A CA 1
ATOM 1005 C C . ARG A 1 138 ? 33.911 -12.793 25.209 1.00 17.29 ? 256 ARG A C 1
ATOM 1006 O O . ARG A 1 138 ? 34.014 -12.411 24.047 1.00 17.20 ? 256 ARG A O 1
ATOM 1007 C CB . ARG A 1 138 ? 31.391 -12.620 25.160 1.00 17.36 ? 256 ARG A CB 1
ATOM 1008 C CG . ARG A 1 138 ? 30.056 -13.287 25.476 1.00 18.80 ? 256 ARG A CG 1
ATOM 1009 C CD . ARG A 1 138 ? 29.912 -14.715 24.952 1.00 21.34 ? 256 ARG A CD 1
ATOM 1010 N NE . ARG A 1 138 ? 28.592 -15.263 25.267 1.00 22.38 ? 256 ARG A NE 1
ATOM 1011 C CZ . ARG A 1 138 ? 27.538 -15.200 24.461 1.00 23.58 ? 256 ARG A CZ 1
ATOM 1012 N NH1 . ARG A 1 138 ? 27.638 -14.629 23.267 1.00 22.11 ? 256 ARG A NH1 1
ATOM 1013 N NH2 . ARG A 1 138 ? 26.376 -15.722 24.846 1.00 24.43 ? 256 ARG A NH2 1
ATOM 1014 N N . GLY A 1 139 ? 34.911 -12.705 26.084 1.00 16.98 ? 257 GLY A N 1
ATOM 1015 C CA . GLY A 1 139 ? 36.248 -12.329 25.653 1.00 17.07 ? 257 GLY A CA 1
ATOM 1016 C C . GLY A 1 139 ? 36.793 -10.947 25.997 1.00 16.76 ? 257 GLY A C 1
ATOM 1017 O O . GLY A 1 139 ? 37.906 -10.619 25.574 1.00 17.25 ? 257 GLY A O 1
ATOM 1018 N N . ALA A 1 140 ? 36.042 -10.138 26.744 1.00 16.15 ? 258 ALA A N 1
ATOM 1019 C CA . ALA A 1 140 ? 36.535 -8.812 27.135 1.00 16.01 ? 258 ALA A CA 1
ATOM 1020 C C . ALA A 1 140 ? 37.814 -8.923 27.974 1.00 16.41 ? 258 ALA A C 1
ATOM 1021 O O . ALA A 1 140 ? 37.904 -9.763 28.871 1.00 16.64 ? 258 ALA A O 1
ATOM 1022 C CB . ALA A 1 140 ? 35.477 -8.046 27.895 1.00 15.95 ? 258 ALA A CB 1
ATOM 1023 N N . ASP A 1 141 ? 38.795 -8.073 27.668 1.00 16.28 ? 259 ASP A N 1
ATOM 1024 C CA . ASP A 1 141 ? 40.072 -8.067 28.370 1.00 16.28 ? 259 ASP A CA 1
ATOM 1025 C C . ASP A 1 141 ? 39.857 -7.511 29.779 1.00 15.89 ? 259 ASP A C 1
ATOM 1026 O O . ASP A 1 141 ? 39.565 -6.329 29.953 1.00 15.04 ? 259 ASP A O 1
ATOM 1027 C CB . ASP A 1 141 ? 41.081 -7.211 27.606 1.00 16.93 ? 259 ASP A CB 1
ATOM 1028 C CG . ASP A 1 141 ? 42.513 -7.424 28.078 1.00 19.73 ? 259 ASP A CG 1
ATOM 1029 O OD1 . ASP A 1 141 ? 42.705 -7.851 29.237 1.00 19.72 ? 259 ASP A OD1 1
ATOM 1030 O OD2 . ASP A 1 141 ? 43.507 -7.199 27.354 1.00 22.66 ? 259 ASP A OD2 1
ATOM 1031 N N . ILE A 1 142 ? 39.994 -8.382 30.779 1.00 15.59 ? 260 ILE A N 1
ATOM 1032 C CA . ILE A 1 142 ? 39.733 -8.016 32.170 1.00 15.63 ? 260 ILE A CA 1
ATOM 1033 C C . ILE A 1 142 ? 40.756 -7.040 32.756 1.00 16.36 ? 260 ILE A C 1
ATOM 1034 O O . ILE A 1 142 ? 40.486 -6.391 33.772 1.00 16.00 ? 260 ILE A O 1
ATOM 1035 C CB . ILE A 1 142 ? 39.642 -9.277 33.050 1.00 16.08 ? 260 ILE A CB 1
ATOM 1036 C CG1 . ILE A 1 142 ? 39.068 -8.920 34.424 1.00 16.03 ? 260 ILE A CG1 1
ATOM 1037 C CG2 . ILE A 1 142 ? 41.018 -9.947 33.170 1.00 15.20 ? 260 ILE A CG2 1
ATOM 1038 C CD1 . ILE A 1 142 ? 38.598 -10.104 35.222 1.00 18.46 ? 260 ILE A CD1 1
ATOM 1039 N N . ASP A 1 143 ? 41.916 -6.926 32.115 1.00 16.57 ? 261 ASP A N 1
ATOM 1040 C CA . ASP A 1 143 ? 42.979 -6.048 32.610 1.00 17.90 ? 261 ASP A CA 1
ATOM 1041 C C . ASP A 1 143 ? 43.147 -4.792 31.746 1.00 18.49 ? 261 ASP A C 1
ATOM 1042 O O . ASP A 1 143 ? 44.090 -4.020 31.944 1.00 18.91 ? 261 ASP A O 1
ATOM 1043 C CB . ASP A 1 143 ? 44.321 -6.788 32.666 1.00 17.77 ? 261 ASP A CB 1
ATOM 1044 C CG . ASP A 1 143 ? 44.335 -7.933 33.685 1.00 19.00 ? 261 ASP A CG 1
ATOM 1045 O OD1 . ASP A 1 143 ? 43.910 -7.737 34.849 1.00 17.18 ? 261 ASP A OD1 1
ATOM 1046 O OD2 . ASP A 1 143 ? 44.789 -9.064 33.410 1.00 21.83 ? 261 ASP A OD2 1
ATOM 1047 N N . ALA A 1 144 ? 42.253 -4.584 30.790 1.00 18.81 ? 262 ALA A N 1
ATOM 1048 C CA . ALA A 1 144 ? 42.360 -3.408 29.917 1.00 19.39 ? 262 ALA A CA 1
ATOM 1049 C C . ALA A 1 144 ? 42.479 -2.088 30.696 1.00 19.90 ? 262 ALA A C 1
ATOM 1050 O O . ALA A 1 144 ? 41.723 -1.848 31.642 1.00 19.34 ? 262 ALA A O 1
ATOM 1051 C CB . ALA A 1 144 ? 41.190 -3.348 28.959 1.00 19.34 ? 262 ALA A CB 1
ATOM 1052 N N . VAL A 1 145 ? 43.431 -1.241 30.296 1.00 21.05 ? 263 VAL A N 1
ATOM 1053 C CA . VAL A 1 145 ? 43.614 0.062 30.930 1.00 22.47 ? 263 VAL A CA 1
ATOM 1054 C C . VAL A 1 145 ? 43.251 1.194 29.974 1.00 23.63 ? 263 VAL A C 1
ATOM 1055 O O . VAL A 1 145 ? 43.785 1.291 28.865 1.00 23.95 ? 263 VAL A O 1
ATOM 1056 C CB . VAL A 1 145 ? 45.065 0.292 31.452 1.00 22.84 ? 263 VAL A CB 1
ATOM 1057 C CG1 . VAL A 1 145 ? 45.557 -0.910 32.270 1.00 22.05 ? 263 VAL A CG1 1
ATOM 1058 C CG2 . VAL A 1 145 ? 46.012 0.580 30.309 1.00 22.69 ? 263 VAL A CG2 1
ATOM 1059 N N . ASP A 1 146 ? 42.300 2.008 30.394 1.00 24.65 ? 264 ASP A N 1
ATOM 1060 C CA . ASP A 1 146 ? 41.919 3.196 29.629 1.00 26.21 ? 264 ASP A CA 1
ATOM 1061 C C . ASP A 1 146 ? 43.016 4.273 29.712 1.00 26.52 ? 264 ASP A C 1
ATOM 1062 O O . ASP A 1 146 ? 43.708 4.393 30.723 1.00 26.31 ? 264 ASP A O 1
ATOM 1063 C CB . ASP A 1 146 ? 40.586 3.737 30.127 1.00 26.47 ? 264 ASP A CB 1
ATOM 1064 C CG . ASP A 1 146 ? 40.639 4.155 31.571 1.00 28.02 ? 264 ASP A CG 1
ATOM 1065 O OD1 . ASP A 1 146 ? 40.688 3.273 32.444 1.00 29.32 ? 264 ASP A OD1 1
ATOM 1066 O OD2 . ASP A 1 146 ? 40.652 5.355 31.930 1.00 31.33 ? 264 ASP A OD2 1
ATOM 1067 N N . ILE A 1 147 ? 43.165 5.054 28.650 1.00 26.67 ? 265 ILE A N 1
ATOM 1068 C CA . ILE A 1 147 ? 44.266 6.003 28.563 1.00 26.96 ? 265 ILE A CA 1
ATOM 1069 C C . ILE A 1 147 ? 44.234 7.133 29.615 1.00 26.95 ? 265 ILE A C 1
ATOM 1070 O O . ILE A 1 147 ? 45.285 7.542 30.100 1.00 26.81 ? 265 ILE A O 1
ATOM 1071 C CB . ILE A 1 147 ? 44.386 6.561 27.122 1.00 26.78 ? 265 ILE A CB 1
ATOM 1072 C CG1 . ILE A 1 147 ? 45.291 7.796 27.079 1.00 27.23 ? 265 ILE A CG1 1
ATOM 1073 C CG2 . ILE A 1 147 ? 43.092 6.713 26.421 0.00 29.48 ? 265 ILE A CG2 1
ATOM 1074 C CD1 . ILE A 1 147 ? 46.666 7.551 26.471 1.00 26.50 ? 265 ILE A CD1 1
ATOM 1075 N N . LYS A 1 148 ? 43.040 7.591 29.997 1.00 27.09 ? 266 LYS A N 1
ATOM 1076 C CA . LYS A 1 148 ? 42.899 8.709 30.960 1.00 27.43 ? 266 LYS A CA 1
ATOM 1077 C C . LYS A 1 148 ? 43.587 8.487 32.307 1.00 27.28 ? 266 LYS A C 1
ATOM 1078 O O . LYS A 1 148 ? 44.399 9.302 32.749 1.00 27.14 ? 266 LYS A O 1
ATOM 1079 C CB . LYS A 1 148 ? 41.423 9.015 31.241 1.00 27.91 ? 266 LYS A CB 1
ATOM 1080 C CG . LYS A 1 148 ? 40.813 10.146 30.444 1.00 28.62 ? 266 LYS A CG 1
ATOM 1081 C CD . LYS A 1 148 ? 39.817 10.916 31.315 1.00 30.99 ? 266 LYS A CD 1
ATOM 1082 C CE . LYS A 1 148 ? 38.510 11.179 30.588 1.00 33.37 ? 266 LYS A CE 1
ATOM 1083 N NZ . LYS A 1 148 ? 38.620 12.305 29.625 1.00 35.60 ? 266 LYS A NZ 1
ATOM 1084 N N . SER A 1 149 ? 43.246 7.380 32.963 1.00 27.02 ? 267 SER A N 1
ATOM 1085 C CA . SER A 1 149 ? 43.700 7.126 34.323 1.00 26.46 ? 267 SER A CA 1
ATOM 1086 C C . SER A 1 149 ? 44.747 6.033 34.440 1.00 25.49 ? 267 SER A C 1
ATOM 1087 O O . SER A 1 149 ? 45.447 5.941 35.453 1.00 25.33 ? 267 SER A O 1
ATOM 1088 C CB . SER A 1 149 ? 42.501 6.771 35.197 1.00 27.05 ? 267 SER A CB 1
ATOM 1089 O OG . SER A 1 149 ? 41.753 5.704 34.619 1.00 28.99 ? 267 SER A OG 1
ATOM 1090 N N . GLY A 1 150 ? 44.850 5.198 33.410 1.00 24.20 ? 268 GLY A N 1
ATOM 1091 C CA . GLY A 1 150 ? 45.756 4.066 33.436 1.00 22.62 ? 268 GLY A CA 1
ATOM 1092 C C . GLY A 1 150 ? 45.307 3.000 34.428 1.00 21.57 ? 268 GLY A C 1
ATOM 1093 O O . GLY A 1 150 ? 46.110 2.183 34.875 1.00 21.85 ? 268 GLY A O 1
ATOM 1094 N N . ARG A 1 151 ? 44.021 3.006 34.767 1.00 20.21 ? 269 ARG A N 1
ATOM 1095 C CA . ARG A 1 151 ? 43.466 2.075 35.752 1.00 19.50 ? 269 ARG A CA 1
ATOM 1096 C C . ARG A 1 151 ? 42.743 0.880 35.127 1.00 18.56 ? 269 ARG A C 1
ATOM 1097 O O . ARG A 1 151 ? 41.976 1.041 34.185 1.00 17.36 ? 269 ARG A O 1
ATOM 1098 C CB . ARG A 1 151 ? 42.482 2.811 36.661 1.00 19.91 ? 269 ARG A CB 1
ATOM 1099 C CG . ARG A 1 151 ? 43.141 3.817 37.588 1.00 20.48 ? 269 ARG A CG 1
ATOM 1100 C CD A ARG A 1 151 ? 42.371 5.120 37.736 0.50 22.06 ? 269 ARG A CD 1
ATOM 1101 C CD B ARG A 1 151 ? 42.164 4.721 38.310 0.50 22.29 ? 269 ARG A CD 1
ATOM 1102 N NE A ARG A 1 151 ? 41.126 4.967 38.482 0.50 22.68 ? 269 ARG A NE 1
ATOM 1103 N NE B ARG A 1 151 ? 42.831 5.587 39.279 0.50 22.86 ? 269 ARG A NE 1
ATOM 1104 C CZ A ARG A 1 151 ? 40.110 5.810 38.407 0.50 23.20 ? 269 ARG A CZ 1
ATOM 1105 C CZ B ARG A 1 151 ? 42.265 6.646 39.840 0.50 23.83 ? 269 ARG A CZ 1
ATOM 1106 N NH1 A ARG A 1 151 ? 40.179 6.866 37.609 0.50 23.82 ? 269 ARG A NH1 1
ATOM 1107 N NH1 B ARG A 1 151 ? 41.017 6.969 39.533 0.50 24.58 ? 269 ARG A NH1 1
ATOM 1108 N NH2 A ARG A 1 151 ? 39.018 5.600 39.129 0.50 24.05 ? 269 ARG A NH2 1
ATOM 1109 N NH2 B ARG A 1 151 ? 42.940 7.380 40.717 0.50 23.89 ? 269 ARG A NH2 1
ATOM 1110 N N . SER A 1 152 ? 42.986 -0.310 35.677 1.00 17.61 ? 270 SER A N 1
ATOM 1111 C CA . SER A 1 152 ? 42.274 -1.522 35.259 1.00 16.50 ? 270 SER A CA 1
ATOM 1112 C C . SER A 1 152 ? 40.908 -1.488 35.916 1.00 15.64 ? 270 SER A C 1
ATOM 1113 O O . SER A 1 152 ? 40.699 -0.725 36.846 1.00 15.09 ? 270 SER A O 1
ATOM 1114 C CB . SER A 1 152 ? 43.035 -2.768 35.718 1.00 16.53 ? 270 SER A CB 1
ATOM 1115 O OG . SER A 1 152 ? 43.051 -2.857 37.136 1.00 16.99 ? 270 SER A OG 1
ATOM 1116 N N . PRO A 1 153 ? 39.964 -2.280 35.419 1.00 15.19 ? 271 PRO A N 1
ATOM 1117 C CA . PRO A 1 153 ? 38.638 -2.382 36.044 1.00 14.73 ? 271 PRO A CA 1
ATOM 1118 C C . PRO A 1 153 ? 38.720 -2.699 37.547 1.00 14.71 ? 271 PRO A C 1
ATOM 1119 O O . PRO A 1 153 ? 37.910 -2.190 38.326 1.00 13.68 ? 271 PRO A O 1
ATOM 1120 C CB . PRO A 1 153 ? 37.995 -3.542 35.286 1.00 15.09 ? 271 PRO A CB 1
ATOM 1121 C CG . PRO A 1 153 ? 38.619 -3.462 33.919 1.00 14.89 ? 271 PRO A CG 1
ATOM 1122 C CD . PRO A 1 153 ? 40.061 -3.093 34.194 1.00 15.14 ? 271 PRO A CD 1
ATOM 1123 N N . LEU A 1 154 ? 39.684 -3.521 37.946 1.00 14.47 ? 272 LEU A N 1
ATOM 1124 C CA . LEU A 1 154 ? 39.820 -3.875 39.360 1.00 14.87 ? 272 LEU A CA 1
ATOM 1125 C C . LEU A 1 154 ? 40.066 -2.642 40.230 1.00 15.24 ? 272 LEU A C 1
ATOM 1126 O O . LEU A 1 154 ? 39.463 -2.483 41.298 1.00 15.45 ? 272 LEU A O 1
ATOM 1127 C CB . LEU A 1 154 ? 40.938 -4.901 39.569 1.00 15.06 ? 272 LEU A CB 1
ATOM 1128 C CG . LEU A 1 154 ? 41.146 -5.339 41.029 1.00 15.05 ? 272 LEU A CG 1
ATOM 1129 C CD1 . LEU A 1 154 ? 39.859 -5.897 41.621 1.00 14.33 ? 272 LEU A CD1 1
ATOM 1130 C CD2 . LEU A 1 154 ? 42.278 -6.345 41.147 1.00 17.47 ? 272 LEU A CD2 1
ATOM 1131 N N . ILE A 1 155 ? 40.948 -1.769 39.774 1.00 15.51 ? 273 ILE A N 1
ATOM 1132 C CA . ILE A 1 155 ? 41.262 -0.566 40.534 1.00 16.52 ? 273 ILE A CA 1
ATOM 1133 C C . ILE A 1 155 ? 40.043 0.353 40.586 1.00 17.06 ? 273 ILE A C 1
ATOM 1134 O O . ILE A 1 155 ? 39.719 0.917 41.641 1.00 17.15 ? 273 ILE A O 1
ATOM 1135 C CB . ILE A 1 155 ? 42.521 0.128 39.961 1.00 16.29 ? 273 ILE A CB 1
ATOM 1136 C CG1 . ILE A 1 155 ? 43.755 -0.740 40.239 1.00 16.99 ? 273 ILE A CG1 1
ATOM 1137 C CG2 . ILE A 1 155 ? 42.691 1.523 40.554 1.00 16.86 ? 273 ILE A CG2 1
ATOM 1138 C CD1 . ILE A 1 155 ? 44.993 -0.378 39.432 1.00 15.77 ? 273 ILE A CD1 1
ATOM 1139 N N . HIS A 1 156 ? 39.328 0.457 39.467 1.00 17.66 ? 274 HIS A N 1
ATOM 1140 C CA . HIS A 1 156 ? 38.097 1.232 39.437 1.00 18.45 ? 274 HIS A CA 1
ATOM 1141 C C . HIS A 1 156 ? 37.139 0.704 40.501 1.00 18.24 ? 274 HIS A C 1
ATOM 1142 O O . HIS A 1 156 ? 36.561 1.481 41.264 1.00 18.70 ? 274 HIS A O 1
ATOM 1143 C CB . HIS A 1 156 ? 37.432 1.161 38.050 1.00 19.24 ? 274 HIS A CB 1
ATOM 1144 C CG . HIS A 1 156 ? 38.069 2.050 37.022 1.00 21.04 ? 274 HIS A CG 1
ATOM 1145 N ND1 . HIS A 1 156 ? 37.950 3.424 37.049 1.00 24.38 ? 274 HIS A ND1 1
ATOM 1146 C CD2 . HIS A 1 156 ? 38.808 1.759 35.924 1.00 23.32 ? 274 HIS A CD2 1
ATOM 1147 C CE1 . HIS A 1 156 ? 38.598 3.942 36.019 1.00 25.06 ? 274 HIS A CE1 1
ATOM 1148 N NE2 . HIS A 1 156 ? 39.123 2.953 35.318 1.00 25.13 ? 274 HIS A NE2 1
ATOM 1149 N N . ALA A 1 157 ? 36.985 -0.619 40.559 1.00 17.68 ? 275 ALA A N 1
ATOM 1150 C CA . ALA A 1 157 ? 36.081 -1.253 41.520 1.00 17.26 ? 275 ALA A CA 1
ATOM 1151 C C . ALA A 1 157 ? 36.487 -0.962 42.966 1.00 17.36 ? 275 ALA A C 1
ATOM 1152 O O . ALA A 1 157 ? 35.630 -0.720 43.827 1.00 16.75 ? 275 ALA A O 1
ATOM 1153 C CB . ALA A 1 157 ? 36.021 -2.765 41.286 1.00 17.32 ? 275 ALA A CB 1
ATOM 1154 N N . VAL A 1 158 ? 37.788 -0.998 43.231 1.00 17.38 ? 276 VAL A N 1
ATOM 1155 C CA . VAL A 1 158 ? 38.292 -0.724 44.577 1.00 18.37 ? 276 VAL A CA 1
ATOM 1156 C C . VAL A 1 158 ? 38.029 0.726 44.978 1.00 19.14 ? 276 VAL A C 1
ATOM 1157 O O . VAL A 1 158 ? 37.604 0.998 46.102 1.00 19.75 ? 276 VAL A O 1
ATOM 1158 C CB . VAL A 1 158 ? 39.787 -1.053 44.712 1.00 17.96 ? 276 VAL A CB 1
ATOM 1159 C CG1 . VAL A 1 158 ? 40.346 -0.483 46.004 1.00 18.50 ? 276 VAL A CG1 1
ATOM 1160 C CG2 . VAL A 1 158 ? 39.997 -2.556 44.666 1.00 17.93 ? 276 VAL A CG2 1
ATOM 1161 N N . GLU A 1 159 ? 38.270 1.655 44.059 1.00 20.02 ? 277 GLU A N 1
ATOM 1162 C CA . GLU A 1 159 ? 38.009 3.073 44.328 1.00 21.18 ? 277 GLU A CA 1
ATOM 1163 C C . GLU A 1 159 ? 36.523 3.381 44.554 1.00 21.07 ? 277 GLU A C 1
ATOM 1164 O O . GLU A 1 159 ? 36.177 4.267 45.351 1.00 21.01 ? 277 GLU A O 1
ATOM 1165 C CB . GLU A 1 159 ? 38.590 3.947 43.221 1.00 21.57 ? 277 GLU A CB 1
ATOM 1166 C CG . GLU A 1 159 ? 40.099 3.835 43.124 1.00 24.97 ? 277 GLU A CG 1
ATOM 1167 C CD . GLU A 1 159 ? 40.710 4.820 42.154 1.00 28.96 ? 277 GLU A CD 1
ATOM 1168 O OE1 . GLU A 1 159 ? 40.038 5.184 41.163 1.00 33.02 ? 277 GLU A OE1 1
ATOM 1169 O OE2 . GLU A 1 159 ? 41.873 5.221 42.378 1.00 31.61 ? 277 GLU A OE2 1
ATOM 1170 N N . ASN A 1 160 ? 35.648 2.633 43.882 1.00 20.76 ? 278 ASN A N 1
ATOM 1171 C CA . ASN A 1 160 ? 34.200 2.784 44.050 1.00 20.75 ? 278 ASN A CA 1
ATOM 1172 C C . ASN A 1 160 ? 33.695 2.076 45.304 1.00 20.39 ? 278 ASN A C 1
ATOM 1173 O O . ASN A 1 160 ? 32.490 2.056 45.571 1.00 20.14 ? 278 ASN A O 1
ATOM 1174 C CB . ASN A 1 160 ? 33.443 2.207 42.839 1.00 21.21 ? 278 ASN A CB 1
ATOM 1175 C CG . ASN A 1 160 ? 33.793 2.902 41.528 1.00 22.54 ? 278 ASN A CG 1
ATOM 1176 O OD1 . ASN A 1 160 ? 34.308 4.021 41.513 1.00 24.10 ? 278 ASN A OD1 1
ATOM 1177 N ND2 . ASN A 1 160 ? 33.501 2.233 40.412 1.00 23.57 ? 278 ASN A ND2 1
