data_1F0V # _entry.id 1F0V # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 1F0V NDB PD0150 RCSB RCSB011107 WWPDB D_1000011107 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 1a2w _pdbx_database_related.details 'Crystal structure of a 3D domain-swapped dimer of RNase A at 2.1 A resolution' _pdbx_database_related.content_type unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 1F0V _pdbx_database_status.recvd_initial_deposition_date 2000-05-17 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry N _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Liu, Y.S.' 1 'Gotte, G.' 2 'Libonati, M.' 3 'Eisenberg, D.S.' 4 # _citation.id primary _citation.title 'A domain-swapped RNase A dimer with implications for amyloid formation' _citation.journal_abbrev Nat.Struct.Biol. _citation.journal_volume 8 _citation.page_first 211 _citation.page_last 214 _citation.year 2001 _citation.journal_id_ASTM NSBIEW _citation.country US _citation.journal_id_ISSN 1072-8368 _citation.journal_id_CSD 2024 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 11224563 _citation.pdbx_database_id_DOI 10.1038/84941 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Liu, Y.S.' 1 primary 'Gotte, G.' 2 primary 'Libonati, M.' 3 primary 'Eisenberg, D.S.' 4 # _cell.entry_id 1F0V _cell.length_a 83.569 _cell.length_b 96.341 _cell.length_c 48.240 _cell.angle_alpha 90.00 _cell.angle_beta 107.50 _cell.angle_gamma 90.00 _cell.Z_PDB 8 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 1F0V _symmetry.space_group_name_H-M 'P 1 21 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting monoclinic _symmetry.Int_Tables_number 4 _symmetry.space_group_name_Hall ? # 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 syn "5'-D(*CP*G)-3'" 573.430 4 ? ? ? ? 2 polymer nat 'RIBONUCLEASE A' 13708.326 4 3.1.27.5 ? ? ? 3 non-polymer syn 'PHOSPHATE ION' 94.971 4 ? ? ? ? 4 non-polymer syn GLYCEROL 92.094 24 ? ? ? ? 5 water nat water 18.015 554 ? ? ? ? # _entity_name_com.entity_id 2 _entity_name_com.name 'RNASE 1, RNASE A' # _entity_name_sys.entity_id 2 _entity_name_sys.name E.C.3.1.27.5 # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 polydeoxyribonucleotide no no '(DC)(DG)' CG M,N,O,P ? 2 'polypeptide(L)' no no ;KETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMS ITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV ; ;KETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMS ITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV ; A,B,C,D ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 DC n 1 2 DG n 2 1 LYS n 2 2 GLU n 2 3 THR n 2 4 ALA n 2 5 ALA n 2 6 ALA n 2 7 LYS n 2 8 PHE n 2 9 GLU n 2 10 ARG n 2 11 GLN n 2 12 HIS n 2 13 MET n 2 14 ASP n 2 15 SER n 2 16 SER n 2 17 THR n 2 18 SER n 2 19 ALA n 2 20 ALA n 2 21 SER n 2 22 SER n 2 23 SER n 2 24 ASN n 2 25 TYR n 2 26 CYS n 2 27 ASN n 2 28 GLN n 2 29 MET n 2 30 MET n 2 31 LYS n 2 32 SER n 2 33 ARG n 2 34 ASN n 2 35 LEU n 2 36 THR n 2 37 LYS n 2 38 ASP n 2 39 ARG n 2 40 CYS n 2 41 LYS n 2 42 PRO n 2 43 VAL n 2 44 ASN n 2 45 THR n 2 46 PHE n 2 47 VAL n 2 48 HIS n 2 49 GLU n 2 50 SER n 2 51 LEU n 2 52 ALA n 2 53 ASP n 2 54 VAL n 2 55 GLN n 2 56 ALA n 2 57 VAL n 2 58 CYS n 2 59 SER n 2 60 GLN n 2 61 LYS n 2 62 ASN n 2 63 VAL n 2 64 ALA n 2 65 CYS n 2 66 LYS n 2 67 ASN n 2 68 GLY n 2 69 GLN n 2 70 THR n 2 71 ASN n 2 72 CYS n 2 73 TYR n 2 74 GLN n 2 75 SER n 2 76 TYR n 2 77 SER n 2 78 THR n 2 79 MET n 2 80 SER n 2 81 ILE n 2 82 THR n 2 83 ASP n 2 84 CYS n 2 85 ARG n 2 86 GLU n 2 87 THR n 2 88 GLY n 2 89 SER n 2 90 SER n 2 91 LYS n 2 92 TYR n 2 93 PRO n 2 94 ASN n 2 95 CYS n 2 96 ALA n 2 97 TYR n 2 98 LYS n 2 99 THR n 2 100 THR n 2 101 GLN n 2 102 ALA n 2 103 ASN n 2 104 LYS n 2 105 HIS n 2 106 ILE n 2 107 ILE n 2 108 VAL n 2 109 ALA n 2 110 CYS n 2 111 GLU n 2 112 GLY n 2 113 ASN n 2 114 PRO n 2 115 TYR n 2 116 VAL n 2 117 PRO n 2 118 VAL n 2 119 HIS n 2 120 PHE n 2 121 ASP n 2 122 ALA n 2 123 SER n 2 124 VAL n # _entity_src_nat.entity_id 2 _entity_src_nat.pdbx_src_id 1 _entity_src_nat.pdbx_alt_source_flag sample _entity_src_nat.pdbx_beg_seq_num ? _entity_src_nat.pdbx_end_seq_num ? _entity_src_nat.common_name cattle _entity_src_nat.pdbx_organism_scientific 'Bos taurus' _entity_src_nat.pdbx_ncbi_taxonomy_id 9913 _entity_src_nat.genus Bos _entity_src_nat.species ? _entity_src_nat.strain ? _entity_src_nat.tissue ? _entity_src_nat.tissue_fraction ? _entity_src_nat.pdbx_secretion ? _entity_src_nat.pdbx_fragment ? _entity_src_nat.pdbx_variant ? _entity_src_nat.pdbx_cell_line ? _entity_src_nat.pdbx_atcc ? _entity_src_nat.pdbx_cellular_location ? _entity_src_nat.pdbx_organ PANCREAS _entity_src_nat.pdbx_organelle ? _entity_src_nat.pdbx_cell ? _entity_src_nat.pdbx_plasmid_name ? _entity_src_nat.pdbx_plasmid_details ? _entity_src_nat.details ? # loop_ _struct_ref.id _struct_ref.db_code _struct_ref.db_name _struct_ref.entity_id _struct_ref.pdbx_db_accession _struct_ref.pdbx_align_begin _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_db_isoform 1 RNAS1_BOVIN UNP 2 P61823 27 ;KETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMS ITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV ; ? 2 1F0V PDB 1 1F0V ? ? ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 1F0V A 1 ? 124 ? P61823 27 ? 150 ? 1 124 2 1 1F0V B 1 ? 124 ? P61823 27 ? 150 ? 201 324 3 1 1F0V C 1 ? 124 ? P61823 27 ? 150 ? 401 524 4 1 1F0V D 1 ? 124 ? P61823 27 ? 150 ? 