ATOM 1178 N N . ASN A 1 161 ? 34.611 1.464 46.051 1.00 19.97 ? 279 ASN A N 1
ATOM 1179 C CA . ASN A 1 161 ? 34.251 0.700 47.244 1.00 20.09 ? 279 ASN A CA 1
ATOM 1180 C C . ASN A 1 161 ? 33.129 -0.315 46.991 1.00 19.52 ? 279 ASN A C 1
ATOM 1181 O O . ASN A 1 161 ? 32.124 -0.342 47.697 1.00 19.44 ? 279 ASN A O 1
ATOM 1182 C CB . ASN A 1 161 ? 33.894 1.631 48.414 1.00 20.59 ? 279 ASN A CB 1
ATOM 1183 C CG . ASN A 1 161 ? 33.718 0.879 49.721 1.00 21.70 ? 279 ASN A CG 1
ATOM 1184 O OD1 . ASN A 1 161 ? 34.400 -0.113 49.972 1.00 23.47 ? 279 ASN A OD1 1
ATOM 1185 N ND2 . ASN A 1 161 ? 32.780 1.336 50.555 1.00 23.40 ? 279 ASN A ND2 1
ATOM 1186 N N . SER A 1 162 ? 33.307 -1.142 45.963 1.00 19.10 ? 280 SER A N 1
ATOM 1187 C CA . SER A 1 162 ? 32.338 -2.182 45.647 1.00 18.42 ? 280 SER A CA 1
ATOM 1188 C C . SER A 1 162 ? 32.935 -3.570 45.855 1.00 18.03 ? 280 SER A C 1
ATOM 1189 O O . SER A 1 162 ? 33.611 -4.110 44.971 1.00 17.94 ? 280 SER A O 1
ATOM 1190 C CB . SER A 1 162 ? 31.844 -2.061 44.207 1.00 18.61 ? 280 SER A CB 1
ATOM 1191 O OG . SER A 1 162 ? 30.929 -3.117 43.923 1.00 18.78 ? 280 SER A OG 1
ATOM 1192 N N . LEU A 1 163 ? 32.675 -4.142 47.019 1.00 17.13 ? 281 LEU A N 1
ATOM 1193 C CA . LEU A 1 163 ? 33.168 -5.472 47.341 1.00 16.84 ? 281 LEU A CA 1
ATOM 1194 C C . LEU A 1 163 ? 32.640 -6.530 46.359 1.00 16.39 ? 281 LEU A C 1
ATOM 1195 O O . LEU A 1 163 ? 33.336 -7.481 46.036 1.00 15.81 ? 281 LEU A O 1
ATOM 1196 C CB . LEU A 1 163 ? 32.790 -5.846 48.773 1.00 16.44 ? 281 LEU A CB 1
ATOM 1197 C CG . LEU A 1 163 ? 33.298 -7.200 49.261 1.00 16.67 ? 281 LEU A CG 1
ATOM 1198 C CD1 . LEU A 1 163 ? 34.823 -7.283 49.161 1.00 15.92 ? 281 LEU A CD1 1
ATOM 1199 C CD2 . LEU A 1 163 ? 32.835 -7.453 50.689 1.00 18.01 ? 281 LEU A CD2 1
ATOM 1200 N N . SER A 1 164 ? 31.404 -6.369 45.905 1.00 16.11 ? 282 SER A N 1
ATOM 1201 C CA . SER A 1 164 ? 30.851 -7.301 44.926 1.00 16.65 ? 282 SER A CA 1
ATOM 1202 C C . SER A 1 164 ? 31.696 -7.325 43.642 1.00 15.96 ? 282 SER A C 1
ATOM 1203 O O . SER A 1 164 ? 32.098 -8.395 43.176 1.00 16.26 ? 282 SER A O 1
ATOM 1204 C CB . SER A 1 164 ? 29.389 -6.954 44.610 1.00 16.60 ? 282 SER A CB 1
ATOM 1205 O OG . SER A 1 164 ? 28.569 -7.182 45.749 1.00 19.43 ? 282 SER A OG 1
ATOM 1206 N N . MET A 1 165 ? 31.966 -6.153 43.072 1.00 15.91 ? 283 MET A N 1
ATOM 1207 C CA . MET A 1 165 ? 32.749 -6.086 41.826 1.00 15.41 ? 283 MET A CA 1
ATOM 1208 C C . MET A 1 165 ? 34.178 -6.591 42.023 1.00 14.99 ? 283 MET A C 1
ATOM 1209 O O . MET A 1 165 ? 34.739 -7.250 41.147 1.00 14.52 ? 283 MET A O 1
ATOM 1210 C CB . MET A 1 165 ? 32.774 -4.664 41.255 1.00 15.64 ? 283 MET A CB 1
ATOM 1211 C CG . MET A 1 165 ? 31.480 -4.210 40.611 1.00 16.62 ? 283 MET A CG 1
ATOM 1212 S SD . MET A 1 165 ? 30.939 -5.277 39.227 1.00 16.78 ? 283 MET A SD 1
ATOM 1213 C CE . MET A 1 165 ? 29.692 -6.198 40.000 1.00 18.75 ? 283 MET A CE 1
ATOM 1214 N N . VAL A 1 166 ? 34.765 -6.263 43.168 1.00 14.18 ? 284 VAL A N 1
ATOM 1215 C CA . VAL A 1 166 ? 36.101 -6.727 43.494 1.00 13.86 ? 284 VAL A CA 1
ATOM 1216 C C . VAL A 1 166 ? 36.118 -8.244 43.545 1.00 13.49 ? 284 VAL A C 1
ATOM 1217 O O . VAL A 1 166 ? 36.970 -8.877 42.938 1.00 12.96 ? 284 VAL A O 1
ATOM 1218 C CB . VAL A 1 166 ? 36.618 -6.121 44.829 1.00 14.28 ? 284 VAL A CB 1
ATOM 1219 C CG1 . VAL A 1 166 ? 37.858 -6.861 45.310 1.00 13.62 ? 284 VAL A CG1 1
ATOM 1220 C CG2 . VAL A 1 166 ? 36.922 -4.609 44.649 1.00 14.36 ? 284 VAL A CG2 1
ATOM 1221 N N . GLN A 1 167 ? 35.144 -8.832 44.231 1.00 13.36 ? 285 GLN A N 1
ATOM 1222 C CA . GLN A 1 167 ? 35.060 -10.286 44.304 1.00 12.91 ? 285 GLN A CA 1
ATOM 1223 C C . GLN A 1 167 ? 34.812 -10.925 42.929 1.00 12.79 ? 285 GLN A C 1
ATOM 1224 O O . GLN A 1 167 ? 35.428 -11.929 42.581 1.00 11.79 ? 285 GLN A O 1
ATOM 1225 C CB . GLN A 1 167 ? 33.999 -10.716 45.328 1.00 13.75 ? 285 GLN A CB 1
ATOM 1226 C CG . GLN A 1 167 ? 34.437 -10.457 46.786 1.00 14.84 ? 285 GLN A CG 1
ATOM 1227 C CD . GLN A 1 167 ? 33.408 -10.890 47.830 1.00 18.07 ? 285 GLN A CD 1
ATOM 1228 O OE1 . GLN A 1 167 ? 32.242 -11.131 47.509 1.00 17.11 ? 285 GLN A OE1 1
ATOM 1229 N NE2 . GLN A 1 167 ? 33.841 -10.967 49.093 1.00 18.58 ? 285 GLN A NE2 1
ATOM 1230 N N . LEU A 1 168 ? 33.937 -10.312 42.141 1.00 12.48 ? 286 LEU A N 1
ATOM 1231 C CA . LEU A 1 168 ? 33.597 -10.829 40.817 1.00 12.12 ? 286 LEU A CA 1
ATOM 1232 C C . LEU A 1 168 ? 34.798 -10.808 39.872 1.00 11.89 ? 286 LEU A C 1
ATOM 1233 O O . LEU A 1 168 ? 35.053 -11.778 39.163 1.00 11.40 ? 286 LEU A O 1
ATOM 1234 C CB . LEU A 1 168 ? 32.416 -10.044 40.223 1.00 11.71 ? 286 LEU A CB 1
ATOM 1235 C CG . LEU A 1 168 ? 31.841 -10.561 38.899 1.00 12.85 ? 286 LEU A CG 1
ATOM 1236 C CD1 . LEU A 1 168 ? 31.505 -12.060 38.993 1.00 13.66 ? 286 LEU A CD1 1
ATOM 1237 C CD2 . LEU A 1 168 ? 30.613 -9.754 38.483 1.00 14.94 ? 286 LEU A CD2 1
ATOM 1238 N N . LEU A 1 169 ? 35.543 -9.706 39.870 1.00 12.31 ? 287 LEU A N 1
ATOM 1239 C CA . LEU A 1 169 ? 36.705 -9.589 38.987 1.00 12.36 ? 287 LEU A CA 1
ATOM 1240 C C . LEU A 1 169 ? 37.846 -10.537 39.358 1.00 13.15 ? 287 LEU A C 1
ATOM 1241 O O . LEU A 1 169 ? 38.476 -11.138 38.481 1.00 12.71 ? 287 LEU A O 1
ATOM 1242 C CB . LEU A 1 169 ? 37.199 -8.139 38.923 1.00 12.64 ? 287 LEU A CB 1
ATOM 1243 C CG . LEU A 1 169 ? 36.278 -7.149 38.197 1.00 11.95 ? 287 LEU A CG 1
ATOM 1244 C CD1 . LEU A 1 169 ? 36.597 -5.718 38.583 1.00 12.47 ? 287 LEU A CD1 1
ATOM 1245 C CD2 . LEU A 1 169 ? 36.371 -7.318 36.682 1.00 15.08 ? 287 LEU A CD2 1
ATOM 1246 N N . LEU A 1 170 ? 38.113 -10.681 40.654 1.00 13.45 ? 288 LEU A N 1
ATOM 1247 C CA . LEU A 1 170 ? 39.181 -11.568 41.097 1.00 14.15 ? 288 LEU A CA 1
ATOM 1248 C C . LEU A 1 170 ? 38.831 -13.008 40.759 1.00 14.70 ? 288 LEU A C 1
ATOM 1249 O O . LEU A 1 170 ? 39.687 -13.803 40.380 1.00 14.45 ? 288 LEU A O 1
ATOM 1250 C CB . LEU A 1 170 ? 39.437 -11.409 42.598 1.00 14.06 ? 288 LEU A CB 1
ATOM 1251 C CG . LEU A 1 170 ? 40.062 -10.064 43.015 1.00 13.73 ? 288 LEU A CG 1
ATOM 1252 C CD1 . LEU A 1 170 ? 40.052 -9.913 44.529 1.00 15.27 ? 288 LEU A CD1 1
ATOM 1253 C CD2 . LEU A 1 170 ? 41.475 -9.890 42.465 1.00 14.73 ? 288 LEU A CD2 1
ATOM 1254 N N . GLN A 1 171 ? 37.549 -13.314 40.873 1.00 15.77 ? 289 GLN A N 1
ATOM 1255 C CA . GLN A 1 171 ? 37.007 -14.613 40.535 1.00 16.90 ? 289 GLN A CA 1
ATOM 1256 C C . GLN A 1 171 ? 37.291 -14.948 39.069 1.00 16.93 ? 289 GLN A C 1
ATOM 1257 O O . GLN A 1 171 ? 37.491 -16.118 38.708 1.00 17.07 ? 289 GLN A O 1
ATOM 1258 C CB . GLN A 1 171 ? 35.500 -14.541 40.767 1.00 17.86 ? 289 GLN A CB 1
ATOM 1259 C CG . GLN A 1 171 ? 34.778 -15.824 40.918 1.00 19.88 ? 289 GLN A CG 1
ATOM 1260 C CD . GLN A 1 171 ? 33.369 -15.601 41.431 1.00 20.47 ? 289 GLN A CD 1
ATOM 1261 O OE1 . GLN A 1 171 ? 32.400 -15.735 40.686 1.00 21.82 ? 289 GLN A OE1 1
ATOM 1262 N NE2 . GLN A 1 171 ? 33.254 -15.263 42.707 1.00 20.98 ? 289 GLN A NE2 1
ATOM 1263 N N . HIS A 1 172 ? 37.305 -13.922 38.220 1.00 16.48 ? 290 HIS A N 1
ATOM 1264 C CA . HIS A 1 172 ? 37.522 -14.131 36.787 1.00 15.97 ? 290 HIS A CA 1
ATOM 1265 C C . HIS A 1 172 ? 38.959 -13.932 36.290 1.00 15.64 ? 290 HIS A C 1
ATOM 1266 O O . HIS A 1 172 ? 39.185 -13.757 35.092 1.00 15.90 ? 290 HIS A O 1
ATOM 1267 C CB . HIS A 1 172 ? 36.547 -13.288 35.968 1.00 15.98 ? 290 HIS A CB 1
ATOM 1268 C CG . HIS A 1 172 ? 35.154 -13.826 35.965 1.00 16.20 ? 290 HIS A CG 1
ATOM 1269 N ND1 . HIS A 1 172 ? 34.697 -14.699 35.002 1.00 16.72 ? 290 HIS A ND1 1
ATOM 1270 C CD2 . HIS A 1 172 ? 34.122 -13.636 36.821 1.00 16.43 ? 290 HIS A CD2 1
ATOM 1271 C CE1 . HIS A 1 172 ? 33.440 -15.016 35.259 1.00 16.61 ? 290 HIS A CE1 1
ATOM 1272 N NE2 . HIS A 1 172 ? 33.067 -14.384 36.357 1.00 17.40 ? 290 HIS A NE2 1
ATOM 1273 N N . GLY A 1 173 ? 39.922 -13.932 37.205 1.00 15.43 ? 291 GLY A N 1
ATOM 1274 C CA . GLY A 1 173 ? 41.328 -13.891 36.824 1.00 14.51 ? 291 GLY A CA 1
ATOM 1275 C C . GLY A 1 173 ? 42.016 -12.533 36.724 1.00 14.23 ? 291 GLY A C 1
ATOM 1276 O O . GLY A 1 173 ? 43.092 -12.431 36.133 1.00 13.48 ? 291 GLY A O 1
ATOM 1277 N N . ALA A 1 174 ? 41.423 -11.499 37.315 1.00 13.66 ? 292 ALA A N 1
ATOM 1278 C CA . ALA A 1 174 ? 42.003 -10.150 37.261 1.00 14.00 ? 292 ALA A CA 1
ATOM 1279 C C . ALA A 1 174 ? 43.364 -10.058 37.980 1.00 14.37 ? 292 ALA A C 1
ATOM 1280 O O . ALA A 1 174 ? 43.565 -10.663 39.032 1.00 14.42 ? 292 ALA A O 1
ATOM 1281 C CB . ALA A 1 174 ? 41.036 -9.136 37.850 1.00 13.64 ? 292 ALA A CB 1
ATOM 1282 N N . ASN A 1 175 ? 44.281 -9.292 37.403 1.00 14.05 ? 293 ASN A N 1
ATOM 1283 C CA . ASN A 1 175 ? 45.590 -9.070 37.997 1.00 14.24 ? 293 ASN A CA 1
ATOM 1284 C C . ASN A 1 175 ? 45.458 -8.191 39.236 1.00 13.77 ? 293 ASN A C 1
ATOM 1285 O O . ASN A 1 175 ? 45.235 -6.996 39.134 1.00 13.84 ? 293 ASN A O 1
ATOM 1286 C CB . ASN A 1 175 ? 46.531 -8.428 36.977 1.00 14.36 ? 293 ASN A CB 1
ATOM 1287 C CG . ASN A 1 175 ? 47.891 -8.107 37.559 1.00 15.79 ? 293 ASN A CG 1
ATOM 1288 O OD1 . ASN A 1 175 ? 48.234 -8.558 38.657 1.00 15.52 ? 293 ASN A OD1 1
ATOM 1289 N ND2 . ASN A 1 175 ? 48.674 -7.315 36.831 1.00 15.76 ? 293 ASN A ND2 1
ATOM 1290 N N . VAL A 1 176 ? 45.591 -8.799 40.409 1.00 13.38 ? 294 VAL A N 1
ATOM 1291 C CA . VAL A 1 176 ? 45.404 -8.085 41.661 1.00 13.26 ? 294 VAL A CA 1
ATOM 1292 C C . VAL A 1 176 ? 46.532 -7.059 41.918 1.00 13.61 ? 294 VAL A C 1
ATOM 1293 O O . VAL A 1 176 ? 46.370 -6.109 42.694 1.00 13.46 ? 294 VAL A O 1
ATOM 1294 C CB . VAL A 1 176 ? 45.258 -9.094 42.851 1.00 13.32 ? 294 VAL A CB 1
ATOM 1295 C CG1 . VAL A 1 176 ? 46.586 -9.788 43.150 1.00 13.19 ? 294 VAL A CG1 1
ATOM 1296 C CG2 . VAL A 1 176 ? 44.710 -8.405 44.079 1.00 13.60 ? 294 VAL A CG2 1
ATOM 1297 N N . ASN A 1 177 ? 47.656 -7.229 41.235 1.00 13.60 ? 295 ASN A N 1
ATOM 1298 C CA . ASN A 1 177 ? 48.785 -6.320 41.411 1.00 14.41 ? 295 ASN A CA 1
ATOM 1299 C C . ASN A 1 177 ? 49.014 -5.311 40.273 1.00 14.47 ? 295 ASN A C 1
ATOM 1300 O O . ASN A 1 177 ? 50.096 -4.738 40.146 1.00 14.45 ? 295 ASN A O 1
ATOM 1301 C CB . ASN A 1 177 ? 50.052 -7.104 41.710 1.00 14.38 ? 295 ASN A CB 1
ATOM 1302 C CG . ASN A 1 177 ? 49.993 -7.791 43.055 1.00 14.77 ? 295 ASN A CG 1
ATOM 1303 O OD1 . ASN A 1 177 ? 49.614 -7.184 44.056 1.00 13.89 ? 295 ASN A OD1 1
ATOM 1304 N ND2 . ASN A 1 177 ? 50.351 -9.071 43.084 1.00 17.27 ? 295 ASN A ND2 1
ATOM 1305 N N . ALA A 1 178 ? 47.980 -5.069 39.479 1.00 14.43 ? 296 ALA A N 1
ATOM 1306 C CA . ALA A 1 178 ? 48.047 -4.040 38.446 1.00 15.37 ? 296 ALA A CA 1
ATOM 1307 C C . ALA A 1 178 ? 48.323 -2.670 39.078 1.00 15.44 ? 296 ALA A C 1
ATOM 1308 O O . ALA A 1 178 ? 47.846 -2.379 40.180 1.00 15.12 ? 296 ALA A O 1
ATOM 1309 C CB . ALA A 1 178 ? 46.752 -4.007 37.656 1.00 15.02 ? 296 ALA A CB 1
ATOM 1310 N N . GLN A 1 179 ? 49.092 -1.831 38.386 1.00 16.05 ? 297 GLN A N 1
ATOM 1311 C CA . GLN A 1 179 ? 49.424 -0.494 38.906 1.00 16.56 ? 297 GLN A CA 1
ATOM 1312 C C . GLN A 1 179 ? 48.957 0.639 37.992 1.00 17.39 ? 297 GLN A C 1
ATOM 1313 O O . GLN A 1 179 ? 48.942 0.502 36.761 1.00 17.52 ? 297 GLN A O 1
ATOM 1314 C CB . GLN A 1 179 ? 50.936 -0.357 39.113 1.00 16.68 ? 297 GLN A CB 1
ATOM 1315 C CG . GLN A 1 179 ? 51.514 -1.198 40.238 1.00 17.71 ? 297 GLN A CG 1
ATOM 1316 C CD . GLN A 1 179 ? 53.041 -1.205 40.218 1.00 19.58 ? 297 GLN A CD 1
ATOM 1317 O OE1 . GLN A 1 179 ? 53.681 -0.549 41.043 1.00 21.71 ? 297 GLN A OE1 1
ATOM 1318 N NE2 . GLN A 1 179 ? 53.617 -1.919 39.268 1.00 18.66 ? 297 GLN A NE2 1
ATOM 1319 N N . MET A 1 180 ? 48.606 1.766 38.599 1.00 17.82 ? 298 MET A N 1
ATOM 1320 C CA . MET A 1 180 ? 48.238 2.961 37.858 1.00 18.91 ? 298 MET A CA 1
ATOM 1321 C C . MET A 1 180 ? 49.514 3.687 37.423 1.00 18.63 ? 298 MET A C 1
ATOM 1322 O O . MET A 1 180 ? 50.606 3.277 37.787 1.00 18.25 ? 298 MET A O 1
ATOM 1323 C CB . MET A 1 180 ? 47.440 3.890 38.757 1.00 19.78 ? 298 MET A CB 1
ATOM 1324 C CG . MET A 1 180 ? 46.167 3.297 39.314 1.00 22.66 ? 298 MET A CG 1
ATOM 1325 S SD . MET A 1 180 ? 45.273 4.517 40.295 1.00 28.25 ? 298 MET A SD 1
ATOM 1326 C CE . MET A 1 180 ? 46.396 4.800 41.560 1.00 27.12 ? 298 MET A CE 1
ATOM 1327 N N . TYR A 1 181 ? 49.367 4.777 36.665 1.00 19.19 ? 299 TYR A N 1
ATOM 1328 C CA . TYR A 1 181 ? 50.515 5.579 36.223 1.00 19.72 ? 299 TYR A CA 1
ATOM 1329 C C . TYR A 1 181 ? 51.483 5.914 37.374 1.00 20.19 ? 299 TYR A C 1
ATOM 1330 O O . TYR A 1 181 ? 52.708 5.872 37.211 1.00 20.31 ? 299 TYR A O 1
ATOM 1331 C CB . TYR A 1 181 ? 50.045 6.885 35.562 1.00 19.85 ? 299 TYR A CB 1
ATOM 1332 C CG . TYR A 1 181 ? 49.410 6.722 34.194 1.00 20.61 ? 299 TYR A CG 1
ATOM 1333 C CD1 . TYR A 1 181 ? 50.087 6.094 33.166 1.00 22.48 ? 299 TYR A CD1 1
ATOM 1334 C CD2 . TYR A 1 181 ? 48.145 7.228 33.930 1.00 20.73 ? 299 TYR A CD2 1
ATOM 1335 C CE1 . TYR A 1 181 ? 49.510 5.959 31.903 1.00 24.53 ? 299 TYR A CE1 1
ATOM 1336 C CE2 . TYR A 1 181 ? 47.562 7.096 32.675 1.00 22.23 ? 299 TYR A CE2 1
ATOM 1337 C CZ . TYR A 1 181 ? 48.249 6.456 31.672 1.00 24.01 ? 299 TYR A CZ 1
ATOM 1338 O OH . TYR A 1 181 ? 47.683 6.307 30.426 1.00 25.11 ? 299 TYR A OH 1
ATOM 1339 N N . SER A 1 182 ? 50.924 6.261 38.528 1.00 20.88 ? 300 SER A N 1
ATOM 1340 C CA . SER A 1 182 ? 51.719 6.624 39.701 1.00 21.72 ? 300 SER A CA 1
ATOM 1341 C C . SER A 1 182 ? 52.402 5.419 40.343 1.00 21.89 ? 300 SER A C 1
ATOM 1342 O O . SER A 1 182 ? 53.243 5.567 41.238 1.00 22.06 ? 300 SER A O 1
ATOM 1343 C CB . SER A 1 182 ? 50.828 7.288 40.744 1.00 21.86 ? 300 SER A CB 1
ATOM 1344 O OG . SER A 1 182 ? 49.865 6.356 41.226 1.00 23.07 ? 300 SER A OG 1
ATOM 1345 N N . GLY A 1 183 ? 52.020 4.225 39.916 1.00 21.54 ? 301 GLY A N 1
ATOM 1346 C CA . GLY A 1 183 ? 52.593 3.023 40.480 1.00 21.68 ? 301 GLY A CA 1
ATOM 1347 C C . GLY A 1 183 ? 51.817 2.477 41.667 1.00 21.58 ? 301 GLY A C 1
ATOM 1348 O O . GLY A 1 183 ? 52.245 1.512 42.292 1.00 21.89 ? 301 GLY A O 1
ATOM 1349 N N . SER A 1 184 ? 50.683 3.093 41.983 1.00 21.18 ? 302 SER A N 1
ATOM 1350 C CA . SER A 1 184 ? 49.841 2.601 43.068 1.00 21.03 ? 302 SER A CA 1
ATOM 1351 C C . SER A 1 184 ? 48.949 1.440 42.607 1.00 20.53 ? 302 SER A C 1
ATOM 1352 O O . SER A 1 184 ? 48.491 1.408 41.458 1.00 19.88 ? 302 SER A O 1
ATOM 1353 C CB . SER A 1 184 ? 48.983 3.728 43.643 1.00 21.33 ? 302 SER A CB 1
ATOM 1354 O OG . SER A 1 184 ? 49.766 4.633 44.414 1.00 23.14 ? 302 SER A OG 1
ATOM 1355 N N . SER A 1 185 ? 48.697 0.501 43.517 1.00 19.66 ? 303 SER A N 1
ATOM 1356 C CA . SER A 1 185 ? 47.873 -0.670 43.219 1.00 18.68 ? 303 SER A CA 1
ATOM 1357 C C . SER A 1 185 ? 46.516 -0.598 43.916 1.00 18.01 ? 303 SER A C 1
ATOM 1358 O O . SER A 1 185 ? 46.239 0.337 44.666 1.00 17.98 ? 303 SER A O 1
ATOM 1359 C CB . SER A 1 185 ? 48.600 -1.941 43.660 1.00 18.95 ? 303 SER A CB 1
ATOM 1360 O OG . SER A 1 185 ? 48.745 -1.969 45.077 1.00 18.63 ? 303 SER A OG 1
ATOM 1361 N N . ALA A 1 186 ? 45.671 -1.593 43.667 1.00 16.88 ? 304 ALA A N 1
ATOM 1362 C CA . ALA A 1 186 ? 44.381 -1.689 44.328 1.00 16.26 ? 304 ALA A CA 1
ATOM 1363 C C . ALA A 1 186 ? 44.572 -1.656 45.842 1.00 15.94 ? 304 ALA A C 1
ATOM 1364 O O . ALA A 1 186 ? 43.806 -1.019 46.573 1.00 15.55 ? 304 ALA A O 1
ATOM 1365 C CB . ALA A 1 186 ? 43.680 -2.973 43.925 1.00 16.20 ? 304 ALA A CB 1
ATOM 1366 N N . LEU A 1 187 ? 45.600 -2.342 46.308 1.00 15.64 ? 305 LEU A N 1
ATOM 1367 C CA . LEU A 1 187 ? 45.846 -2.431 47.749 1.00 15.79 ? 305 LEU A CA 1
ATOM 1368 C C . LEU A 1 187 ? 46.252 -1.090 48.384 1.00 15.88 ? 305 LEU A C 1
ATOM 1369 O O . LEU A 1 187 ? 45.881 -0.809 49.532 1.00 14.93 ? 305 LEU A O 1
ATOM 1370 C CB . LEU A 1 187 ? 46.876 -3.523 48.051 1.00 15.54 ? 305 LEU A CB 1
ATOM 1371 C CG . LEU A 1 187 ? 47.012 -3.941 49.514 1.00 14.99 ? 305 LEU A CG 1
ATOM 1372 C CD1 . LEU A 1 187 ? 45.686 -4.403 50.078 1.00 13.51 ? 305 LEU A CD1 1
ATOM 1373 C CD2 . LEU A 1 187 ? 48.078 -5.024 49.659 1.00 15.52 ? 305 LEU A CD2 1
ATOM 1374 N N . HIS A 1 188 ? 47.003 -0.262 47.651 1.00 16.13 ? 306 HIS A N 1
ATOM 1375 C CA . HIS A 1 188 ? 47.332 1.074 48.165 1.00 16.57 ? 306 HIS A CA 1
ATOM 1376 C C . HIS A 1 188 ? 46.039 1.813 48.469 1.00 16.99 ? 306 HIS A C 1
ATOM 1377 O O . HIS A 1 188 ? 45.898 2.417 49.524 1.00 16.87 ? 306 HIS A O 1
ATOM 1378 C CB . HIS A 1 188 ? 48.114 1.909 47.150 1.00 16.70 ? 306 HIS A CB 1
ATOM 1379 C CG . HIS A 1 188 ? 49.520 1.455 46.930 1.00 16.39 ? 306 HIS A CG 1
ATOM 1380 N ND1 . HIS A 1 188 ? 50.588 1.965 47.635 1.00 17.61 ? 306 HIS A ND1 1
ATOM 1381 C CD2 . HIS A 1 188 ? 50.040 0.578 46.043 1.00 17.70 ? 306 HIS A CD2 1
ATOM 1382 C CE1 . HIS A 1 188 ? 51.703 1.402 47.208 1.00 17.00 ? 306 HIS A CE1 1
ATOM 1383 N NE2 . HIS A 1 188 ? 51.397 0.559 46.239 1.00 18.08 ? 306 HIS A NE2 1
ATOM 1384 N N . SER A 1 189 ? 45.099 1.767 47.525 1.00 17.61 ? 307 SER A N 1
ATOM 1385 C CA . SER A 1 189 ? 43.830 2.477 47.666 1.00 18.14 ? 307 SER A CA 1
ATOM 1386 C C . SER A 1 189 ? 42.997 1.982 48.838 1.00 18.59 ? 307 SER A C 1
ATOM 1387 O O . SER A 1 189 ? 42.520 2.788 49.660 1.00 19.08 ? 307 SER A O 1
ATOM 1388 C CB . SER A 1 189 ? 43.011 2.397 46.372 1.00 18.59 ? 307 SER A CB 1
ATOM 1389 O OG A SER A 1 189 ? 43.406 3.404 45.454 0.50 18.78 ? 307 SER A OG 1
ATOM 1390 O OG B SER A 1 189 ? 41.766 3.056 46.520 0.50 17.82 ? 307 SER A OG 1
ATOM 1391 N N . ALA A 1 190 ? 42.812 0.667 48.915 1.00 18.49 ? 308 ALA A N 1
ATOM 1392 C CA . ALA A 1 190 ? 42.032 0.065 49.993 1.00 18.68 ? 308 ALA A CA 1
ATOM 1393 C C . ALA A 1 190 ? 42.679 0.319 51.347 1.00 18.86 ? 308 ALA A C 1
ATOM 1394 O O . ALA A 1 190 ? 41.992 0.629 52.322 1.00 18.49 ? 308 ALA A O 1
ATOM 1395 C CB . ALA A 1 190 ? 41.856 -1.441 49.761 1.00 18.50 ? 308 ALA A CB 1
ATOM 1396 N N . SER A 1 191 ? 44.001 0.194 51.398 1.00 19.34 ? 309 SER A N 1
ATOM 1397 C CA . SER A 1 191 ? 44.747 0.380 52.639 1.00 20.45 ? 309 SER A CA 1
ATOM 1398 C C . SER A 1 191 ? 44.712 1.828 53.120 1.00 21.02 ? 309 SER A C 1
ATOM 1399 O O . SER A 1 191 ? 44.487 2.090 54.306 1.00 20.67 ? 309 SER A O 1
ATOM 1400 C CB . SER A 1 191 ? 46.201 -0.073 52.474 1.00 20.22 ? 309 SER A CB 1
ATOM 1401 O OG . SER A 1 191 ? 46.957 0.242 53.635 1.00 21.50 ? 309 SER A OG 1
ATOM 1402 N N . GLY A 1 192 ? 44.946 2.759 52.198 1.00 21.55 ? 310 GLY A N 1
ATOM 1403 C CA . GLY A 1 192 ? 44.969 4.176 52.523 1.00 22.96 ? 310 GLY A CA 1
ATOM 1404 C C . GLY A 1 192 ? 43.623 4.730 52.962 1.00 23.40 ? 310 GLY A C 1
ATOM 1405 O O . GLY A 1 192 ? 43.557 5.719 53.693 1.00 23.69 ? 310 GLY A O 1
ATOM 1406 N N . ARG A 1 193 ? 42.548 4.083 52.531 1.00 23.78 ? 311 ARG A N 1
ATOM 1407 C CA . ARG A 1 193 ? 41.200 4.543 52.860 1.00 24.38 ? 311 ARG A CA 1
ATOM 1408 C C . ARG A 1 193 ? 40.561 3.731 53.974 1.00 24.08 ? 311 ARG A C 1
ATOM 1409 O O . ARG A 1 193 ? 39.436 4.012 54.386 1.00 24.24 ? 311 ARG A O 1
ATOM 1410 C CB . ARG A 1 193 ? 40.309 4.505 51.624 1.00 24.59 ? 311 ARG A CB 1
ATOM 1411 C CG . ARG A 1 193 ? 40.688 5.498 50.561 1.00 26.51 ? 311 ARG A CG 1
ATOM 1412 C CD . ARG A 1 193 ? 39.952 5.290 49.242 1.00 29.06 ? 311 ARG A CD 1
ATOM 1413 N NE . ARG A 1 193 ? 38.506 5.182 49.429 1.00 32.41 ? 311 ARG A NE 1
ATOM 1414 C CZ . ARG A 1 193 ? 37.635 5.064 48.430 1.00 34.16 ? 311 ARG A CZ 1
ATOM 1415 N NH1 . ARG A 1 193 ? 38.064 5.043 47.177 1.00 34.83 ? 311 ARG A NH1 1
ATOM 1416 N NH2 . ARG A 1 193 ? 36.336 4.973 48.680 1.00 34.60 ? 311 ARG A NH2 1
ATOM 1417 N N . GLY A 1 194 ? 41.269 2.710 54.443 1.00 23.87 ? 312 GLY A N 1
ATOM 1418 C CA . GLY A 1 194 ? 40.773 1.861 55.509 1.00 23.65 ? 312 GLY A CA 1
ATOM 1419 C C . GLY A 1 194 ? 39.525 1.080 55.151 1.00 23.69 ? 312 GLY A C 1
ATOM 1420 O O . GLY A 1 194 ? 38.655 0.865 55.998 1.00 23.74 ? 312 GLY A O 1
ATOM 1421 N N . LEU A 1 195 ? 39.422 0.669 53.890 1.00 23.23 ? 313 LEU A N 1
ATOM 1422 C CA . LEU A 1 195 ? 38.306 -0.151 53.441 1.00 23.00 ? 313 LEU A CA 1
ATOM 1423 C C . LEU A 1 195 ? 38.582 -1.601 53.842 1.00 22.65 ? 313 LEU A C 1
ATOM 1424 O O . LEU A 1 195 ? 39.007 -2.409 53.017 1.00 22.44 ? 313 LEU A O 1
ATOM 1425 C CB . LEU A 1 195 ? 38.146 -0.040 51.919 1.00 23.00 ? 313 LEU A CB 1
ATOM 1426 C CG . LEU A 1 195 ? 37.378 1.160 51.352 1.00 23.96 ? 313 LEU A CG 1
ATOM 1427 C CD1 . LEU A 1 195 ? 37.477 2.375 52.250 1.00 24.77 ? 313 LEU A CD1 1
ATOM 1428 C CD2 . LEU A 1 195 ? 37.844 1.485 49.934 1.00 24.14 ? 313 LEU A CD2 1
ATOM 1429 N N . LEU A 1 196 ? 38.328 -1.917 55.114 1.00 22.08 ? 314 LEU A N 1
ATOM 1430 C CA . LEU A 1 196 ? 38.649 -3.228 55.686 1.00 21.76 ? 314 LEU A CA 1
ATOM 1431 C C . LEU A 1 196 ? 38.231 -4.475 54.881 1.00 21.08 ? 314 LEU A C 1
ATOM 1432 O O . LEU A 1 196 ? 39.056 -5.339 54.646 1.00 20.81 ? 314 LEU A O 1
ATOM 1433 C CB . LEU A 1 196 ? 38.163 -3.335 57.138 1.00 21.80 ? 314 LEU A CB 1
ATOM 1434 C CG . LEU A 1 196 ? 38.650 -2.240 58.102 1.00 23.13 ? 314 LEU A CG 1
ATOM 1435 C CD1 . LEU A 1 196 ? 38.314 -2.611 59.527 1.00 23.03 ? 314 LEU A CD1 1
ATOM 1436 C CD2 . LEU A 1 196 ? 40.151 -1.972 57.954 1.00 23.50 ? 314 LEU A CD2 1
ATOM 1437 N N . PRO A 1 197 ? 36.959 -4.596 54.501 1.00 20.60 ? 315 PRO A N 1
ATOM 1438 C CA . PRO A 1 197 ? 36.510 -5.772 53.741 1.00 20.22 ? 315 PRO A CA 1
ATOM 1439 C C . PRO A 1 197 ? 37.307 -5.948 52.451 1.00 19.67 ? 315 PRO A C 1
ATOM 1440 O O . PRO A 1 197 ? 37.618 -7.081 52.067 1.00 19.53 ? 315 PRO A O 1
ATOM 1441 C CB . PRO A 1 197 ? 35.046 -5.451 53.430 1.00 20.43 ? 315 PRO A CB 1
ATOM 1442 C CG . PRO A 1 197 ? 34.640 -4.485 54.500 1.00 20.78 ? 315 PRO A CG 1
ATOM 1443 C CD . PRO A 1 197 ? 35.855 -3.656 54.765 1.00 20.94 ? 315 PRO A CD 1
ATOM 1444 N N . LEU A 1 198 ? 37.648 -4.836 51.803 1.00 18.92 ? 316 LEU A N 1
ATOM 1445 C CA . LEU A 1 198 ? 38.426 -4.886 50.571 1.00 18.49 ? 316 LEU A CA 1
ATOM 1446 C C . LEU A 1 198 ? 39.878 -5.269 50.838 1.00 17.60 ? 316 LEU A C 1
ATOM 1447 O O . LEU A 1 198 ? 40.477 -6.015 50.071 1.00 17.22 ? 316 LEU A O 1
ATOM 1448 C CB . LEU A 1 198 ? 38.350 -3.555 49.814 1.00 18.40 ? 316 LEU A CB 1
ATOM 1449 C CG . LEU A 1 198 ? 37.168 -3.425 48.837 1.00 19.75 ? 316 LEU A CG 1
ATOM 1450 C CD1 . LEU A 1 198 ? 35.843 -3.515 49.568 1.00 21.54 ? 316 LEU A CD1 1
ATOM 1451 C CD2 . LEU A 1 198 ? 37.252 -2.142 48.015 1.00 19.33 ? 316 LEU A CD2 1
ATOM 1452 N N . VAL A 1 199 ? 40.450 -4.741 51.914 1.00 16.93 ? 317 VAL A N 1
ATOM 1453 C CA . VAL A 1 199 ? 41.818 -5.083 52.261 1.00 16.11 ? 317 VAL A CA 1
ATOM 1454 C C . VAL A 1 199 ? 41.904 -6.590 52.489 1.00 15.85 ? 317 VAL A C 1
ATOM 1455 O O . VAL A 1 199 ? 42.800 -7.258 51.968 1.00 15.90 ? 317 VAL A O 1
ATOM 1456 C CB . VAL A 1 199 ? 42.315 -4.314 53.514 1.00 16.18 ? 317 VAL A CB 1
ATOM 1457 C CG1 . VAL A 1 199 ? 43.743 -4.720 53.855 1.00 16.32 ? 317 VAL A CG1 1
ATOM 1458 C CG2 . VAL A 1 199 ? 42.239 -2.808 53.280 1.00 15.73 ? 317 VAL A CG2 1
ATOM 1459 N N . ARG A 1 200 ? 40.948 -7.129 53.240 1.00 15.27 ? 318 ARG A N 1
ATOM 1460 C CA . ARG A 1 200 ? 40.930 -8.560 53.530 1.00 15.33 ? 318 ARG A CA 1
ATOM 1461 C C . ARG A 1 200 ? 40.848 -9.386 52.253 1.00 14.99 ? 318 ARG A C 1
ATOM 1462 O O . ARG A 1 200 ? 41.578 -10.369 52.097 1.00 15.03 ? 318 ARG A O 1
ATOM 1463 C CB . ARG A 1 200 ? 39.755 -8.927 54.441 1.00 15.81 ? 318 ARG A CB 1
ATOM 1464 C CG . ARG A 1 200 ? 39.942 -8.545 55.913 1.00 17.81 ? 318 ARG A CG 1
ATOM 1465 C CD . ARG A 1 200 ? 38.715 -8.810 56.786 1.00 21.17 ? 318 ARG A CD 1
ATOM 1466 N NE . ARG A 1 200 ? 38.851 -8.211 58.111 1.00 22.96 ? 318 ARG A NE 1
ATOM 1467 C CZ . ARG A 1 200 ? 38.061 -7.262 58.591 1.00 23.93 ? 318 ARG A CZ 1
ATOM 1468 N NH1 . ARG A 1 200 ? 37.048 -6.793 57.863 1.00 25.14 ? 318 ARG A NH1 1
ATOM 1469 N NH2 . ARG A 1 200 ? 38.284 -6.774 59.804 1.00 24.19 ? 318 ARG A NH2 1
ATOM 1470 N N . THR A 1 201 ? 39.947 -8.994 51.358 1.00 14.24 ? 319 THR A N 1
ATOM 1471 C CA . THR A 1 201 ? 39.745 -9.717 50.103 1.00 14.62 ? 319 THR A CA 1
ATOM 1472 C C . THR A 1 201 ? 40.987 -9.681 49.199 1.00 13.33 ? 319 THR A C 1
ATOM 1473 O O . THR A 1 201 ? 41.423 -10.714 48.699 1.00 13.11 ? 319 THR A O 1
ATOM 1474 C CB . THR A 1 201 ? 38.508 -9.176 49.368 1.00 14.86 ? 319 THR A CB 1
ATOM 1475 O OG1 . THR A 1 201 ? 37.323 -9.698 49.987 1.00 18.12 ? 319 THR A OG1 1
ATOM 1476 C CG2 . THR A 1 201 ? 38.432 -9.730 47.956 1.00 15.91 ? 319 THR A CG2 1
ATOM 1477 N N . LEU A 1 202 ? 41.547 -8.493 48.991 1.00 12.67 ? 320 LEU A N 1
ATOM 1478 C CA . LEU A 1 202 ? 42.756 -8.356 48.169 1.00 12.73 ? 320 LEU A CA 1
ATOM 1479 C C . LEU A 1 202 ? 43.954 -9.158 48.717 1.00 12.65 ? 320 LEU A C 1
ATOM 1480 O O . LEU A 1 202 ? 44.664 -9.807 47.963 1.00 12.36 ? 320 LEU A O 1
ATOM 1481 C CB . LEU A 1 202 ? 43.143 -6.880 48.005 1.00 12.30 ? 320 LEU A CB 1
ATOM 1482 C CG . LEU A 1 202 ? 42.141 -5.973 47.279 1.00 13.46 ? 320 LEU A CG 1
ATOM 1483 C CD1 . LEU A 1 202 ? 42.490 -4.498 47.469 1.00 12.69 ? 320 LEU A CD1 1
ATOM 1484 C CD2 . LEU A 1 202 ? 42.060 -6.322 45.792 1.00 12.67 ? 320 LEU A CD2 1
ATOM 1485 N N . VAL A 1 203 ? 44.185 -9.093 50.025 1.00 12.83 ? 321 VAL A N 1
ATOM 1486 C CA . VAL A 1 203 ? 45.321 -9.798 50.629 1.00 13.43 ? 321 VAL A CA 1
ATOM 1487 C C . VAL A 1 203 ? 45.192 -11.311 50.483 1.00 13.77 ? 321 VAL A C 1
ATOM 1488 O O . VAL A 1 203 ? 46.151 -11.998 50.142 1.00 13.74 ? 321 VAL A O 1
ATOM 1489 C CB . VAL A 1 203 ? 45.497 -9.442 52.134 1.00 13.34 ? 321 VAL A CB 1
ATOM 1490 C CG1 . VAL A 1 203 ? 46.518 -10.377 52.796 1.00 14.76 ? 321 VAL A CG1 1
ATOM 1491 C CG2 . VAL A 1 203 ? 45.924 -7.992 52.295 1.00 13.93 ? 321 VAL A CG2 1
ATOM 1492 N N . ARG A 1 204 ? 44.002 -11.830 50.721 1.00 14.64 ? 322 ARG A N 1
ATOM 1493 C CA . ARG A 1 204 ? 43.798 -13.258 50.596 1.00 15.80 ? 322 ARG A CA 1
ATOM 1494 C C . ARG A 1 204 ? 43.921 -13.701 49.144 1.00 15.24 ? 322 ARG A C 1
ATOM 1495 O O . ARG A 1 204 ? 44.231 -14.853 48.872 1.00 15.01 ? 322 ARG A O 1
ATOM 1496 C CB . ARG A 1 204 ? 42.438 -13.657 51.132 1.00 16.84 ? 322 ARG A CB 1
ATOM 1497 C CG . ARG A 1 204 ? 42.370 -13.689 52.634 1.00 20.58 ? 322 ARG A CG 1
ATOM 1498 C CD . ARG A 1 204 ? 41.120 -14.344 53.146 1.00 27.12 ? 322 ARG A CD 1
ATOM 1499 N NE . ARG A 1 204 ? 41.100 -14.406 54.599 1.00 32.19 ? 322 ARG A NE 1
ATOM 1500 C CZ . ARG A 1 204 ? 40.059 -14.811 55.300 1.00 34.63 ? 322 ARG A CZ 1
ATOM 1501 N NH1 . ARG A 1 204 ? 38.955 -15.186 54.675 1.00 35.24 ? 322 ARG A NH1 1
ATOM 1502 N NH2 . ARG A 1 204 ? 40.117 -14.842 56.626 1.00 36.87 ? 322 ARG A NH2 1
ATOM 1503 N N . SER A 1 205 ? 43.679 -12.776 48.222 1.00 14.86 ? 323 SER A N 1
ATOM 1504 C CA . SER A 1 205 ? 43.747 -13.080 46.796 1.00 15.22 ? 323 SER A CA 1
ATOM 1505 C C . SER A 1 205 ? 45.135 -12.865 46.230 1.00 15.08 ? 323 SER A C 1
ATOM 1506 O O . SER A 1 205 ? 45.333 -12.945 45.013 1.00 15.38 ? 323 SER A O 1
ATOM 1507 C CB . SER A 1 205 ? 42.734 -12.246 46.020 1.00 15.35 ? 323 SER A CB 1
ATOM 1508 O OG . SER A 1 205 ? 41.423 -12.580 46.420 1.00 17.29 ? 323 SER A OG 1
ATOM 1509 N N . GLY A 1 206 ? 46.086 -12.545 47.100 1.00 14.49 ? 324 GLY A N 1
ATOM 1510 C CA . GLY A 1 206 ? 47.469 -12.425 46.685 1.00 14.52 ? 324 GLY A CA 1
ATOM 1511 C C . GLY A 1 206 ? 48.045 -11.030 46.495 1.00 15.09 ? 324 GLY A C 1
ATOM 1512 O O . GLY A 1 206 ? 49.132 -10.896 45.948 1.00 15.18 ? 324 GLY A O 1
ATOM 1513 N N . ALA A 1 207 ? 47.353 -9.995 46.958 1.00 15.27 ? 325 ALA A N 1
ATOM 1514 C CA . ALA A 1 207 ? 47.876 -8.631 46.796 1.00 16.15 ? 325 ALA A CA 1
ATOM 1515 C C . ALA A 1 207 ? 49.259 -8.469 47.445 1.00 16.85 ? 325 ALA A C 1
ATOM 1516 O O . ALA A 1 207 ? 49.488 -8.935 48.557 1.00 16.19 ? 325 ALA A O 1
ATOM 1517 C CB . ALA A 1 207 ? 46.910 -7.619 47.348 1.00 15.89 ? 325 ALA A CB 1
ATOM 1518 N N . ASP A 1 208 ? 50.166 -7.799 46.734 1.00 17.70 ? 326 ASP A N 1
ATOM 1519 C CA . ASP A 1 208 ? 51.544 -7.579 47.196 1.00 19.01 ? 326 ASP A CA 1
ATOM 1520 C C . ASP A 1 208 ? 51.636 -6.315 48.050 1.00 19.40 ? 326 ASP A C 1
ATOM 1521 O O . ASP A 1 208 ? 51.481 -5.202 47.544 1.00 19.31 ? 326 ASP A O 1
ATOM 1522 C CB . ASP A 1 208 ? 52.473 -7.463 45.982 1.00 19.56 ? 326 ASP A CB 1
ATOM 1523 C CG . ASP A 1 208 ? 53.941 -7.281 46.363 1.00 21.66 ? 326 ASP A CG 1
ATOM 1524 O OD1 . ASP A 1 208 ? 54.254 -7.129 47.565 1.00 24.08 ? 326 ASP A OD1 1
ATOM 1525 O OD2 . ASP A 1 208 ? 54.854 -7.283 45.507 1.00 24.34 ? 326 ASP A OD2 1
ATOM 1526 N N . SER A 1 209 ? 51.889 -6.485 49.344 1.00 20.03 ? 327 SER A N 1
ATOM 1527 C CA . SER A 1 209 ? 51.969 -5.347 50.267 1.00 21.59 ? 327 SER A CA 1
ATOM 1528 C C . SER A 1 209 ? 53.341 -4.654 50.316 1.00 22.14 ? 327 SER A C 1
ATOM 1529 O O . SER A 1 209 ? 53.531 -3.708 51.083 1.00 22.31 ? 327 SER A O 1
ATOM 1530 C CB . SER A 1 209 ? 51.560 -5.772 51.683 1.00 21.33 ? 327 SER A CB 1
ATOM 1531 O OG . SER A 1 209 ? 52.435 -6.769 52.178 1.00 22.90 ? 327 SER A OG 1
ATOM 1532 N N . SER A 1 210 ? 54.286 -5.123 49.510 1.00 23.30 ? 328 SER A N 1
ATOM 1533 C CA . SER A 1 210 ? 55.627 -4.530 49.474 1.00 24.31 ? 328 SER A CA 1
ATOM 1534 C C . SER A 1 210 ? 55.833 -3.696 48.212 1.00 24.35 ? 328 SER A C 1
ATOM 1535 O O . SER A 1 210 ? 56.900 -3.123 47.998 1.00 24.83 ? 328 SER A O 1
ATOM 1536 C CB . SER A 1 210 ? 56.693 -5.619 49.539 1.00 24.43 ? 328 SER A CB 1
ATOM 1537 O OG . SER A 1 210 ? 56.795 -6.296 48.292 1.00 26.30 ? 328 SER A OG 1
ATOM 1538 N N . LEU A 1 211 ? 54.806 -3.635 47.376 1.00 24.38 ? 329 LEU A N 1
ATOM 1539 C CA . LEU A 1 211 ? 54.887 -2.904 46.120 1.00 24.56 ? 329 LEU A CA 1
ATOM 1540 C C . LEU A 1 211 ? 54.974 -1.398 46.363 1.00 24.60 ? 329 LEU A C 1
ATOM 1541 O O . LEU A 1 211 ? 54.116 -0.820 47.025 1.00 24.15 ? 329 LEU A O 1
ATOM 1542 C CB . LEU A 1 211 ? 53.673 -3.228 45.258 1.00 24.54 ? 329 LEU A CB 1
ATOM 1543 C CG . LEU A 1 211 ? 53.695 -2.702 43.832 1.00 25.63 ? 329 LEU A CG 1
ATOM 1544 C CD1 . LEU A 1 211 ? 54.927 -3.205 43.086 1.00 24.98 ? 329 LEU A CD1 1
ATOM 1545 C CD2 . LEU A 1 211 ? 52.423 -3.122 43.127 1.00 26.70 ? 329 LEU A CD2 1
ATOM 1546 N N . LYS A 1 212 ? 56.018 -0.771 45.831 1.00 25.08 ? 330 LYS A N 1
ATOM 1547 C CA . LYS A 1 212 ? 56.231 0.667 46.024 1.00 25.92 ? 330 LYS A CA 1
ATOM 1548 C C . LYS A 1 212 ? 55.633 1.501 44.897 1.00 25.76 ? 330 LYS A C 1
ATOM 1549 O O . LYS A 1 212 ? 55.665 1.095 43.735 1.00 26.39 ? 330 LYS A O 1
ATOM 1550 C CB . LYS A 1 212 ? 57.726 0.975 46.133 1.00 26.23 ? 330 LYS A CB 1
ATOM 1551 C CG . LYS A 1 212 ? 58.464 0.177 47.189 1.00 27.73 ? 330 LYS A CG 1
ATOM 1552 C CD . LYS A 1 212 ? 59.953 0.536 47.200 1.00 30.03 ? 330 LYS A CD 1
ATOM 1553 C CE . LYS A 1 212 ? 60.178 1.957 47.668 1.00 31.16 ? 330 LYS A CE 1
ATOM 1554 N NZ . LYS A 1 212 ? 59.833 2.132 49.114 1.00 32.16 ? 330 LYS A NZ 1
ATOM 1555 N N . ASN A 1 213 ? 55.055 2.651 45.241 1.00 25.45 ? 331 ASN A N 1
ATOM 1556 C CA . ASN A 1 213 ? 54.589 3.586 44.222 1.00 25.17 ? 331 ASN A CA 1
ATOM 1557 C C . ASN A 1 213 ? 55.650 4.646 43.946 1.00 25.22 ? 331 ASN A C 1
ATOM 1558 O O . ASN A 1 213 ? 56.775 4.543 44.442 1.00 24.85 ? 331 ASN A O 1
ATOM 1559 C CB . ASN A 1 213 ? 53.223 4.210 44.559 1.00 24.66 ? 331 ASN A CB 1
ATOM 1560 C CG . ASN A 1 213 ? 53.233 5.043 45.852 1.00 23.67 ? 331 ASN A CG 1
ATOM 1561 O OD1 . ASN A 1 213 ? 54.269 5.525 46.305 1.00 22.02 ? 331 ASN A OD1 1
ATOM 1562 N ND2 . ASN A 1 213 ? 52.058 5.221 46.430 1.00 22.39 ? 331 ASN A ND2 1
ATOM 1563 N N . CYS A 1 214 ? 55.299 5.653 43.154 1.00 25.60 ? 332 CYS A N 1
ATOM 1564 C CA . CYS A 1 214 ? 56.272 6.681 42.765 1.00 26.23 ? 332 CYS A CA 1
ATOM 1565 C C . CYS A 1 214 ? 56.734 7.509 43.957 1.00 25.55 ? 332 CYS A C 1
ATOM 1566 O O . CYS A 1 214 ? 57.803 8.121 43.923 1.00 25.66 ? 332 CYS A O 1
ATOM 1567 C CB . CYS A 1 214 ? 55.695 7.597 41.688 1.00 26.40 ? 332 CYS A CB 1
ATOM 1568 S SG . CYS A 1 214 ? 54.195 8.469 42.172 1.00 30.29 ? 332 CYS A SG 1
ATOM 1569 N N . HIS A 1 215 ? 55.923 7.532 45.006 1.00 25.11 ? 333 HIS A N 1
ATOM 1570 C CA . HIS A 1 215 ? 56.267 8.266 46.217 1.00 24.88 ? 333 HIS A CA 1
ATOM 1571 C C . HIS A 1 215 ? 57.082 7.362 47.137 1.00 24.41 ? 333 HIS A C 1
ATOM 1572 O O . HIS A 1 215 ? 57.471 7.763 48.236 1.00 24.64 ? 333 HIS A O 1
ATOM 1573 C CB . HIS A 1 215 ? 54.992 8.766 46.918 1.00 24.70 ? 333 HIS A CB 1
ATOM 1574 C CG . HIS A 1 215 ? 55.247 9.688 48.074 1.00 25.85 ? 333 HIS A CG 1
ATOM 1575 N ND1 . HIS A 1 215 ? 54.643 9.523 49.304 1.00 26.69 ? 333 HIS A ND1 1
ATOM 1576 C CD2 . HIS A 1 215 ? 56.024 10.792 48.184 1.00 24.93 ? 333 HIS A CD2 1
ATOM 1577 C CE1 . HIS A 1 215 ? 55.042 10.482 50.122 1.00 26.42 ? 333 HIS A CE1 1
ATOM 1578 N NE2 . HIS A 1 215 ? 55.884 11.262 49.468 1.00 26.32 ? 333 HIS A NE2 1
ATOM 1579 N N . ASN A 1 216 ? 57.345 6.143 46.673 1.00 23.97 ? 334 ASN A N 1
ATOM 1580 C CA . ASN A 1 216 ? 58.108 5.156 47.443 1.00 23.95 ? 334 ASN A CA 1
ATOM 1581 C C . ASN A 1 216 ? 57.308 4.573 48.608 1.00 23.11 ? 334 ASN A C 1
ATOM 1582 O O . ASN A 1 216 ? 57.870 3.977 49.518 1.00 23.18 ? 334 ASN A O 1
ATOM 1583 C CB . ASN A 1 216 ? 59.433 5.747 47.953 1.00 24.37 ? 334 ASN A CB 1
ATOM 1584 C CG . ASN A 1 216 ? 60.358 6.194 46.824 1.00 26.38 ? 334 ASN A CG 1
ATOM 1585 O OD1 . ASN A 1 216 ? 61.288 6.981 47.040 1.00 28.78 ? 334 ASN A OD1 1
ATOM 1586 N ND2 . ASN A 1 216 ? 60.112 5.692 45.621 1.00 29.30 ? 334 ASN A ND2 1
ATOM 1587 N N . ASP A 1 217 ? 55.994 4.745 48.566 1.00 22.70 ? 335 ASP A N 1
ATOM 1588 C CA . ASP A 1 217 ? 55.101 4.216 49.595 1.00 22.18 ? 335 ASP A CA 1
ATOM 1589 C C . ASP A 1 217 ? 54.631 2.801 49.244 1.00 22.10 ? 335 ASP A C 1
ATOM 1590 O O . ASP A 1 217 ? 54.368 2.507 48.077 1.00 22.05 ? 335 ASP A O 1
ATOM 1591 C CB . ASP A 1 217 ? 53.859 5.100 49.698 1.00 22.34 ? 335 ASP A CB 1
ATOM 1592 C CG . ASP A 1 217 ? 54.022 6.246 50.665 1.00 22.30 ? 335 ASP A CG 1
ATOM 1593 O OD1 . ASP A 1 217 ? 55.020 6.282 51.413 1.00 23.16 ? 335 ASP A OD1 1
ATOM 1594 O OD2 . ASP A 1 217 ? 53.178 7.160 50.749 1.00 23.13 ? 335 ASP A OD2 1
ATOM 1595 N N . THR A 1 218 ? 54.531 1.929 50.249 1.00 21.72 ? 336 THR A N 1
ATOM 1596 C CA . THR A 1 218 ? 53.913 0.613 50.062 1.00 21.27 ? 336 THR A CA 1
ATOM 1597 C C . THR A 1 218 ? 52.541 0.669 50.720 1.00 21.20 ? 336 THR A C 1
ATOM 1598 O O . THR A 1 218 ? 52.272 1.569 51.513 1.00 20.45 ? 336 THR A O 1
ATOM 1599 C CB . THR A 1 218 ? 54.739 -0.505 50.734 1.00 21.16 ? 336 THR A CB 1
ATOM 1600 O OG1 . THR A 1 218 ? 54.884 -0.221 52.135 1.00 20.46 ? 336 THR A OG1 1
ATOM 1601 C CG2 . THR A 1 218 ? 56.162 -0.543 50.207 1.00 21.32 ? 336 THR A CG2 1
ATOM 1602 N N . PRO A 1 219 ? 51.670 -0.286 50.414 1.00 21.24 ? 337 PRO A N 1
ATOM 1603 C CA . PRO A 1 219 ? 50.351 -0.318 51.049 1.00 21.65 ? 337 PRO A CA 1
ATOM 1604 C C . PRO A 1 219 ? 50.494 -0.343 52.573 1.00 22.38 ? 337 PRO A C 1
ATOM 1605 O O . PRO A 1 219 ? 49.647 0.189 53.295 1.00 22.58 ? 337 PRO A O 1
ATOM 1606 C CB . PRO A 1 219 ? 49.748 -1.626 50.531 1.00 21.75 ? 337 PRO A CB 1
ATOM 1607 C CG . PRO A 1 219 ? 50.434 -1.849 49.222 1.00 21.29 ? 337 PRO A CG 1
ATOM 1608 C CD . PRO A 1 219 ? 51.851 -1.385 49.448 1.00 21.46 ? 337 PRO A CD 1
ATOM 1609 N N . LEU A 1 220 ? 51.569 -0.951 53.058 1.00 22.87 ? 338 LEU A N 1
ATOM 1610 C CA . LEU A 1 220 ? 51.813 -0.993 54.489 1.00 23.86 ? 338 LEU A CA 1
ATOM 1611 C C . LEU A 1 220 ? 52.041 0.426 55.026 1.00 23.86 ? 338 LEU A C 1
ATOM 1612 O O . LEU A 1 220 ? 51.477 0.812 56.054 1.00 24.03 ? 338 LEU A O 1
ATOM 1613 C CB . LEU A 1 220 ? 53.016 -1.890 54.804 1.00 24.01 ? 338 LEU A CB 1
ATOM 1614 C CG . LEU A 1 220 ? 52.789 -2.951 55.882 1.00 26.13 ? 338 LEU A CG 1
ATOM 1615 C CD1 . LEU A 1 220 ? 54.124 -3.441 56.450 1.00 27.46 ? 338 LEU A CD1 1
ATOM 1616 C CD2 . LEU A 1 220 ? 51.896 -2.420 56.991 1.00 27.34 ? 338 LEU A CD2 1
ATOM 1617 N N . MET A 1 221 ? 52.836 1.212 54.305 1.00 23.91 ? 339 MET A N 1
ATOM 1618 C CA . MET A 1 221 ? 53.181 2.566 54.740 1.00 24.42 ? 339 MET A CA 1
ATOM 1619 C C . MET A 1 221 ? 52.028 3.566 54.707 1.00 24.83 ? 339 MET A C 1
ATOM 1620 O O . MET A 1 221 ? 52.086 4.591 55.378 1.00 24.83 ? 339 MET A O 1
ATOM 1621 C CB . MET A 1 221 ? 54.361 3.102 53.939 1.00 24.29 ? 339 MET A CB 1
ATOM 1622 C CG . MET A 1 221 ? 55.625 2.301 54.131 1.00 24.23 ? 339 MET A CG 1
ATOM 1623 S SD . MET A 1 221 ? 56.814 2.651 52.861 1.00 23.89 ? 339 MET A SD 1
ATOM 1624 C CE . MET A 1 221 ? 57.006 4.414 53.078 1.00 25.43 ? 339 MET A CE 1
ATOM 1625 N N . VAL A 1 222 ? 50.992 3.283 53.921 1.00 25.10 ? 340 VAL A N 1
ATOM 1626 C CA . VAL A 1 222 ? 49.848 4.187 53.850 1.00 25.70 ? 340 VAL A CA 1
ATOM 1627 C C . VAL A 1 222 ? 48.660 3.678 54.668 1.00 25.98 ? 340 VAL A C 1
ATOM 1628 O O . VAL A 1 222 ? 47.596 4.277 54.646 1.00 26.14 ? 340 VAL A O 1
ATOM 1629 C CB . VAL A 1 222 ? 49.393 4.449 52.395 1.00 25.60 ? 340 VAL A CB 1
ATOM 1630 C CG1 . VAL A 1 222 ? 50.540 5.007 51.560 1.00 25.69 ? 340 VAL A CG1 1
ATOM 1631 C CG2 . VAL A 1 222 ? 48.813 3.178 51.765 1.00 26.16 ? 340 VAL A CG2 1
ATOM 1632 N N . ALA A 1 223 ? 48.854 2.580 55.389 1.00 26.61 ? 341 ALA A N 1
ATOM 1633 C CA . ALA A 1 223 ? 47.782 1.992 56.185 1.00 27.38 ? 341 ALA A CA 1
ATOM 1634 C C . ALA A 1 223 ? 47.108 3.061 57.029 1.00 28.33 ? 341 ALA A C 1
ATOM 1635 O O . ALA A 1 223 ? 47.771 3.797 57.762 1.00 28.36 ? 341 ALA A O 1
ATOM 1636 C CB . ALA A 1 223 ? 48.318 0.886 57.056 1.00 27.32 ? 341 ALA A CB 1
ATOM 1637 N N . ARG A 1 224 ? 45.789 3.145 56.933 1.00 28.98 ? 342 ARG A N 1
ATOM 1638 C CA . ARG A 1 224 ? 45.059 4.188 57.638 1.00 29.92 ? 342 ARG A CA 1
ATOM 1639 C C . ARG A 1 224 ? 44.973 3.980 59.153 1.00 29.81 ? 342 ARG A C 1
ATOM 1640 O O . ARG A 1 224 ? 44.855 4.944 59.908 1.00 30.28 ? 342 ARG A O 1
ATOM 1641 C CB . ARG A 1 224 ? 43.663 4.356 57.050 1.00 30.25 ? 342 ARG A CB 1
ATOM 1642 C CG . ARG A 1 224 ? 43.049 5.700 57.352 1.00 32.21 ? 342 ARG A CG 1
ATOM 1643 C CD . ARG A 1 224 ? 41.857 6.041 56.491 1.00 35.87 ? 342 ARG A CD 1
ATOM 1644 N NE . ARG A 1 224 ? 41.487 7.447 56.612 1.00 38.20 ? 342 ARG A NE 1
ATOM 1645 C CZ . ARG A 1 224 ? 40.258 7.904 56.432 1.00 39.58 ? 342 ARG A CZ 1
ATOM 1646 N NH1 . ARG A 1 224 ? 39.280 7.065 56.122 1.00 40.57 ? 342 ARG A NH1 1
ATOM 1647 N NH2 . ARG A 1 224 ? 40.003 9.201 56.561 1.00 40.40 ? 342 ARG A NH2 1
ATOM 1648 N N . SER A 1 225 ? 45.031 2.727 59.592 1.00 29.65 ? 343 SER A N 1
ATOM 1649 C CA . SER A 1 225 ? 44.897 2.412 61.014 1.00 29.20 ? 343 SER A CA 1
ATOM 1650 C C . SER A 1 225 ? 45.596 1.112 61.380 1.00 28.57 ? 343 SER A C 1
ATOM 1651 O O . SER A 1 225 ? 46.062 0.378 60.515 1.00 28.37 ? 343 SER A O 1
ATOM 1652 C CB . SER A 1 225 ? 43.421 2.301 61.389 1.00 29.58 ? 343 SER A CB 1
ATOM 1653 O OG . SER A 1 225 ? 42.843 1.160 60.776 1.00 30.17 ? 343 SER A OG 1
ATOM 1654 N N . ARG A 1 226 ? 45.639 0.819 62.673 1.00 23.95 ? 344 ARG A N 1
ATOM 1655 C CA . ARG A 1 226 ? 46.281 -0.393 63.161 1.00 20.35 ? 344 ARG A CA 1
ATOM 1656 C C . ARG A 1 226 ? 45.543 -1.668 62.722 1.00 18.61 ? 344 ARG A C 1
ATOM 1657 O O . ARG A 1 226 ? 46.147 -2.730 62.596 1.00 17.67 ? 344 ARG A O 1
ATOM 1658 C CB . ARG A 1 226 ? 46.341 -0.374 64.700 1.00 19.95 ? 344 ARG A CB 1
ATOM 1659 C CG . ARG A 1 226 ? 47.437 0.539 65.248 1.00 20.39 ? 344 ARG A CG 1
ATOM 1660 C CD . ARG A 1 226 ? 47.346 1.967 64.712 1.00 20.95 ? 344 ARG A CD 1
ATOM 1661 N NE . ARG A 1 226 ? 48.664 2.591 64.517 1.00 22.31 ? 344 ARG A NE 1
ATOM 1662 C CZ . ARG A 1 226 ? 49.078 3.113 63.355 1.00 21.58 ? 344 ARG A CZ 1
ATOM 1663 N NH1 . ARG A 1 226 ? 48.234 3.276 62.331 1.00 22.21 ? 344 ARG A NH1 1
ATOM 1664 N NH2 . ARG A 1 226 ? 50.338 3.509 63.123 1.00 21.90 ? 344 ARG A NH2 1
ATOM 1665 N N . ARG A 1 227 ? 44.237 -1.554 62.495 1.00 19.29 ? 345 ARG A N 1
ATOM 1666 C CA . ARG A 1 227 ? 43.443 -2.693 62.033 1.00 20.49 ? 345 ARG A CA 1
ATOM 1667 C C . ARG A 1 227 ? 43.878 -3.109 60.630 1.00 18.94 ? 345 ARG A C 1
ATOM 1668 O O . ARG A 1 227 ? 43.911 -4.290 60.308 1.00 20.31 ? 345 ARG A O 1
ATOM 1669 C CB . ARG A 1 227 ? 41.957 -2.320 62.001 1.00 19.70 ? 345 ARG A CB 1
ATOM 1670 C CG . ARG A 1 227 ? 41.039 -3.529 61.829 1.00 20.91 ? 345 ARG A CG 1
ATOM 1671 C CD . ARG A 1 227 ? 40.728 -4.237 63.146 1.00 21.51 ? 345 ARG A CD 1
ATOM 1672 N NE . ARG A 1 227 ? 39.295 -4.516 63.324 1.00 23.35 ? 345 ARG A NE 1
ATOM 1673 C CZ . ARG A 1 227 ? 38.810 -5.688 63.753 1.00 20.91 ? 345 ARG A CZ 1
ATOM 1674 N NH1 . ARG A 1 227 ? 39.447 -6.395 64.693 1.00 23.33 ? 345 ARG A NH1 1
ATOM 1675 N NH2 . ARG A 1 227 ? 37.677 -6.241 63.296 1.00 23.15 ? 345 ARG A NH2 1
ATOM 1676 N N . VAL A 1 228 ? 44.206 -2.129 59.798 1.00 24.57 ? 346 VAL A N 1
ATOM 1677 C CA . VAL A 1 228 ? 44.681 -2.404 58.444 1.00 24.17 ? 346 VAL A CA 1
ATOM 1678 C C . VAL A 1 228 ? 46.040 -3.083 58.489 1.00 24.21 ? 346 VAL A C 1
ATOM 1679 O O . VAL A 1 228 ? 46.271 -4.088 57.811 1.00 23.46 ? 346 VAL A O 1
ATOM 1680 C CB . VAL A 1 228 ? 44.773 -1.119 57.602 1.00 24.24 ? 346 VAL A CB 1
ATOM 1681 C CG1 . VAL A 1 228 ? 45.505 -1.387 56.282 1.00 24.34 ? 346 VAL A CG1 1
ATOM 1682 C CG2 . VAL A 1 228 ? 43.393 -0.565 57.338 1.00 23.95 ? 346 VAL A CG2 1
ATOM 1683 N N . ILE A 1 229 ? 46.941 -2.540 59.303 1.00 24.42 ? 347 ILE A N 1
ATOM 1684 C CA . ILE A 1 229 ? 48.272 -3.114 59.443 1.00 25.26 ? 347 ILE A CA 1
ATOM 1685 C C . ILE A 1 229 ? 48.164 -4.581 59.840 1.00 25.17 ? 347 ILE A C 1
ATOM 1686 O O . ILE A 1 229 ? 48.860 -5.443 59.298 1.00 24.70 ? 347 ILE A O 1
ATOM 1687 C CB . ILE A 1 229 ? 49.069 -2.354 60.510 1.00 25.48 ? 347 ILE A CB 1
ATOM 1688 C CG1 . ILE A 1 229 ? 48.873 -0.843 60.355 1.00 26.70 ? 347 ILE A CG1 1
ATOM 1689 C CG2 . ILE A 1 229 ? 50.539 -2.758 60.464 1.00 26.42 ? 347 ILE A CG2 1
ATOM 1690 C CD1 . ILE A 1 229 ? 50.061 -0.122 59.786 1.00 29.22 ? 347 ILE A CD1 1
ATOM 1691 N N . ASP A 1 230 ? 47.270 -4.852 60.786 1.00 22.35 ? 348 ASP A N 1
ATOM 1692 C CA . ASP A 1 230 ? 47.053 -6.206 61.289 1.00 20.67 ? 348 ASP A CA 1
ATOM 1693 C C . ASP A 1 230 ? 46.678 -7.163 60.168 1.00 21.12 ? 348 ASP A C 1
ATOM 1694 O O . ASP A 1 230 ? 47.157 -8.294 60.120 1.00 20.80 ? 348 ASP A O 1
ATOM 1695 C CB . ASP A 1 230 ? 45.925 -6.199 62.334 1.00 19.06 ? 348 ASP A CB 1
ATOM 1696 C CG . ASP A 1 230 ? 46.407 -5.840 63.740 1.00 20.96 ? 348 ASP A CG 1
ATOM 1697 O OD1 . ASP A 1 230 ? 47.662 -5.670 63.964 1.00 23.83 ? 348 ASP A OD1 1
ATOM 1698 O OD2 . ASP A 1 230 ? 45.559 -5.713 64.698 1.00 25.00 ? 348 ASP A OD2 1
ATOM 1699 N N . ILE A 1 231 ? 45.807 -6.706 59.276 1.00 26.57 ? 349 ILE A N 1
ATOM 1700 C CA . ILE A 1 231 ? 45.378 -7.517 58.142 1.00 27.23 ? 349 ILE A CA 1
ATOM 1701 C C . ILE A 1 231 ? 46.533 -7.738 57.159 1.00 27.94 ? 349 ILE A C 1
ATOM 1702 O O . ILE A 1 231 ? 46.782 -8.864 56.727 1.00 28.13 ? 349 ILE A O 1
ATOM 1703 C CB . ILE A 1 231 ? 44.165 -6.864 57.444 1.00 27.08 ? 349 ILE A CB 1
ATOM 1704 C CG1 . ILE A 1 231 ? 42.962 -6.864 58.391 1.00 26.88 ? 349 ILE A CG1 1
ATOM 1705 C CG2 . ILE A 1 231 ? 43.832 -7.597 56.154 1.00 26.58 ? 349 ILE A CG2 1
ATOM 1706 C CD1 . ILE A 1 231 ? 41.928 -5.792 58.098 1.00 28.39 ? 349 ILE A CD1 1
ATOM 1707 N N . LEU A 1 232 ? 47.253 -6.665 56.837 1.00 28.91 ? 350 LEU A N 1
ATOM 1708 C CA . LEU A 1 232 ? 48.379 -6.740 55.898 1.00 30.06 ? 350 LEU A CA 1
ATOM 1709 C C . LEU A 1 232 ? 49.472 -7.700 56.346 1.00 31.07 ? 350 LEU A C 1
ATOM 1710 O O . LEU A 1 232 ? 50.086 -8.382 55.523 1.00 31.22 ? 350 LEU A O 1
ATOM 1711 C CB . LEU A 1 232 ? 48.983 -5.355 55.672 1.00 29.49 ? 350 LEU A CB 1
ATOM 1712 C CG . LEU A 1 232 ? 48.110 -4.378 54.890 1.00 29.62 ? 350 LEU A CG 1
ATOM 1713 C CD1 . LEU A 1 232 ? 48.811 -3.034 54.743 1.00 28.99 ? 350 LEU A CD1 1
ATOM 1714 C CD2 . LEU A 1 232 ? 47.767 -4.961 53.528 1.00 29.30 ? 350 LEU A CD2 1
ATOM 1715 N N . ARG A 1 233 ? 49.707 -7.752 57.653 1.00 32.46 ? 351 ARG A N 1
ATOM 1716 C CA . ARG A 1 233 ? 50.772 -8.577 58.208 1.00 34.10 ? 351 ARG A CA 1
ATOM 1717 C C . ARG A 1 233 ? 50.328 -10.001 58.529 1.00 34.74 ? 351 ARG A C 1
ATOM 1718 O O . ARG A 1 233 ? 51.145 -10.842 58.900 1.00 35.21 ? 351 ARG A O 1
ATOM 1719 C CB . ARG A 1 233 ? 51.375 -7.908 59.446 1.00 34.31 ? 351 ARG A CB 1
ATOM 1720 C CG . ARG A 1 233 ? 52.302 -6.752 59.114 1.00 35.75 ? 351 ARG A CG 1
ATOM 1721 C CD . ARG A 1 233 ? 53.054 -6.176 60.305 1.00 38.37 ? 351 ARG A CD 1
ATOM 1722 N NE . ARG A 1 233 ? 54.100 -5.254 59.873 1.00 40.74 ? 351 ARG A NE 1
ATOM 1723 C CZ . ARG A 1 233 ? 54.458 -4.158 60.534 1.00 42.09 ? 351 ARG A CZ 1
ATOM 1724 N NH1 . ARG A 1 233 ? 53.857 -3.837 61.674 1.00 42.74 ? 351 ARG A NH1 1
ATOM 1725 N NH2 . ARG A 1 233 ? 55.423 -3.380 60.054 1.00 42.67 ? 351 ARG A NH2 1
ATOM 1726 N N . GLY A 1 234 ? 49.037 -10.270 58.372 1.00 35.34 ? 352 GLY A N 1
ATOM 1727 C CA . GLY A 1 234 ? 48.503 -11.592 58.642 1.00 35.94 ? 352 GLY A CA 1
ATOM 1728 C C . GLY A 1 234 ? 48.186 -11.803 60.111 1.00 36.55 ? 352 GLY A C 1
ATOM 1729 O O . GLY A 1 234 ? 47.421 -12.703 60.471 1.00 37.28 ? 352 GLY A O 1
HETATM 1730 O O . HOH B 2 . ? 25.942 -2.431 33.227 1.00 14.12 ? 360 HOH A O 1
HETATM 1731 O O . HOH B 2 . ? 34.458 -1.817 24.690 1.00 9.67 ? 361 HOH A O 1
HETATM 1732 O O . HOH B 2 . ? 41.013 -5.607 36.276 1.00 12.91 ? 362 HOH A O 1
HETATM 1733 O O . HOH B 2 . ? 46.856 -4.682 45.008 1.00 13.15 ? 363 HOH A O 1
HETATM 1734 O O . HOH B 2 . ? 45.858 -3.544 41.626 1.00 13.75 ? 364 HOH A O 1
HETATM 1735 O O . HOH B 2 . ? 46.282 -11.759 40.212 1.00 14.12 ? 365 HOH A O 1
HETATM 1736 O O . HOH B 2 . ? 4.191 2.963 16.054 1.00 17.77 ? 366 HOH A O 1
HETATM 1737 O O . HOH B 2 . ? 46.139 -16.358 47.656 1.00 20.10 ? 367 HOH A O 1
HETATM 1738 O O . HOH B 2 . ? 35.239 -4.414 27.313 1.00 12.24 ? 368 HOH A O 1
HETATM 1739 O O . HOH B 2 . ? 21.314 1.048 12.877 1.00 15.55 ? 369 HOH A O 1
HETATM 1740 O O . HOH B 2 . ? 32.998 9.102 25.912 1.00 21.13 ? 370 HOH A O 1
HETATM 1741 O O . HOH B 2 . ? 15.365 6.790 9.906 1.00 20.78 ? 371 HOH A O 1
HETATM 1742 O O . HOH B 2 . ? 34.546 3.102 20.625 1.00 13.16 ? 372 HOH A O 1
HETATM 1743 O O . HOH B 2 . ? 24.586 1.126 14.002 1.00 25.62 ? 373 HOH A O 1
HETATM 1744 O O . HOH B 2 . ? 43.713 -5.750 37.210 1.00 16.87 ? 374 HOH A O 1
HETATM 1745 O O . HOH B 2 . ? 3.990 2.148 18.686 1.00 15.24 ? 375 HOH A O 1
HETATM 1746 O O . HOH B 2 . ? 18.000 -6.493 30.583 1.00 25.51 ? 376 HOH A O 1
HETATM 1747 O O . HOH B 2 . ? 44.645 -12.583 42.325 1.00 17.79 ? 377 HOH A O 1
HETATM 1748 O O . HOH B 2 . ? 48.695 -11.305 49.779 1.00 20.35 ? 378 HOH A O 1
HETATM 1749 O O . HOH B 2 . ? 38.307 -8.491 23.726 1.00 21.78 ? 379 HOH A O 1
HETATM 1750 O O . HOH B 2 . ? 31.126 5.414 13.644 1.00 24.68 ? 380 HOH A O 1
HETATM 1751 O O . HOH B 2 . ? 38.261 -12.749 32.535 1.00 24.60 ? 381 HOH A O 1
HETATM 1752 O O . HOH B 2 . ? 45.628 -12.682 37.489 1.00 19.05 ? 382 HOH A O 1
HETATM 1753 O O . HOH B 2 . ? 25.758 -6.280 11.374 1.00 19.76 ? 383 HOH A O 1
HETATM 1754 O O . HOH B 2 . ? 29.187 3.671 33.879 1.00 24.30 ? 384 HOH A O 1
HETATM 1755 O O . HOH B 2 . ? 24.148 9.299 8.406 1.00 30.17 ? 385 HOH A O 1
HETATM 1756 O O . HOH B 2 . ? 29.200 -2.911 20.000 1.00 18.57 ? 386 HOH A O 1
HETATM 1757 O O . HOH B 2 . ? 12.486 -6.186 22.261 1.00 20.33 ? 387 HOH A O 1
HETATM 1758 O O . HOH B 2 . ? 31.366 -2.548 49.320 1.00 26.58 ? 388 HOH A O 1
HETATM 1759 O O . HOH B 2 . ? 37.955 -4.696 28.536 1.00 12.94 ? 389 HOH A O 1
HETATM 1760 O O . HOH B 2 . ? 49.773 -4.645 45.760 1.00 25.71 ? 390 HOH A O 1
HETATM 1761 O O . HOH B 2 . ? 33.704 2.922 14.428 1.00 23.96 ? 391 HOH A O 1
HETATM 1762 O O . HOH B 2 . ? 14.900 2.288 28.175 1.00 28.91 ? 392 HOH A O 1
HETATM 1763 O O . HOH B 2 . ? 35.124 -4.947 58.896 1.00 36.37 ? 393 HOH A O 1
HETATM 1764 O O . HOH B 2 . ? 10.113 5.068 23.774 1.00 24.32 ? 394 HOH A O 1
HETATM 1765 O O . HOH B 2 . ? 15.488 10.867 16.129 1.00 29.00 ? 395 HOH A O 1
HETATM 1766 O O . HOH B 2 . ? 29.281 -4.097 46.591 1.00 30.17 ? 396 HOH A O 1
HETATM 1767 O O . HOH B 2 . ? 41.766 3.950 26.393 1.00 21.99 ? 397 HOH A O 1
HETATM 1768 O O . HOH B 2 . ? 23.443 8.042 22.152 1.00 27.52 ? 398 HOH A O 1
HETATM 1769 O O . HOH B 2 . ? 31.911 -3.078 20.919 1.00 21.79 ? 399 HOH A O 1
HETATM 1770 O O . HOH B 2 . ? 36.009 -0.566 56.854 1.00 25.49 ? 400 HOH A O 1
HETATM 1771 O O . HOH B 2 . ? 16.145 7.825 7.493 1.00 37.24 ? 401 HOH A O 1
HETATM 1772 O O . HOH B 2 . ? 30.028 -14.155 21.654 1.00 31.95 ? 402 HOH A O 1
HETATM 1773 O O . HOH B 2 . ? 36.429 -8.502 21.446 1.00 30.83 ? 403 HOH A O 1
HETATM 1774 O O . HOH B 2 . ? 8.316 5.472 11.287 1.00 23.44 ? 404 HOH A O 1
HETATM 1775 O O . HOH B 2 . ? 45.899 10.884 31.130 1.00 28.90 ? 405 HOH A O 1
HETATM 1776 O O . HOH B 2 . ? 32.455 -0.472 40.773 1.00 30.36 ? 406 HOH A O 1
HETATM 1777 O O . HOH B 2 . ? 34.493 -1.556 52.038 1.00 32.00 ? 407 HOH A O 1
HETATM 1778 O O . HOH B 2 . ? 50.255 -2.777 35.706 1.00 27.90 ? 408 HOH A O 1
HETATM 1779 O O . HOH B 2 . ? 48.122 5.629 47.060 1.00 64.24 ? 409 HOH A O 1
HETATM 1780 O O . HOH B 2 . ? 47.694 -5.921 34.587 1.00 23.56 ? 410 HOH A O 1
HETATM 1781 O O . HOH B 2 . ? 41.243 -3.452 19.267 1.00 32.60 ? 411 HOH A O 1
HETATM 1782 O O . HOH B 2 . ? 24.725 10.158 20.682 1.00 19.77 ? 412 HOH A O 1
HETATM 1783 O O . HOH B 2 . ? 43.011 -7.500 24.604 1.00 47.37 ? 413 HOH A O 1
HETATM 1784 O O . HOH B 2 . ? 58.519 -2.753 44.503 1.00 37.35 ? 414 HOH A O 1
HETATM 1785 O O . HOH B 2 . ? 14.085 -10.240 16.302 1.00 20.21 ? 415 HOH A O 1
HETATM 1786 O O . HOH B 2 . ? 32.677 6.920 29.514 1.00 27.60 ? 416 HOH A O 1
HETATM 1787 O O . HOH B 2 . ? 2.959 -1.893 12.533 1.00 29.51 ? 417 HOH A O 1
HETATM 1788 O O . HOH B 2 . ? 17.162 -8.071 32.360 1.00 32.06 ? 418 HOH A O 1
HETATM 1789 O O . HOH B 2 . ? 27.843 -3.741 9.077 1.00 38.65 ? 419 HOH A O 1
HETATM 1790 O O . HOH B 2 . ? 35.129 -14.217 44.815 1.00 27.12 ? 420 HOH A O 1
HETATM 1791 O O . HOH B 2 . ? 8.784 -2.930 3.301 1.00 35.89 ? 421 HOH A O 1
HETATM 1792 O O . HOH B 2 . ? 7.179 8.995 19.375 1.00 33.51 ? 422 HOH A O 1
HETATM 1793 O O . HOH B 2 . ? 38.904 6.602 21.727 1.00 23.12 ? 423 HOH A O 1
HETATM 1794 O O . HOH B 2 . ? 14.987 -8.807 6.478 1.00 45.52 ? 424 HOH A O 1
HETATM 1795 O O . HOH B 2 . ? 31.325 -15.580 38.523 1.00 34.17 ? 425 HOH A O 1
HETATM 1796 O O . HOH B 2 . ? 32.897 -4.064 12.405 1.00 34.28 ? 426 HOH A O 1
HETATM 1797 O O . HOH B 2 . ? 17.334 -4.104 30.445 1.00 39.81 ? 427 HOH A O 1
HETATM 1798 O O . HOH B 2 . ? 40.128 -7.201 20.171 1.00 38.56 ? 428 HOH A O 1
HETATM 1799 O O . HOH B 2 . ? 31.239 10.100 16.812 1.00 31.00 ? 429 HOH A O 1
HETATM 1800 O O . HOH B 2 . ? 26.196 8.298 24.716 1.00 28.33 ? 430 HOH A O 1
HETATM 1801 O O . HOH B 2 . ? 51.581 7.242 48.599 1.00 23.65 ? 431 HOH A O 1
HETATM 1802 O O . HOH B 2 . ? 28.786 16.021 13.297 1.00 28.41 ? 432 HOH A O 1
HETATM 1803 O O . HOH B 2 . ? 26.806 -4.886 42.372 1.00 35.04 ? 433 HOH A O 1
HETATM 1804 O O . HOH B 2 . ? 30.708 6.041 31.498 1.00 27.97 ? 434 HOH A O 1
HETATM 1805 O O . HOH B 2 . ? 15.990 -11.172 14.154 1.00 26.16 ? 435 HOH A O 1
HETATM 1806 O O . HOH B 2 . ? 11.544 -10.229 14.577 1.00 47.55 ? 436 HOH A O 1
HETATM 1807 O O . HOH B 2 . ? 40.274 -14.607 44.637 1.00 40.34 ? 437 HOH A O 1
HETATM 1808 O O . HOH B 2 . ? 23.519 -1.374 6.401 1.00 35.66 ? 438 HOH A O 1
HETATM 1809 O O . HOH B 2 . ? 18.860 -11.389 24.615 1.00 21.86 ? 439 HOH A O 1
HETATM 1810 O O . HOH B 2 . ? 37.284 -13.072 45.914 1.00 38.46 ? 440 HOH A O 1
HETATM 1811 O O . HOH B 2 . ? 26.266 -14.715 31.300 1.00 33.07 ? 441 HOH A O 1
HETATM 1812 O O . HOH B 2 . ? 19.351 -9.444 34.367 1.00 43.18 ? 442 HOH A O 1
HETATM 1813 O O . HOH B 2 . ? 35.193 -10.748 21.512 1.00 33.24 ? 443 HOH A O 1
HETATM 1814 O O . HOH B 2 . ? 22.602 13.102 9.104 1.00 47.11 ? 444 HOH A O 1
HETATM 1815 O O . HOH B 2 . ? 19.471 -5.077 -1.347 1.00 47.58 ? 445 HOH A O 1
HETATM 1816 O O . HOH B 2 . ? 46.236 -0.709 35.838 1.00 21.31 ? 446 HOH A O 1
HETATM 1817 O O . HOH B 2 . ? 49.210 1.975 34.324 1.00 27.80 ? 447 HOH A O 1
HETATM 1818 O O . HOH B 2 . ? 27.549 -7.832 12.529 1.00 26.48 ? 448 HOH A O 1
HETATM 1819 O O . HOH B 2 . ? 16.406 -11.807 23.116 1.00 48.40 ? 449 HOH A O 1
HETATM 1820 O O . HOH B 2 . ? 4.954 6.249 13.511 1.00 30.92 ? 450 HOH A O 1
HETATM 1821 O O . HOH B 2 . ? 28.136 -16.747 28.234 1.00 31.38 ? 451 HOH A O 1
HETATM 1822 O O . HOH B 2 . ? 42.487 -11.674 55.194 1.00 33.46 ? 452 HOH A O 1
HETATM 1823 O O . HOH B 2 . ? 48.474 7.562 43.387 1.00 64.22 ? 453 HOH A O 1
HETATM 1824 O O . HOH B 2 . ? 41.104 -8.946 21.903 1.00 46.31 ? 454 HOH A O 1
HETATM 1825 O O . HOH B 2 . ? 39.716 -17.508 39.057 1.00 43.01 ? 455 HOH A O 1
HETATM 1826 O O . HOH B 2 . ? 48.446 -2.273 33.848 1.00 33.92 ? 456 HOH A O 1
HETATM 1827 O O . HOH B 2 . ? 28.127 -13.875 17.456 1.00 38.68 ? 457 HOH A O 1
HETATM 1828 O O . HOH B 2 . ? 56.003 5.810 39.445 1.00 52.47 ? 458 HOH A O 1
HETATM 1829 O O . HOH B 2 . ? 17.550 0.917 31.731 1.00 47.34 ? 459 HOH A O 1
HETATM 1830 O O . HOH B 2 . ? 28.765 8.544 32.321 1.00 57.95 ? 460 HOH A O 1
HETATM 1831 O O . HOH B 2 . ? 14.358 8.318 5.371 1.00 54.94 ? 461 HOH A O 1
HETATM 1832 O O . HOH B 2 . ? 16.998 -9.121 10.256 1.00 30.42 ? 462 HOH A O 1
HETATM 1833 O O . HOH B 2 . ? 10.748 -1.053 17.766 1.00 32.02 ? 463 HOH A O 1
HETATM 1834 O O . HOH B 2 . ? 6.280 3.945 12.811 1.00 35.19 ? 464 HOH A O 1
HETATM 1835 O O . HOH B 2 . ? 34.050 -10.289 9.233 1.00 44.42 ? 465 HOH A O 1
HETATM 1836 O O . HOH B 2 . ? 27.601 6.194 31.808 1.00 60.40 ? 466 HOH A O 1
HETATM 1837 O O . HOH B 2 . ? 32.581 -3.655 51.836 1.00 36.23 ? 467 HOH A O 1
HETATM 1838 O O . HOH B 2 . ? 11.801 -12.124 7.945 1.00 56.86 ? 468 HOH A O 1
HETATM 1839 O O . HOH B 2 . ? 30.851 -4.523 54.190 1.00 43.38 ? 469 HOH A O 1
HETATM 1840 O O . HOH B 2 . ? 35.871 4.678 38.356 1.00 64.32 ? 470 HOH A O 1
HETATM 1841 O O . HOH B 2 . ? 26.800 0.740 17.328 1.00 21.96 ? 471 HOH A O 1
HETATM 1842 O O . HOH B 2 . ? 40.095 -11.130 29.983 1.00 41.83 ? 472 HOH A O 1
HETATM 1843 O O . HOH B 2 . ? 48.096 -17.349 49.556 1.00 41.89 ? 473 HOH A O 1
HETATM 1844 O O . HOH B 2 . ? 22.483 6.931 26.633 1.00 30.77 ? 474 HOH A O 1
HETATM 1845 O O . HOH B 2 . ? 14.573 -11.039 21.543 1.00 47.73 ? 475 HOH A O 1
HETATM 1846 O O . HOH B 2 . ? 10.531 -5.642 20.176 1.00 33.21 ? 476 HOH A O 1
HETATM 1847 O O . HOH B 2 . ? 25.205 4.102 33.497 1.00 37.31 ? 477 HOH A O 1
HETATM 1848 O O . HOH B 2 . ? 25.183 -12.418 32.794 1.00 34.19 ? 478 HOH A O 1
HETATM 1849 O O . HOH B 2 . ? 51.755 8.631 43.750 1.00 64.99 ? 479 HOH A O 1
HETATM 1850 O O . HOH B 2 . ? 28.120 1.669 10.011 1.00 40.73 ? 480 HOH A O 1
HETATM 1851 O O . HOH B 2 . ? 24.616 -13.328 35.078 1.00 34.43 ? 481 HOH A O 1
HETATM 1852 O O . HOH B 2 . ? 11.284 12.698 11.702 1.00 51.96 ? 482 HOH A O 1
HETATM 1853 O O . HOH B 2 . ? 39.122 7.345 45.276 1.00 79.01 ? 483 HOH A O 1
HETATM 1854 O O . HOH B 2 . ? 29.821 -8.100 41.724 1.00 50.96 ? 484 HOH A O 1
HETATM 1855 O O . HOH B 2 . ? 17.281 2.405 29.548 1.00 32.75 ? 485 HOH A O 1
HETATM 1856 O O . HOH B 2 . ? 35.627 7.724 46.721 1.00 42.99 ? 486 HOH A O 1
HETATM 1857 O O . HOH B 2 . ? 42.450 -12.932 40.819 1.00 32.09 ? 487 HOH A O 1
HETATM 1858 O O . HOH B 2 . ? 13.287 -11.034 11.014 1.00 54.41 ? 488 HOH A O 1
HETATM 1859 O O . HOH B 2 . ? 52.663 0.763 58.382 1.00 53.28 ? 489 HOH A O 1
HETATM 1860 O O . HOH B 2 . ? 17.051 5.120 27.909 1.00 35.85 ? 490 HOH A O 1
HETATM 1861 O O . HOH B 2 . ? 51.252 3.422 58.721 1.00 48.80 ? 491 HOH A O 1
HETATM 1862 O O . HOH B 2 . ? 48.307 -11.771 39.599 1.00 33.25 ? 492 HOH A O 1
HETATM 1863 O O . HOH B 2 . ? 30.173 -11.287 18.736 1.00 44.33 ? 493 HOH A O 1
HETATM 1864 O O . HOH B 2 . ? 22.409 -12.184 32.162 1.00 32.88 ? 494 HOH A O 1
HETATM 1865 O O . HOH B 2 . ? 56.775 -1.797 53.643 1.00 39.39 ? 495 HOH A O 1
HETATM 1866 O O . HOH B 2 . ? 25.603 16.059 13.236 1.00 48.50 ? 496 HOH A O 1
HETATM 1867 O O . HOH B 2 . ? 12.724 -12.294 19.138 1.00 46.18 ? 497 HOH A O 1
HETATM 1868 O O . HOH B 2 . ? 11.832 -13.630 21.993 1.00 38.71 ? 498 HOH A O 1
HETATM 1869 O O . HOH B 2 . ? 22.727 11.658 22.636 1.00 78.87 ? 499 HOH A O 1
HETATM 1870 O O . HOH B 2 . ? 15.765 -11.351 11.824 1.00 33.74 ? 500 HOH A O 1
HETATM 1871 O O . HOH B 2 . ? 10.430 2.311 22.017 1.00 2.00 ? 501 HOH A O 1
HETATM 1872 O O . HOH B 2 . ? 20.318 16.604 6.174 1.00 87.21 ? 502 HOH A O 1
HETATM 1873 O O . HOH B 2 . ? 17.507 13.691 9.262 1.00 49.98 ? 503 HOH A O 1
HETATM 1874 O O . HOH B 2 . ? 17.788 14.063 12.140 1.00 31.57 ? 504 HOH A O 1
HETATM 1875 O O . HOH B 2 . ? 17.297 10.452 7.641 1.00 45.69 ? 505 HOH A O 1
HETATM 1876 O O . HOH B 2 . ? 19.045 -15.664 24.915 1.00 47.26 ? 506 HOH A O 1
HETATM 1877 O O . HOH B 2 . ? 17.651 -1.881 31.538 1.00 50.33 ? 507 HOH A O 1
HETATM 1878 O O . HOH B 2 . ? 23.364 -6.406 39.485 1.00 44.77 ? 508 HOH A O 1
HETATM 1879 O O . HOH B 2 . ? 25.801 -12.009 40.075 1.00 64.61 ? 509 HOH A O 1
HETATM 1880 O O . HOH B 2 . ? 31.115 5.219 39.696 1.00 49.75 ? 510 HOH A O 1
HETATM 1881 O O . HOH B 2 . ? 31.557 4.984 33.813 1.00 31.99 ? 511 HOH A O 1
HETATM 1882 O O . HOH B 2 . ? 24.448 1.983 40.951 1.00 28.72 ? 512 HOH A O 1
HETATM 1883 O O . HOH B 2 . ? 26.976 3.068 40.184 1.00 40.98 ? 513 HOH A O 1
HETATM 1884 O O . HOH B 2 . ? 41.762 -3.709 25.549 1.00 33.12 ? 514 HOH A O 1
HETATM 1885 O O . HOH B 2 . ? 13.809 -4.790 28.339 1.00 44.22 ? 515 HOH A O 1
HETATM 1886 O O . HOH B 2 . ? 7.303 -0.983 -1.507 1.00 54.45 ? 516 HOH A O 1
HETATM 1887 O O . HOH B 2 . ? 28.095 11.508 13.037 1.00 48.29 ? 517 HOH A O 1
HETATM 1888 O O . HOH B 2 . ? 13.086 13.727 -1.113 1.00 45.07 ? 518 HOH A O 1
HETATM 1889 O O . HOH B 2 . ? 8.355 15.064 4.387 1.00 47.06 ? 519 HOH A O 1
HETATM 1890 O O . HOH B 2 . ? 16.192 10.387 1.966 1.00 63.96 ? 520 HOH A O 1
HETATM 1891 O O . HOH B 2 . ? 6.226 -6.016 8.757 1.00 33.50 ? 521 HOH A O 1
HETATM 1892 O O . HOH B 2 . ? 2.203 -5.383 10.188 1.00 32.44 ? 522 HOH A O 1
HETATM 1893 O O . HOH B 2 . ? 8.268 -6.468 4.611 1.00 36.38 ? 523 HOH A O 1
HETATM 1894 O O . HOH B 2 . ? 30.705 -3.475 11.705 1.00 42.99 ? 524 HOH A O 1
HETATM 1895 O O . HOH B 2 . ? 31.868 0.671 11.259 1.00 50.60 ? 525 HOH A O 1
HETATM 1896 O O . HOH B 2 . ? 26.647 8.011 26.745 1.00 39.76 ? 526 HOH A O 1
HETATM 1897 O O . HOH B 2 . ? 21.667 4.422 32.498 1.00 49.56 ? 527 HOH A O 1
HETATM 1898 O O . HOH B 2 . ? 23.688 -12.232 12.247 1.00 59.12 ? 528 HOH A O 1
HETATM 1899 O O . HOH B 2 . ? 27.108 -14.410 10.094 1.00 31.83 ? 529 HOH A O 1
HETATM 1900 O O . HOH B 2 . ? 29.302 -17.037 10.334 1.00 35.48 ? 530 HOH A O 1
HETATM 1901 O O . HOH B 2 . ? 57.437 7.575 50.948 1.00 36.37 ? 531 HOH A O 1
HETATM 1902 O O . HOH B 2 . ? 27.337 -4.284 6.646 1.00 63.83 ? 532 HOH A O 1
HETATM 1903 O O . HOH B 2 . ? 31.160 -10.968 16.434 1.00 48.86 ? 533 HOH A O 1
HETATM 1904 O O . HOH B 2 . ? 36.106 -15.001 13.776 1.00 56.33 ? 534 HOH A O 1
HETATM 1905 O O . HOH B 2 . ? 37.381 -8.026 16.616 1.00 39.30 ? 535 HOH A O 1
HETATM 1906 O O . HOH B 2 . ? 38.393 11.665 23.626 1.00 39.02 ? 536 HOH A O 1
HETATM 1907 O O . HOH B 2 . ? 39.091 7.130 30.476 1.00 49.22 ? 537 HOH A O 1
HETATM 1908 O O . HOH B 2 . ? 39.918 8.601 23.087 1.00 38.20 ? 538 HOH A O 1
HETATM 1909 O O . HOH B 2 . ? 24.770 0.444 38.638 1.00 36.24 ? 539 HOH A O 1
HETATM 1910 O O . HOH B 2 . ? 46.979 6.251 36.737 1.00 33.61 ? 540 HOH A O 1
HETATM 1911 O O . HOH B 2 . ? 44.697 -11.297 34.364 1.00 35.67 ? 541 HOH A O 1
HETATM 1912 O O . HOH B 2 . ? 48.319 -10.184 62.680 1.00 45.94 ? 542 HOH A O 1
HETATM 1913 O O . HOH B 2 . ? 53.936 -11.665 58.214 1.00 35.78 ? 543 HOH A O 1
HETATM 1914 O O . HOH B 2 . ? 3.814 -1.630 9.783 1.00 28.82 ? 544 HOH A O 1
HETATM 1915 O O . HOH B 2 . ? 3.984 -3.652 8.768 1.00 38.94 ? 545 HOH A O 1
HETATM 1916 O O . HOH B 2 . ? 39.591 -15.984 59.025 1.00 61.19 ? 546 HOH A O 1
HETATM 1917 O O . HOH B 2 . ? 10.713 5.825 0.329 1.00 51.20 ? 547 HOH A O 1
HETATM 1918 O O . HOH B 2 . ? 7.088 4.269 8.502 1.00 41.49 ? 548 HOH A O 1
HETATM 1919 O O . HOH B 2 . ? 5.423 8.638 12.547 1.00 29.97 ? 549 HOH A O 1
HETATM 1920 O O . HOH B 2 . ? 13.969 1.634 -5.284 1.00 40.44 ? 550 HOH A O 1
HETATM 1921 O O . HOH B 2 . ? 19.740 8.187 26.539 1.00 33.90 ? 551 HOH A O 1
HETATM 1922 O O . HOH B 2 . ? 49.721 -7.708 51.437 1.00 41.40 ? 552 HOH A O 1
HETATM 1923 O O . HOH B 2 . ? 41.576 8.027 27.291 1.00 28.14 ? 553 HOH A O 1
HETATM 1924 O O . HOH B 2 . ? 47.290 7.392 28.936 1.00 40.11 ? 554 HOH A O 1
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.seq_id
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.ndb_seq_num
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.pdb_mon_id
_pdbx_poly_seq_scheme.auth_mon_id
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.hetero
A 1 1 MET 1 119 ? ? ? A . n
A 1 2 ALA 2 120 ? ? ? A . n
A 1 3 THR 3 121 ? ? ? A . n
A 1 4 ARG 4 122 ? ? ? A . n
A 1 5 ALA 5 123 ? ? ? A . n
A 1 6 ASP 6 124 ? ? ? A . n
A 1 7 GLU 7 125 125 GLU GLU A . n
A 1 8 ASP 8 126 126 ASP ASP A . n
A 1 9 GLY 9 127 127 GLY GLY A . n
A 1 10 ASP 10 128 128 ASP ASP A . n
A 1 11 THR 11 129 129 THR THR A . n
A 1 12 PRO 12 130 130 PRO PRO A . n
A 1 13 LEU 13 131 131 LEU LEU A . n
A 1 14 HIS 14 132 132 HIS HIS A . n
A 1 15 ILE 15 133 133 ILE ILE A . n
A 1 16 ALA 16 134 134 ALA ALA A . n
A 1 17 VAL 17 135 135 VAL VAL A . n
A 1 18 VAL 18 136 136 VAL VAL A . n
A 1 19 GLN 19 137 137 GLN GLN A . n
A 1 20 GLY 20 138 138 GLY GLY A . n
A 1 21 ASN 21 139 139 ASN ASN A . n
A 1 22 LEU 22 140 140 LEU LEU A . n
A 1 23 PRO 23 141 141 PRO PRO A . n
A 1 24 ALA 24 142 142 ALA ALA A . n
A 1 25 VAL 25 143 143 VAL VAL A . n
A 1 26 HIS 26 144 144 HIS HIS A . n
A 1 27 ARG 27 145 145 ARG ARG A . n
A 1 28 LEU 28 146 146 LEU LEU A . n
A 1 29 VAL 29 147 147 VAL VAL A . n
A 1 30 ASN 30 148 148 ASN ASN A . n
A 1 31 LEU 31 149 149 LEU LEU A . n
A 1 32 PHE 32 150 150 PHE PHE A . n
A 1 33 GLN 33 151 151 GLN GLN A . n
A 1 34 GLN 34 152 152 GLN GLN A . n
A 1 35 GLY 35 153 153 GLY GLY A . n
A 1 36 GLY 36 154 154 GLY GLY A . n
A 1 37 ARG 37 155 155 ARG ARG A . n
A 1 38 GLU 38 156 156 GLU GLU A . n
A 1 39 LEU 39 157 157 LEU LEU A . n
A 1 40 ASP 40 158 158 ASP ASP A . n
A 1 41 ILE 41 159 159 ILE ILE A . n
A 1 42 TYR 42 160 160 TYR TYR A . n
A 1 43 ASN 43 161 161 ASN ASN A . n
A 1 44 ASN 44 162 162 ASN ASN A . n
A 1 45 LEU 45 163 163 LEU LEU A . n
A 1 46 ARG 46 164 164 ARG ARG A . n
A 1 47 GLN 47 165 165 GLN GLN A . n
A 1 48 THR 48 166 166 THR THR A . n
A 1 49 PRO 49 167 167 PRO PRO A . n
A 1 50 LEU 50 168 168 LEU LEU A . n
A 1 51 HIS 51 169 169 HIS HIS A . n
A 1 52 LEU 52 170 170 LEU LEU A . n
A 1 53 ALA 53 171 171 ALA ALA A . n
A 1 54 VAL 54 172 172 VAL VAL A . n
A 1 55 ILE 55 173 173 ILE ILE A . n
A 1 56 THR 56 174 174 THR THR A . n
A 1 57 THR 57 175 175 THR THR A . n
A 1 58 LEU 58 176 176 LEU LEU A . n
A 1 59 PRO 59 177 177 PRO PRO A . n
A 1 60 SER 60 178 178 SER SER A . n
A 1 61 VAL 61 179 179 VAL VAL A . n
A 1 62 VAL 62 180 180 VAL VAL A . n
A 1 63 ARG 63 181 181 ARG ARG A . n
A 1 64 LEU 64 182 182 LEU LEU A . n
A 1 65 LEU 65 183 183 LEU LEU A . n
A 1 66 VAL 66 184 184 VAL VAL A . n
A 1 67 THR 67 185 185 THR THR A . n
A 1 68 ALA 68 186 186 ALA ALA A . n
A 1 69 GLY 69 187 187 GLY GLY A . n
A 1 70 ALA 70 188 188 ALA ALA A . n
A 1 71 SER 71 189 189 SER SER A . n
A 1 72 PRO 72 190 190 PRO PRO A . n
A 1 73 MET 73 191 191 MET MET A . n
A 1 74 ALA 74 192 192 ALA ALA A . n
A 1 75 LEU 75 193 193 LEU LEU A . n
A 1 76 ASP 76 194 194 ASP ASP A . n
A 1 77 ARG 77 195 195 ARG ARG A . n
A 1 78 HIS 78 196 196 HIS HIS A . n
A 1 79 GLY 79 197 197 GLY GLY A . n
A 1 80 GLN 80 198 198 GLN GLN A . n
A 1 81 THR 81 199 199 THR THR A . n
A 1 82 ALA 82 200 200 ALA ALA A . n
A 1 83 ALA 83 201 201 ALA ALA A . n
A 1 84 HIS 84 202 202 HIS HIS A . n
A 1 85 LEU 85 203 203 LEU LEU A . n
A 1 86 ALA 86 204 204 ALA ALA A . n
A 1 87 CYS 87 205 205 CYS CYS A . n
A 1 88 GLU 88 206 206 GLU GLU A . n
A 1 89 HIS 89 207 207 HIS HIS A . n
A 1 90 ARG 90 208 208 ARG ARG A . n
A 1 91 SER 91 209 209 SER SER A . n
A 1 92 PRO 92 210 210 PRO PRO A . n
A 1 93 THR 93 211 211 THR THR A . n
A 1 94 CYS 94 212 212 CYS CYS A . n
A 1 95 LEU 95 213 213 LEU LEU A . n
A 1 96 ARG 96 214 214 ARG ARG A . n
A 1 97 ALA 97 215 215 ALA ALA A . n
A 1 98 LEU 98 216 216 LEU LEU A . n
A 1 99 LEU 99 217 217 LEU LEU A . n
A 1 100 ASP 100 218 218 ASP ASP A . n
A 1 101 SER 101 219 219 SER SER A . n
A 1 102 ALA 102 220 220 ALA ALA A . n
A 1 103 ALA 103 221 221 ALA ALA A . n
A 1 104 PRO 104 222 222 PRO PRO A . n
A 1 105 GLY 105 223 223 GLY GLY A . n
A 1 106 THR 106 224 224 THR THR A . n
A 1 107 LEU 107 225 225 LEU LEU A . n
A 1 108 ASP 108 226 226 ASP ASP A . n
A 1 109 LEU 109 227 227 LEU LEU A . n
A 1 110 GLU 110 228 228 GLU GLU A . n
A 1 111 ALA 111 229 229 ALA ALA A . n
A 1 112 ARG 112 230 230 ARG ARG A . n
A 1 113 ASN 113 231 231 ASN ASN A . n
A 1 114 TYR 114 232 232 TYR TYR A . n
A 1 115 ASP 115 233 233 ASP ASP A . n
A 1 116 GLY 116 234 234 GLY GLY A . n
A 1 117 LEU 117 235 235 LEU LEU A . n
A 1 118 THR 118 236 236 THR THR A . n
A 1 119 ALA 119 237 237 ALA ALA A . n
A 1 120 LEU 120 238 238 LEU LEU A . n
A 1 121 HIS 121 239 239 HIS HIS A . n
A 1 122 VAL 122 240 240 VAL VAL A . n
A 1 123 ALA 123 241 241 ALA ALA A . n
A 1 124 VAL 124 242 242 VAL VAL A . n
A 1 125 ASN 125 243 243 ASN ASN A . n
A 1 126 THR 126 244 244 THR THR A . n
A 1 127 GLU 127 245 245 GLU GLU A . n
A 1 128 CYS 128 246 246 CYS CYS A . n
A 1 129 GLN 129 247 247 GLN GLN A . n
A 1 130 GLU 130 248 248 GLU GLU A . n
A 1 131 THR 131 249 249 THR THR A . n
A 1 132 VAL 132 250 250 VAL VAL A . n
A 1 133 GLN 133 251 251 GLN GLN A . n
A 1 134 LEU 134 252 252 LEU LEU A . n
A 1 135 LEU 135 253 253 LEU LEU A . n
A 1 136 LEU 136 254 254 LEU LEU A . n
A 1 137 GLU 137 255 255 GLU GLU A . n
A 1 138 ARG 138 256 256 ARG ARG A . n
A 1 139 GLY 139 257 257 GLY GLY A . n
A 1 140 ALA 140 258 258 ALA ALA A . n
A 1 141 ASP 141 259 259 ASP ASP A . n
A 1 142 ILE 142 260 260 ILE ILE A . n
A 1 143 ASP 143 261 261 ASP ASP A . n
A 1 144 ALA 144 262 262 ALA ALA A . n
A 1 145 VAL 145 263 263 VAL VAL A . n
A 1 146 ASP 146 264 264 ASP ASP A . n
A 1 147 ILE 147 265 265 ILE ILE A . n
A 1 148 LYS 148 266 266 LYS LYS A . n
A 1 149 SER 149 267 267 SER SER A . n
A 1 150 GLY 150 268 268 GLY GLY A . n
A 1 151 ARG 151 269 269 ARG ARG A . n
A 1 152 SER 152 270 270 SER SER A . n
A 1 153 PRO 153 271 271 PRO PRO A . n
A 1 154 LEU 154 272 272 LEU LEU A . n
A 1 155 ILE 155 273 273 ILE ILE A . n
A 1 156 HIS 156 274 274 HIS HIS A . n
A 1 157 ALA 157 275 275 ALA ALA A . n
A 1 158 VAL 158 276 276 VAL VAL A . n
A 1 159 GLU 159 277 277 GLU GLU A . n
A 1 160 ASN 160 278 278 ASN ASN A . n
A 1 161 ASN 161 279 279 ASN ASN A . n
A 1 162 SER 162 280 280 SER SER A . n
A 1 163 LEU 163 281 281 LEU LEU A . n
A 1 164 SER 164 282 282 SER SER A . n
A 1 165 MET 165 283 283 MET MET A . n
A 1 166 VAL 166 284 284 VAL VAL A . n
A 1 167 GLN 167 285 285 GLN GLN A . n
A 1 168 LEU 168 286 286 LEU LEU A . n
A 1 169 LEU 169 287 287 LEU LEU A . n
A 1 170 LEU 170 288 288 LEU LEU A . n
A 1 171 GLN 171 289 289 GLN GLN A . n
A 1 172 HIS 172 290 290 HIS HIS A . n
A 1 173 GLY 173 291 291 GLY GLY A . n
A 1 174 ALA 174 292 292 ALA ALA A . n
A 1 175 ASN 175 293 293 ASN ASN A . n
A 1 176 VAL 176 294 294 VAL VAL A . n
A 1 177 ASN 177 295 295 ASN ASN A . n
A 1 178 ALA 178 296 296 ALA ALA A . n
A 1 179 GLN 179 297 297 GLN GLN A . n
A 1 180 MET 180 298 298 MET MET A . n
A 1 181 TYR 181 299 299 TYR TYR A . n
A 1 182 SER 182 300 300 SER SER A . n
A 1 183 GLY 183 301 301 GLY GLY A . n
A 1 184 SER 184 302 302 SER SER A . n
A 1 185 SER 185 303 303 SER SER A . n
A 1 186 ALA 186 304 304 ALA ALA A . n
A 1 187 LEU 187 305 305 LEU LEU A . n
A 1 188 HIS 188 306 306 HIS HIS A . n
A 1 189 SER 189 307 307 SER SER A . n
A 1 190 ALA 190 308 308 ALA ALA A . n
A 1 191 SER 191 309 309 SER SER A . n
A 1 192 GLY 192 310 310 GLY GLY A . n
A 1 193 ARG 193 311 311 ARG ARG A . n
A 1 194 GLY 194 312 312 GLY GLY A . n
A 1 195 LEU 195 313 313 LEU LEU A . n
A 1 196 LEU 196 314 314 LEU LEU A . n
A 1 197 PRO 197 315 315 PRO PRO A . n
A 1 198 LEU 198 316 316 LEU LEU A . n
A 1 199 VAL 199 317 317 VAL VAL A . n
A 1 200 ARG 200 318 318 ARG ARG A . n
A 1 201 THR 201 319 319 THR THR A . n
A 1 202 LEU 202 320 320 LEU LEU A . n
A 1 203 VAL 203 321 321 VAL VAL A . n
A 1 204 ARG 204 322 322 ARG ARG A . n
A 1 205 SER 205 323 323 SER SER A . n
A 1 206 GLY 206 324 324 GLY GLY A . n
A 1 207 ALA 207 325 325 ALA ALA A . n
A 1 208 ASP 208 326 326 ASP ASP A . n
A 1 209 SER 209 327 327 SER SER A . n
A 1 210 SER 210 328 328 SER SER A . n
A 1 211 LEU 211 329 329 LEU LEU A . n
A 1 212 LYS 212 330 330 LYS LYS A . n
A 1 213 ASN 213 331 331 ASN ASN A . n
A 1 214 CYS 214 332 332 CYS CYS A . n
A 1 215 HIS 215 333 333 HIS HIS A . n
A 1 216 ASN 216 334 334 ASN ASN A . n
A 1 217 ASP 217 335 335 ASP ASP A . n
A 1 218 THR 218 336 336 THR THR A . n
A 1 219 PRO 219 337 337 PRO PRO A . n
A 1 220 LEU 220 338 338 LEU LEU A . n
A 1 221 MET 221 339 339 MET MET A . n
A 1 222 VAL 222 340 340 VAL VAL A . n
A 1 223 ALA 223 341 341 ALA ALA A . n
A 1 224 ARG 224 342 342 ARG ARG A . n
A 1 225 SER 225 343 343 SER SER A . n
A 1 226 ARG 226 344 344 ARG ARG A . n
A 1 227 ARG 227 345 345 ARG ARG A . n
A 1 228 VAL 228 346 346 VAL VAL A . n
A 1 229 ILE 229 347 347 ILE ILE A . n
A 1 230 ASP 230 348 348 ASP ASP A . n
A 1 231 ILE 231 349 349 ILE ILE A . n
A 1 232 LEU 232 350 350 LEU LEU A . n
A 1 233 ARG 233 351 351 ARG ARG A . n
A 1 234 GLY 234 352 352 GLY GLY A . n
A 1 235 LYS 235 353 ? ? ? A . n
A 1 236 ALA 236 354 ? ? ? A . n
A 1 237 THR 237 355 ? ? ? A . n
A 1 238 ARG 238 356 ? ? ? A . n
A 1 239 PRO 239 357 ? ? ? A . n
A 1 240 ALA 240 358 ? ? ? A . n
A 1 241 SER 241 359 ? ? ? A . n
#
loop_
_pdbx_nonpoly_scheme.asym_id
_pdbx_nonpoly_scheme.entity_id
_pdbx_nonpoly_scheme.mon_id
_pdbx_nonpoly_scheme.ndb_seq_num
_pdbx_nonpoly_scheme.pdb_seq_num
_pdbx_nonpoly_scheme.auth_seq_num
_pdbx_nonpoly_scheme.pdb_mon_id
_pdbx_nonpoly_scheme.auth_mon_id
_pdbx_nonpoly_scheme.pdb_strand_id
_pdbx_nonpoly_scheme.pdb_ins_code
B 2 HOH 1 360 353 HOH HOH A .
B 2 HOH 2 361 354 HOH HOH A .
B 2 HOH 3 362 355 HOH HOH A .
B 2 HOH 4 363 356 HOH HOH A .
B 2 HOH 5 364 357 HOH HOH A .
B 2 HOH 6 365 358 HOH HOH A .
B 2 HOH 7 366 359 HOH HOH A .
B 2 HOH 8 367 360 HOH HOH A .
B 2 HOH 9 368 361 HOH HOH A .
B 2 HOH 10 369 362 HOH HOH A .
B 2 HOH 11 370 363 HOH HOH A .
B 2 HOH 12 371 364 HOH HOH A .
B 2 HOH 13 372 365 HOH HOH A .
B 2 HOH 14 373 366 HOH HOH A .
B 2 HOH 15 374 367 HOH HOH A .
B 2 HOH 16 375 368 HOH HOH A .
B 2 HOH 17 376 369 HOH HOH A .
B 2 HOH 18 377 370 HOH HOH A .
B 2 HOH 19 378 371 HOH HOH A .
B 2 HOH 20 379 372 HOH HOH A .
B 2 HOH 21 380 373 HOH HOH A .
B 2 HOH 22 381 374 HOH HOH A .
B 2 HOH 23 382 375 HOH HOH A .
B 2 HOH 24 383 376 HOH HOH A .
B 2 HOH 25 384 377 HOH HOH A .
B 2 HOH 26 385 378 HOH HOH A .
B 2 HOH 27 386 379 HOH HOH A .
B 2 HOH 28 387 380 HOH HOH A .
B 2 HOH 29 388 381 HOH HOH A .
B 2 HOH 30 389 382 HOH HOH A .
B 2 HOH 31 390 383 HOH HOH A .
B 2 HOH 32 391 384 HOH HOH A .
B 2 HOH 33 392 385 HOH HOH A .
B 2 HOH 34 393 386 HOH HOH A .
B 2 HOH 35 394 387 HOH HOH A .
B 2 HOH 36 395 388 HOH HOH A .
B 2 HOH 37 396 389 HOH HOH A .
B 2 HOH 38 397 390 HOH HOH A .
B 2 HOH 39 398 391 HOH HOH A .
B 2 HOH 40 399 392 HOH HOH A .
B 2 HOH 41 400 393 HOH HOH A .
B 2 HOH 42 401 394 HOH HOH A .
B 2 HOH 43 402 395 HOH HOH A .
B 2 HOH 44 403 396 HOH HOH A .
B 2 HOH 45 404 397 HOH HOH A .
B 2 HOH 46 405 398 HOH HOH A .
B 2 HOH 47 406 399 HOH HOH A .
B 2 HOH 48 407 400 HOH HOH A .
B 2 HOH 49 408 401 HOH HOH A .
B 2 HOH 50 409 402 HOH HOH A .
B 2 HOH 51 410 403 HOH HOH A .
B 2 HOH 52 411 404 HOH HOH A .
B 2 HOH 53 412 405 HOH HOH A .
B 2 HOH 54 413 406 HOH HOH A .
B 2 HOH 55 414 407 HOH HOH A .
B 2 HOH 56 415 408 HOH HOH A .
B 2 HOH 57 416 409 HOH HOH A .
B 2 HOH 58 417 410 HOH HOH A .
B 2 HOH 59 418 411 HOH HOH A .
B 2 HOH 60 419 412 HOH HOH A .
B 2 HOH 61 420 413 HOH HOH A .
B 2 HOH 62 421 414 HOH HOH A .
B 2 HOH 63 422 415 HOH HOH A .
B 2 HOH 64 423 416 HOH HOH A .
B 2 HOH 65 424 417 HOH HOH A .
B 2 HOH 66 425 418 HOH HOH A .
B 2 HOH 67 426 419 HOH HOH A .
B 2 HOH 68 427 420 HOH HOH A .
B 2 HOH 69 428 421 HOH HOH A .
B 2 HOH 70 429 422 HOH HOH A .
B 2 HOH 71 430 423 HOH HOH A .
B 2 HOH 72 431 424 HOH HOH A .
B 2 HOH 73 432 425 HOH HOH A .
B 2 HOH 74 433 426 HOH HOH A .
B 2 HOH 75 434 427 HOH HOH A .
B 2 HOH 76 435 428 HOH HOH A .
B 2 HOH 77 436 429 HOH HOH A .
B 2 HOH 78 437 430 HOH HOH A .
B 2 HOH 79 438 431 HOH HOH A .
B 2 HOH 80 439 432 HOH HOH A .
B 2 HOH 81 440 433 HOH HOH A .
B 2 HOH 82 441 434 HOH HOH A .
B 2 HOH 83 442 435 HOH HOH A .
B 2 HOH 84 443 436 HOH HOH A .
B 2 HOH 85 444 437 HOH HOH A .
B 2 HOH 86 445 438 HOH HOH A .
B 2 HOH 87 446 439 HOH HOH A .
B 2 HOH 88 447 440 HOH HOH A .
B 2 HOH 89 448 441 HOH HOH A .
B 2 HOH 90 449 442 HOH HOH A .
B 2 HOH 91 450 443 HOH HOH A .
B 2 HOH 92 451 444 HOH HOH A .
B 2 HOH 93 452 445 HOH HOH A .
B 2 HOH 94 453 446 HOH HOH A .
B 2 HOH 95 454 447 HOH HOH A .
B 2 HOH 96 455 448 HOH HOH A .
B 2 HOH 97 456 449 HOH HOH A .
B 2 HOH 98 457 450 HOH HOH A .
B 2 HOH 99 458 452 HOH HOH A .
B 2 HOH 100 459 453 HOH HOH A .
B 2 HOH 101 460 454 HOH HOH A .
B 2 HOH 102 461 455 HOH HOH A .
B 2 HOH 103 462 456 HOH HOH A .
B 2 HOH 104 463 457 HOH HOH A .
B 2 HOH 105 464 458 HOH HOH A .
B 2 HOH 106 465 459 HOH HOH A .
B 2 HOH 107 466 460 HOH HOH A .
B 2 HOH 108 467 461 HOH HOH A .
B 2 HOH 109 468 462 HOH HOH A .
B 2 HOH 110 469 463 HOH HOH A .
B 2 HOH 111 470 464 HOH HOH A .
B 2 HOH 112 471 465 HOH HOH A .
B 2 HOH 113 472 466 HOH HOH A .
B 2 HOH 114 473 467 HOH HOH A .
B 2 HOH 115 474 468 HOH HOH A .
B 2 HOH 116 475 469 HOH HOH A .
B 2 HOH 117 476 470 HOH HOH A .
B 2 HOH 118 477 471 HOH HOH A .
B 2 HOH 119 478 472 HOH HOH A .
B 2 HOH 120 479 473 HOH HOH A .
B 2 HOH 121 480 474 HOH HOH A .
B 2 HOH 122 481 475 HOH HOH A .
B 2 HOH 123 482 476 HOH HOH A .
B 2 HOH 124 483 477 HOH HOH A .
B 2 HOH 125 484 478 HOH HOH A .
B 2 HOH 126 485 479 HOH HOH A .
B 2 HOH 127 486 480 HOH HOH A .
B 2 HOH 128 487 481 HOH HOH A .
B 2 HOH 129 488 482 HOH HOH A .
B 2 HOH 130 489 483 HOH HOH A .
B 2 HOH 131 490 484 HOH HOH A .
B 2 HOH 132 491 485 HOH HOH A .
B 2 HOH 133 492 486 HOH HOH A .
B 2 HOH 134 493 487 HOH HOH A .
B 2 HOH 135 494 488 HOH HOH A .
B 2 HOH 136 495 489 HOH HOH A .
B 2 HOH 137 496 490 HOH HOH A .
B 2 HOH 138 497 491 HOH HOH A .
B 2 HOH 139 498 492 HOH HOH A .
B 2 HOH 140 499 493 HOH HOH A .
B 2 HOH 141 500 494 HOH HOH A .
B 2 HOH 142 501 495 HOH HOH A .
B 2 HOH 143 502 496 HOH HOH A .
B 2 HOH 144 503 497 HOH HOH A .
B 2 HOH 145 504 498 HOH HOH A .
B 2 HOH 146 505 499 HOH HOH A .
B 2 HOH 147 506 500 HOH HOH A .
B 2 HOH 148 507 501 HOH HOH A .
B 2 HOH 149 508 502 HOH HOH A .
B 2 HOH 150 509 503 HOH HOH A .
B 2 HOH 151 510 504 HOH HOH A .
B 2 HOH 152 511 505 HOH HOH A .
B 2 HOH 153 512 506 HOH HOH A .
B 2 HOH 154 513 507 HOH HOH A .
B 2 HOH 155 514 508 HOH HOH A .
B 2 HOH 156 515 509 HOH HOH A .
B 2 HOH 157 516 510 HOH HOH A .
B 2 HOH 158 517 512 HOH HOH A .
B 2 HOH 159 518 513 HOH HOH A .
B 2 HOH 160 519 514 HOH HOH A .
B 2 HOH 161 520 515 HOH HOH A .
B 2 HOH 162 521 516 HOH HOH A .
B 2 HOH 163 522 517 HOH HOH A .
B 2 HOH 164 523 518 HOH HOH A .
B 2 HOH 165 524 519 HOH HOH A .
B 2 HOH 166 525 520 HOH HOH A .
B 2 HOH 167 526 521 HOH HOH A .
B 2 HOH 168 527 522 HOH HOH A .
B 2 HOH 169 528 523 HOH HOH A .
B 2 HOH 170 529 524 HOH HOH A .
B 2 HOH 171 530 525 HOH HOH A .
B 2 HOH 172 531 526 HOH HOH A .
B 2 HOH 173 532 527 HOH HOH A .
B 2 HOH 174 533 528 HOH HOH A .
B 2 HOH 175 534 529 HOH HOH A .
B 2 HOH 176 535 530 HOH HOH A .
B 2 HOH 177 536 531 HOH HOH A .
B 2 HOH 178 537 532 HOH HOH A .
B 2 HOH 179 538 533 HOH HOH A .
B 2 HOH 180 539 534 HOH HOH A .
B 2 HOH 181 540 535 HOH HOH A .
B 2 HOH 182 541 536 HOH HOH A .
B 2 HOH 183 542 537 HOH HOH A .
B 2 HOH 184 543 538 HOH HOH A .
B 2 HOH 185 544 539 HOH HOH A .
B 2 HOH 186 545 540 HOH HOH A .
B 2 HOH 187 546 541 HOH HOH A .
B 2 HOH 188 547 542 HOH HOH A .
B 2 HOH 189 548 543 HOH HOH A .
B 2 HOH 190 549 544 HOH HOH A .
B 2 HOH 191 550 545 HOH HOH A .
B 2 HOH 192 551 546 HOH HOH A .
B 2 HOH 193 552 547 HOH HOH A .
B 2 HOH 194 553 548 HOH HOH A .
B 2 HOH 195 554 549 HOH HOH A .
#
_pdbx_struct_assembly.id 1
_pdbx_struct_assembly.details author_defined_assembly
_pdbx_struct_assembly.method_details ?
_pdbx_struct_assembly.oligomeric_details monomeric
_pdbx_struct_assembly.oligomeric_count 1
#
_pdbx_struct_assembly_gen.assembly_id 1
_pdbx_struct_assembly_gen.oper_expression 1
_pdbx_struct_assembly_gen.asym_id_list A,B
#
_pdbx_struct_oper_list.id 1
_pdbx_struct_oper_list.type 'identity operation'
_pdbx_struct_oper_list.name 1_555
_pdbx_struct_oper_list.symmetry_operation x,y,z
_pdbx_struct_oper_list.matrix[1][1] 1.0000000000
_pdbx_struct_oper_list.matrix[1][2] 0.0000000000
_pdbx_struct_oper_list.matrix[1][3] 0.0000000000
_pdbx_struct_oper_list.vector[1] 0.0000000000
_pdbx_struct_oper_list.matrix[2][1] 0.0000000000
_pdbx_struct_oper_list.matrix[2][2] 1.0000000000
_pdbx_struct_oper_list.matrix[2][3] 0.0000000000
_pdbx_struct_oper_list.vector[2] 0.0000000000
_pdbx_struct_oper_list.matrix[3][1] 0.0000000000
_pdbx_struct_oper_list.matrix[3][2] 0.0000000000
_pdbx_struct_oper_list.matrix[3][3] 1.0000000000
_pdbx_struct_oper_list.vector[3] 0.0000000000
#
loop_
_pdbx_audit_revision_history.ordinal
_pdbx_audit_revision_history.data_content_type
_pdbx_audit_revision_history.major_revision
_pdbx_audit_revision_history.minor_revision
_pdbx_audit_revision_history.revision_date
1 'Structure model' 1 0 2001-11-21
2 'Structure model' 1 1 2008-04-27
3 'Structure model' 1 2 2011-07-13
4 'Structure model' 1 3 2023-08-16
#
_pdbx_audit_revision_details.ordinal 1
_pdbx_audit_revision_details.revision_ordinal 1
_pdbx_audit_revision_details.data_content_type 'Structure model'
_pdbx_audit_revision_details.provider repository
_pdbx_audit_revision_details.type 'Initial release'
_pdbx_audit_revision_details.description ?
_pdbx_audit_revision_details.details ?
#
loop_
_pdbx_audit_revision_group.ordinal
_pdbx_audit_revision_group.revision_ordinal
_pdbx_audit_revision_group.data_content_type
_pdbx_audit_revision_group.group
1 2 'Structure model' 'Version format compliance'
2 3 'Structure model' 'Version format compliance'
3 4 'Structure model' 'Data collection'
4 4 'Structure model' 'Database references'
5 4 'Structure model' 'Refinement description'
#
loop_
_pdbx_audit_revision_category.ordinal
_pdbx_audit_revision_category.revision_ordinal
_pdbx_audit_revision_category.data_content_type
_pdbx_audit_revision_category.category
1 4 'Structure model' chem_comp_atom
2 4 'Structure model' chem_comp_bond
3 4 'Structure model' database_2
4 4 'Structure model' pdbx_initial_refinement_model
#
loop_
_pdbx_audit_revision_item.ordinal
_pdbx_audit_revision_item.revision_ordinal
_pdbx_audit_revision_item.data_content_type
_pdbx_audit_revision_item.item
1 4 'Structure model' '_database_2.pdbx_DOI'
2 4 'Structure model' '_database_2.pdbx_database_accession'
#
loop_
_software.name
_software.classification
_software.version
_software.citation_id
_software.pdbx_ordinal
AMoRE phasing . ? 1
REFMAC refinement . ? 2
DENZO 'data reduction' . ? 3
SCALEPACK 'data scaling' . ? 4
#
loop_
_pdbx_validate_close_contact.id
_pdbx_validate_close_contact.PDB_model_num
_pdbx_validate_close_contact.auth_atom_id_1
_pdbx_validate_close_contact.auth_asym_id_1
_pdbx_validate_close_contact.auth_comp_id_1
_pdbx_validate_close_contact.auth_seq_id_1
_pdbx_validate_close_contact.PDB_ins_code_1
_pdbx_validate_close_contact.label_alt_id_1
_pdbx_validate_close_contact.auth_atom_id_2
_pdbx_validate_close_contact.auth_asym_id_2
_pdbx_validate_close_contact.auth_comp_id_2
_pdbx_validate_close_contact.auth_seq_id_2
_pdbx_validate_close_contact.PDB_ins_code_2
_pdbx_validate_close_contact.label_alt_id_2
_pdbx_validate_close_contact.dist
1 1 O A THR 244 ? ? O A HOH 539 ? ? 1.75
2 1 OH A TYR 299 ? ? O A HOH 554 ? ? 1.88
3 1 O A VAL 136 ? ? O A HOH 501 ? ? 1.97
4 1 O A SER 267 ? ? O A HOH 540 ? ? 2.02
5 1 O A HOH 430 ? ? O A HOH 526 ? ? 2.10
6 1 O A HOH 365 ? ? O A HOH 492 ? ? 2.12
7 1 CG2 A ILE 265 ? ? O A HOH 553 ? ? 2.19
#
loop_
_pdbx_validate_symm_contact.id
_pdbx_validate_symm_contact.PDB_model_num
_pdbx_validate_symm_contact.auth_atom_id_1
_pdbx_validate_symm_contact.auth_asym_id_1
_pdbx_validate_symm_contact.auth_comp_id_1
_pdbx_validate_symm_contact.auth_seq_id_1
_pdbx_validate_symm_contact.PDB_ins_code_1
_pdbx_validate_symm_contact.label_alt_id_1
_pdbx_validate_symm_contact.site_symmetry_1
_pdbx_validate_symm_contact.auth_atom_id_2
_pdbx_validate_symm_contact.auth_asym_id_2
_pdbx_validate_symm_contact.auth_comp_id_2
_pdbx_validate_symm_contact.auth_seq_id_2
_pdbx_validate_symm_contact.PDB_ins_code_2
_pdbx_validate_symm_contact.label_alt_id_2
_pdbx_validate_symm_contact.site_symmetry_2
_pdbx_validate_symm_contact.dist
1 1 O A HOH 487 ? ? 1_555 O A HOH 536 ? ? 2_846 1.75
2 1 NH2 A ARG 345 ? ? 1_555 O A HOH 445 ? ? 1_656 1.80
3 1 NE A ARG 345 ? ? 1_555 O A HOH 445 ? ? 1_656 2.19
#
loop_
_pdbx_validate_rmsd_angle.id
_pdbx_validate_rmsd_angle.PDB_model_num
_pdbx_validate_rmsd_angle.auth_atom_id_1
_pdbx_validate_rmsd_angle.auth_asym_id_1
_pdbx_validate_rmsd_angle.auth_comp_id_1
_pdbx_validate_rmsd_angle.auth_seq_id_1
_pdbx_validate_rmsd_angle.PDB_ins_code_1
_pdbx_validate_rmsd_angle.label_alt_id_1
_pdbx_validate_rmsd_angle.auth_atom_id_2
_pdbx_validate_rmsd_angle.auth_asym_id_2
_pdbx_validate_rmsd_angle.auth_comp_id_2
_pdbx_validate_rmsd_angle.auth_seq_id_2
_pdbx_validate_rmsd_angle.PDB_ins_code_2
_pdbx_validate_rmsd_angle.label_alt_id_2
_pdbx_validate_rmsd_angle.auth_atom_id_3
_pdbx_validate_rmsd_angle.auth_asym_id_3
_pdbx_validate_rmsd_angle.auth_comp_id_3
_pdbx_validate_rmsd_angle.auth_seq_id_3
_pdbx_validate_rmsd_angle.PDB_ins_code_3
_pdbx_validate_rmsd_angle.label_alt_id_3
_pdbx_validate_rmsd_angle.angle_value
_pdbx_validate_rmsd_angle.angle_target_value
_pdbx_validate_rmsd_angle.angle_deviation
_pdbx_validate_rmsd_angle.angle_standard_deviation
_pdbx_validate_rmsd_angle.linker_flag
1 1 CB A GLU 125 ? ? CA A GLU 125 ? ? C A GLU 125 ? ? 130.75 110.40 20.35 2.00 N
2 1 NE A ARG 344 ? ? CZ A ARG 344 ? ? NH2 A ARG 344 ? ? 123.75 120.30 3.45 0.50 N
3 1 NE A ARG 345 ? ? CZ A ARG 345 ? ? NH2 A ARG 345 ? ? 123.90 120.30 3.60 0.50 N
#
_pdbx_validate_torsion.id 1
_pdbx_validate_torsion.PDB_model_num 1
_pdbx_validate_torsion.auth_comp_id THR
_pdbx_validate_torsion.auth_asym_id A
_pdbx_validate_torsion.auth_seq_id 175
_pdbx_validate_torsion.PDB_ins_code ?
_pdbx_validate_torsion.label_alt_id ?
_pdbx_validate_torsion.phi 62.65
_pdbx_validate_torsion.psi 61.05
#
_pdbx_validate_planes.id 1
_pdbx_validate_planes.PDB_model_num 1
_pdbx_validate_planes.auth_comp_id ARG
_pdbx_validate_planes.auth_asym_id A
_pdbx_validate_planes.auth_seq_id 345
_pdbx_validate_planes.PDB_ins_code ?
_pdbx_validate_planes.label_alt_id ?
_pdbx_validate_planes.rmsd 0.179
_pdbx_validate_planes.type 'SIDE CHAIN'
#
_pdbx_validate_chiral.id 1
_pdbx_validate_chiral.PDB_model_num 1
_pdbx_validate_chiral.auth_atom_id CA
_pdbx_validate_chiral.label_alt_id ?
_pdbx_validate_chiral.auth_asym_id A
_pdbx_validate_chiral.auth_comp_id GLU
_pdbx_validate_chiral.auth_seq_id 125
_pdbx_validate_chiral.PDB_ins_code ?
_pdbx_validate_chiral.details PLANAR
_pdbx_validate_chiral.omega .
#
loop_
_pdbx_unobs_or_zero_occ_atoms.id
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num
_pdbx_unobs_or_zero_occ_atoms.polymer_flag
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id
_pdbx_unobs_or_zero_occ_atoms.label_alt_id
_pdbx_unobs_or_zero_occ_atoms.label_asym_id
_pdbx_unobs_or_zero_occ_atoms.label_comp_id
_pdbx_unobs_or_zero_occ_atoms.label_seq_id
_pdbx_unobs_or_zero_occ_atoms.label_atom_id
1 1 Y 0 A ASP 128 ? OD1 ? A ASP 10 OD1
2 1 Y 0 A GLN 152 ? OE1 ? A GLN 34 OE1
3 1 Y 0 A ILE 265 ? CG2 ? A ILE 147 CG2
#
loop_
_pdbx_unobs_or_zero_occ_residues.id
_pdbx_unobs_or_zero_occ_residues.PDB_model_num
_pdbx_unobs_or_zero_occ_residues.polymer_flag
_pdbx_unobs_or_zero_occ_residues.occupancy_flag
_pdbx_unobs_or_zero_occ_residues.auth_asym_id
_pdbx_unobs_or_zero_occ_residues.auth_comp_id
_pdbx_unobs_or_zero_occ_residues.auth_seq_id
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code
_pdbx_unobs_or_zero_occ_residues.label_asym_id
_pdbx_unobs_or_zero_occ_residues.label_comp_id
_pdbx_unobs_or_zero_occ_residues.label_seq_id
1 1 Y 1 A MET 119 ? A MET 1
2 1 Y 1 A ALA 120 ? A ALA 2
3 1 Y 1 A THR 121 ? A THR 3
4 1 Y 1 A ARG 122 ? A ARG 4
5 1 Y 1 A ALA 123 ? A ALA 5
6 1 Y 1 A ASP 124 ? A ASP 6
7 1 Y 1 A LYS 353 ? A LYS 235
8 1 Y 1 A ALA 354 ? A ALA 236
9 1 Y 1 A THR 355 ? A THR 237
10 1 Y 1 A ARG 356 ? A ARG 238
11 1 Y 1 A PRO 357 ? A PRO 239
12 1 Y 1 A ALA 358 ? A ALA 240
13 1 Y 1 A SER 359 ? A SER 241
#
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.pdbx_aromatic_flag
_chem_comp_atom.pdbx_stereo_config
_chem_comp_atom.pdbx_ordinal
ALA N N N N 1
ALA CA C N S 2
ALA C C N N 3
ALA O O N N 4
ALA CB C N N 5
ALA OXT O N N 6
ALA H H N N 7
ALA H2 H N N 8
ALA HA H N N 9
ALA HB1 H N N 10
ALA HB2 H N N 11
ALA HB3 H N N 12
ALA HXT H N N 13
ARG N N N N 14
ARG CA C N S 15
ARG C C N N 16
ARG O O N N 17
ARG CB C N N 18
ARG CG C N N 19
ARG CD C N N 20
ARG NE N N N 21
ARG CZ C N N 22
ARG NH1 N N N 23
ARG NH2 N N N 24
ARG OXT O N N 25
ARG H H N N 26
ARG H2 H N N 27
ARG HA H N N 28
ARG HB2 H N N 29
ARG HB3 H N N 30
ARG HG2 H N N 31
ARG HG3 H N N 32
ARG HD2 H N N 33
ARG HD3 H N N 34
ARG HE H N N 35
ARG HH11 H N N 36
ARG HH12 H N N 37
ARG HH21 H N N 38
ARG HH22 H N N 39
ARG HXT H N N 40
ASN N N N N 41
ASN CA C N S 42
ASN C C N N 43
ASN O O N N 44
ASN CB C N N 45
ASN CG C N N 46
ASN OD1 O N N 47
ASN ND2 N N N 48
ASN OXT O N N 49
ASN H H N N 50
ASN H2 H N N 51
ASN HA H N N 52
ASN HB2 H N N 53
ASN HB3 H N N 54
ASN HD21 H N N 55
ASN HD22 H N N 56
ASN HXT H N N 57
ASP N N N N 58
ASP CA C N S 59
ASP C C N N 60
ASP O O N N 61
ASP CB C N N 62
ASP CG C N N 63
ASP OD1 O N N 64
ASP OD2 O N N 65
ASP OXT O N N 66
ASP H H N N 67
ASP H2 H N N 68
ASP HA H N N 69
ASP HB2 H N N 70
ASP HB3 H N N 71
ASP HD2 H N N 72
ASP HXT H N N 73
CYS N N N N 74
CYS CA C N R 75
CYS C C N N 76
CYS O O N N 77
CYS CB C N N 78
CYS SG S N N 79
CYS OXT O N N 80
CYS H H N N 81
CYS H2 H N N 82
CYS HA H N N 83
CYS HB2 H N N 84
CYS HB3 H N N 85
CYS HG H N N 86
CYS HXT H N N 87
GLN N N N N 88
GLN CA C N S 89
GLN C C N N 90
GLN O O N N 91
GLN CB C N N 92
GLN CG C N N 93
GLN CD C N N 94
GLN OE1 O N N 95
GLN NE2 N N N 96
GLN OXT O N N 97
GLN H H N N 98
GLN H2 H N N 99
GLN HA H N N 100
GLN HB2 H N N 101
GLN HB3 H N N 102
GLN HG2 H N N 103
GLN HG3 H N N 104
GLN HE21 H N N 105
GLN HE22 H N N 106
GLN HXT H N N 107
GLU N N N N 108
GLU CA C N S 109
GLU C C N N 110
GLU O O N N 111
GLU CB C N N 112
GLU CG C N N 113
GLU CD C N N 114
GLU OE1 O N N 115
GLU OE2 O N N 116
GLU OXT O N N 117
GLU H H N N 118
GLU H2 H N N 119
GLU HA H N N 120
GLU HB2 H N N 121
GLU HB3 H N N 122
GLU HG2 H N N 123
GLU HG3 H N N 124
GLU HE2 H N N 125
GLU HXT H N N 126
GLY N N N N 127
GLY CA C N N 128
GLY C C N N 129
GLY O O N N 130
GLY OXT O N N 131
GLY H H N N 132
GLY H2 H N N 133
GLY HA2 H N N 134
GLY HA3 H N N 135
GLY HXT H N N 136
HIS N N N N 137
HIS CA C N S 138
HIS C C N N 139
HIS O O N N 140
HIS CB C N N 141
HIS CG C Y N 142
HIS ND1 N Y N 143
HIS CD2 C Y N 144
HIS CE1 C Y N 145
HIS NE2 N Y N 146
HIS OXT O N N 147
HIS H H N N 148
HIS H2 H N N 149
HIS HA H N N 150
HIS HB2 H N N 151
HIS HB3 H N N 152
HIS HD1 H N N 153
HIS HD2 H N N 154
HIS HE1 H N N 155
HIS HE2 H N N 156
HIS HXT H N N 157
HOH O O N N 158
HOH H1 H N N 159
HOH H2 H N N 160
ILE N N N N 161
ILE CA C N S 162
ILE C C N N 163
ILE O O N N 164
ILE CB C N S 165
ILE CG1 C N N 166
ILE CG2 C N N 167
ILE CD1 C N N 168
ILE OXT O N N 169
ILE H H N N 170
ILE H2 H N N 171
ILE HA H N N 172
ILE HB H N N 173
ILE HG12 H N N 174
ILE HG13 H N N 175
ILE HG21 H N N 176
ILE HG22 H N N 177
ILE HG23 H N N 178
ILE HD11 H N N 179
ILE HD12 H N N 180
ILE HD13 H N N 181
ILE HXT H N N 182
LEU N N N N 183
LEU CA C N S 184
LEU C C N N 185
LEU O O N N 186
LEU CB C N N 187
LEU CG C N N 188
LEU CD1 C N N 189
LEU CD2 C N N 190
LEU OXT O N N 191
LEU H H N N 192
LEU H2 H N N 193
LEU HA H N N 194
LEU HB2 H N N 195
LEU HB3 H N N 196
LEU HG H N N 197
LEU HD11 H N N 198
LEU HD12 H N N 199
LEU HD13 H N N 200
LEU HD21 H N N 201
LEU HD22 H N N 202
LEU HD23 H N N 203
LEU HXT H N N 204
LYS N N N N 205
LYS CA C N S 206
LYS C C N N 207
LYS O O N N 208
LYS CB C N N 209
LYS CG C N N 210
LYS CD C N N 211
LYS CE C N N 212
LYS NZ N N N 213
LYS OXT O N N 214
LYS H H N N 215
LYS H2 H N N 216
LYS HA H N N 217
LYS HB2 H N N 218
LYS HB3 H N N 219
LYS HG2 H N N 220
LYS HG3 H N N 221
LYS HD2 H N N 222
LYS HD3 H N N 223
LYS HE2 H N N 224
LYS HE3 H N N 225
LYS HZ1 H N N 226
LYS HZ2 H N N 227
LYS HZ3 H N N 228
LYS HXT H N N 229
MET N N N N 230
MET CA C N S 231
MET C C N N 232
MET O O N N 233
MET CB C N N 234
MET CG C N N 235
MET SD S N N 236
MET CE C N N 237
MET OXT O N N 238
MET H H N N 239
MET H2 H N N 240
MET HA H N N 241
MET HB2 H N N 242
MET HB3 H N N 243
MET HG2 H N N 244
MET HG3 H N N 245
MET HE1 H N N 246
MET HE2 H N N 247
MET HE3 H N N 248
MET HXT H N N 249
PHE N N N N 250
PHE CA C N S 251
PHE C C N N 252
PHE O O N N 253
PHE CB C N N 254
PHE CG C Y N 255
PHE CD1 C Y N 256
PHE CD2 C Y N 257
PHE CE1 C Y N 258
PHE CE2 C Y N 259
PHE CZ C Y N 260
PHE OXT O N N 261
PHE H H N N 262
PHE H2 H N N 263
PHE HA H N N 264
PHE HB2 H N N 265
PHE HB3 H N N 266
PHE HD1 H N N 267
PHE HD2 H N N 268
PHE HE1 H N N 269
PHE HE2 H N N 270
PHE HZ H N N 271
PHE HXT H N N 272
PRO N N N N 273
PRO CA C N S 274
PRO C C N N 275
PRO O O N N 276
PRO CB C N N 277
PRO CG C N N 278
PRO CD C N N 279
PRO OXT O N N 280
PRO H H N N 281
PRO HA H N N 282
PRO HB2 H N N 283
PRO HB3 H N N 284
PRO HG2 H N N 285
PRO HG3 H N N 286
PRO HD2 H N N 287
PRO HD3 H N N 288
PRO HXT H N N 289
SER N N N N 290
SER CA C N S 291
SER C C N N 292
SER O O N N 293
SER CB C N N 294
SER OG O N N 295
SER OXT O N N 296
SER H H N N 297
SER H2 H N N 298
SER HA H N N 299
SER HB2 H N N 300
SER HB3 H N N 301
SER HG H N N 302
SER HXT H N N 303
THR N N N N 304
THR CA C N S 305
THR C C N N 306
THR O O N N 307
THR CB C N R 308
THR OG1 O N N 309
THR CG2 C N N 310
THR OXT O N N 311
THR H H N N 312
THR H2 H N N 313
THR HA H N N 314
THR HB H N N 315
THR HG1 H N N 316
THR HG21 H N N 317
THR HG22 H N N 318
THR HG23 H N N 319
THR HXT H N N 320
TYR N N N N 321
TYR CA C N S 322
TYR C C N N 323
TYR O O N N 324
TYR CB C N N 325
TYR CG C Y N 326
TYR CD1 C Y N 327
TYR CD2 C Y N 328
TYR CE1 C Y N 329
TYR CE2 C Y N 330
TYR CZ C Y N 331
TYR OH O N N 332
TYR OXT O N N 333
TYR H H N N 334
TYR H2 H N N 335
TYR HA H N N 336
TYR HB2 H N N 337
TYR HB3 H N N 338
TYR HD1 H N N 339
TYR HD2 H N N 340
TYR HE1 H N N 341
TYR HE2 H N N 342
TYR HH H N N 343
TYR HXT H N N 344
VAL N N N N 345
VAL CA C N S 346
VAL C C N N 347
VAL O O N N 348
VAL CB C N N 349
VAL CG1 C N N 350
VAL CG2 C N N 351
VAL OXT O N N 352
VAL H H N N 353
VAL H2 H N N 354
VAL HA H N N 355
VAL HB H N N 356
VAL HG11 H N N 357
VAL HG12 H N N 358
VAL HG13 H N N 359
VAL HG21 H N N 360
VAL HG22 H N N 361
VAL HG23 H N N 362
VAL HXT H N N 363
#
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
_chem_comp_bond.pdbx_aromatic_flag
_chem_comp_bond.pdbx_stereo_config
_chem_comp_bond.pdbx_ordinal
ALA N CA sing N N 1
ALA N H sing N N 2
ALA N H2 sing N N 3
ALA CA C sing N N 4
ALA CA CB sing N N 5
ALA CA HA sing N N 6
ALA C O doub N N 7
ALA C OXT sing N N 8
ALA CB HB1 sing N N 9
ALA CB HB2 sing N N 10
ALA CB HB3 sing N N 11
ALA OXT HXT sing N N 12
ARG N CA sing N N 13
ARG N H sing N N 14
ARG N H2 sing N N 15
ARG CA C sing N N 16
ARG CA CB sing N N 17
ARG CA HA sing N N 18
ARG C O doub N N 19
ARG C OXT sing N N 20
ARG CB CG sing N N 21
ARG CB HB2 sing N N 22
ARG CB HB3 sing N N 23
ARG CG CD sing N N 24
ARG CG HG2 sing N N 25
ARG CG HG3 sing N N 26
ARG CD NE sing N N 27
ARG CD HD2 sing N N 28
ARG CD HD3 sing N N 29
ARG NE CZ sing N N 30
ARG NE HE sing N N 31
ARG CZ NH1 sing N N 32
ARG CZ NH2 doub N N 33
ARG NH1 HH11 sing N N 34
ARG NH1 HH12 sing N N 35
ARG NH2 HH21 sing N N 36
ARG NH2 HH22 sing N N 37
ARG OXT HXT sing N N 38
ASN N CA sing N N 39
ASN N H sing N N 40
ASN N H2 sing N N 41
ASN CA C sing N N 42
ASN CA CB sing N N 43
ASN CA HA sing N N 44
ASN C O doub N N 45
ASN C OXT sing N N 46
ASN CB CG sing N N 47
ASN CB HB2 sing N N 48
ASN CB HB3 sing N N 49
ASN CG OD1 doub N N 50
ASN CG ND2 sing N N 51
ASN ND2 HD21 sing N N 52
ASN ND2 HD22 sing N N 53
ASN OXT HXT sing N N 54
ASP N CA sing N N 55
ASP N H sing N N 56
ASP N H2 sing N N 57
ASP CA C sing N N 58
ASP CA CB sing N N 59
ASP CA HA sing N N 60
ASP C O doub N N 61
ASP C OXT sing N N 62
ASP CB CG sing N N 63
ASP CB HB2 sing N N 64
ASP CB HB3 sing N N 65
ASP CG OD1 doub N N 66
ASP CG OD2 sing N N 67
ASP OD2 HD2 sing N N 68
ASP OXT HXT sing N N 69
CYS N CA sing N N 70
CYS N H sing N N 71
CYS N H2 sing N N 72
CYS CA C sing N N 73
CYS CA CB sing N N 74
CYS CA HA sing N N 75
CYS C O doub N N 76
CYS C OXT sing N N 77
CYS CB SG sing N N 78
CYS CB HB2 sing N N 79
CYS CB HB3 sing N N 80
CYS SG HG sing N N 81
CYS OXT HXT sing N N 82
GLN N CA sing N N 83
GLN N H sing N N 84
GLN N H2 sing N N 85
GLN CA C sing N N 86
GLN CA CB sing N N 87
GLN CA HA sing N N 88
GLN C O doub N N 89
GLN C OXT sing N N 90
GLN CB CG sing N N 91
GLN CB HB2 sing N N 92
GLN CB HB3 sing N N 93
GLN CG CD sing N N 94
GLN CG HG2 sing N N 95
GLN CG HG3 sing N N 96
GLN CD OE1 doub N N 97
GLN CD NE2 sing N N 98
GLN NE2 HE21 sing N N 99
GLN NE2 HE22 sing N N 100
GLN OXT HXT sing N N 101
GLU N CA sing N N 102
GLU N H sing N N 103
GLU N H2 sing N N 104
GLU CA C sing N N 105
GLU CA CB sing N N 106
GLU CA HA sing N N 107
GLU C O doub N N 108
GLU C OXT sing N N 109
GLU CB CG sing N N 110
GLU CB HB2 sing N N 111
GLU CB HB3 sing N N 112
GLU CG CD sing N N 113
GLU CG HG2 sing N N 114
GLU CG HG3 sing N N 115
GLU CD OE1 doub N N 116
GLU CD OE2 sing N N 117
GLU OE2 HE2 sing N N 118
GLU OXT HXT sing N N 119
GLY N CA sing N N 120
GLY N H sing N N 121
GLY N H2 sing N N 122
GLY CA C sing N N 123
GLY CA HA2 sing N N 124
GLY CA HA3 sing N N 125
GLY C O doub N N 126
GLY C OXT sing N N 127
GLY OXT HXT sing N N 128
HIS N CA sing N N 129
HIS N H sing N N 130
HIS N H2 sing N N 131
HIS CA C sing N N 132
HIS CA CB sing N N 133
HIS CA HA sing N N 134
HIS C O doub N N 135
HIS C OXT sing N N 136
HIS CB CG sing N N 137
HIS CB HB2 sing N N 138
HIS CB HB3 sing N N 139
HIS CG ND1 sing Y N 140
HIS CG CD2 doub Y N 141
HIS ND1 CE1 doub Y N 142
HIS ND1 HD1 sing N N 143
HIS CD2 NE2 sing Y N 144
HIS CD2 HD2 sing N N 145
HIS CE1 NE2 sing Y N 146
HIS CE1 HE1 sing N N 147
HIS NE2 HE2 sing N N 148
HIS OXT HXT sing N N 149
HOH O H1 sing N N 150
HOH O H2 sing N N 151
ILE N CA sing N N 152
ILE N H sing N N 153
ILE N H2 sing N N 154
ILE CA C sing N N 155
ILE CA CB sing N N 156
ILE CA HA sing N N 157
ILE C O doub N N 158
ILE C OXT sing N N 159
ILE CB CG1 sing N N 160
ILE CB CG2 sing N N 161
ILE CB HB sing N N 162
ILE CG1 CD1 sing N N 163
ILE CG1 HG12 sing N N 164
ILE CG1 HG13 sing N N 165
ILE CG2 HG21 sing N N 166
ILE CG2 HG22 sing N N 167
ILE CG2 HG23 sing N N 168
ILE CD1 HD11 sing N N 169
ILE CD1 HD12 sing N N 170
ILE CD1 HD13 sing N N 171
ILE OXT HXT sing N N 172
LEU N CA sing N N 173
LEU N H sing N N 174
LEU N H2 sing N N 175
LEU CA C sing N N 176
LEU CA CB sing N N 177
LEU CA HA sing N N 178
LEU C O doub N N 179
LEU C OXT sing N N 180
LEU CB CG sing N N 181
LEU CB HB2 sing N N 182
LEU CB HB3 sing N N 183
LEU CG CD1 sing N N 184
LEU CG CD2 sing N N 185
LEU CG HG sing N N 186
LEU CD1 HD11 sing N N 187
LEU CD1 HD12 sing N N 188
LEU CD1 HD13 sing N N 189
LEU CD2 HD21 sing N N 190
LEU CD2 HD22 sing N N 191
LEU CD2 HD23 sing N N 192
LEU OXT HXT sing N N 193
LYS N CA sing N N 194
LYS N H sing N N 195
LYS N H2 sing N N 196
LYS CA C sing N N 197
LYS CA CB sing N N 198
LYS CA HA sing N N 199
LYS C O doub N N 200
LYS C OXT sing N N 201
LYS CB CG sing N N 202
LYS CB HB2 sing N N 203
LYS CB HB3 sing N N 204
LYS CG CD sing N N 205
LYS CG HG2 sing N N 206
LYS CG HG3 sing N N 207
LYS CD CE sing N N 208
LYS CD HD2 sing N N 209
LYS CD HD3 sing N N 210
LYS CE NZ sing N N 211
LYS CE HE2 sing N N 212
LYS CE HE3 sing N N 213
LYS NZ HZ1 sing N N 214
LYS NZ HZ2 sing N N 215
LYS NZ HZ3 sing N N 216
LYS OXT HXT sing N N 217
MET N CA sing N N 218
MET N H sing N N 219
MET N H2 sing N N 220
MET CA C sing N N 221
MET CA CB sing N N 222
MET CA HA sing N N 223
MET C O doub N N 224
MET C OXT sing N N 225
MET CB CG sing N N 226
MET CB HB2 sing N N 227
MET CB HB3 sing N N 228
MET CG SD sing N N 229
MET CG HG2 sing N N 230
MET CG HG3 sing N N 231
MET SD CE sing N N 232
MET CE HE1 sing N N 233
MET CE HE2 sing N N 234
MET CE HE3 sing N N 235
MET OXT HXT sing N N 236
PHE N CA sing N N 237
PHE N H sing N N 238
PHE N H2 sing N N 239
PHE CA C sing N N 240
PHE CA CB sing N N 241
PHE CA HA sing N N 242
PHE C O doub N N 243
PHE C OXT sing N N 244
PHE CB CG sing N N 245
PHE CB HB2 sing N N 246
PHE CB HB3 sing N N 247
PHE CG CD1 doub Y N 248
PHE CG CD2 sing Y N 249
PHE CD1 CE1 sing Y N 250
PHE CD1 HD1 sing N N 251
PHE CD2 CE2 doub Y N 252
PHE CD2 HD2 sing N N 253
PHE CE1 CZ doub Y N 254
PHE CE1 HE1 sing N N 255
PHE CE2 CZ sing Y N 256
PHE CE2 HE2 sing N N 257
PHE CZ HZ sing N N 258
PHE OXT HXT sing N N 259
PRO N CA sing N N 260
PRO N CD sing N N 261
PRO N H sing N N 262
PRO CA C sing N N 263
PRO CA CB sing N N 264
PRO CA HA sing N N 265
PRO C O doub N N 266
PRO C OXT sing N N 267
PRO CB CG sing N N 268
PRO CB HB2 sing N N 269
PRO CB HB3 sing N N 270
PRO CG CD sing N N 271
PRO CG HG2 sing N N 272
PRO CG HG3 sing N N 273
PRO CD HD2 sing N N 274
PRO CD HD3 sing N N 275
PRO OXT HXT sing N N 276
SER N CA sing N N 277
SER N H sing N N 278
SER N H2 sing N N 279
SER CA C sing N N 280
SER CA CB sing N N 281
SER CA HA sing N N 282
SER C O doub N N 283
SER C OXT sing N N 284
SER CB OG sing N N 285
SER CB HB2 sing N N 286
SER CB HB3 sing N N 287
SER OG HG sing N N 288
SER OXT HXT sing N N 289
THR N CA sing N N 290
THR N H sing N N 291
THR N H2 sing N N 292
THR CA C sing N N 293
THR CA CB sing N N 294
THR CA HA sing N N 295
THR C O doub N N 296
THR C OXT sing N N 297
THR CB OG1 sing N N 298
THR CB CG2 sing N N 299
THR CB HB sing N N 300
THR OG1 HG1 sing N N 301
THR CG2 HG21 sing N N 302
THR CG2 HG22 sing N N 303
THR CG2 HG23 sing N N 304
THR OXT HXT sing N N 305
TYR N CA sing N N 306
TYR N H sing N N 307
TYR N H2 sing N N 308
TYR CA C sing N N 309
TYR CA CB sing N N 310
TYR CA HA sing N N 311
TYR C O doub N N 312
TYR C OXT sing N N 313
TYR CB CG sing N N 314
TYR CB HB2 sing N N 315
TYR CB HB3 sing N N 316
TYR CG CD1 doub Y N 317
TYR CG CD2 sing Y N 318
TYR CD1 CE1 sing Y N 319
TYR CD1 HD1 sing N N 320
TYR CD2 CE2 doub Y N 321
TYR CD2 HD2 sing N N 322
TYR CE1 CZ doub Y N 323
TYR CE1 HE1 sing N N 324
TYR CE2 CZ sing Y N 325
TYR CE2 HE2 sing N N 326
TYR CZ OH sing N N 327
TYR OH HH sing N N 328
TYR OXT HXT sing N N 329
VAL N CA sing N N 330
VAL N H sing N N 331
VAL N H2 sing N N 332
VAL CA C sing N N 333
VAL CA CB sing N N 334
VAL CA HA sing N N 335
VAL C O doub N N 336
VAL C OXT sing N N 337
VAL CB CG1 sing N N 338
VAL CB CG2 sing N N 339
VAL CB HB sing N N 340
VAL CG1 HG11 sing N N 341
VAL CG1 HG12 sing N N 342
VAL CG1 HG13 sing N N 343
VAL CG2 HG21 sing N N 344
VAL CG2 HG22 sing N N 345
VAL CG2 HG23 sing N N 346
VAL OXT HXT sing N N 347
#
_pdbx_entity_nonpoly.entity_id 2
_pdbx_entity_nonpoly.name water
_pdbx_entity_nonpoly.comp_id HOH
#
_pdbx_initial_refinement_model.id 1
_pdbx_initial_refinement_model.entity_id_list ?
_pdbx_initial_refinement_model.type 'experimental model'
_pdbx_initial_refinement_model.source_name PDB
_pdbx_initial_refinement_model.accession_code 1IKN
_pdbx_initial_refinement_model.details ?
#
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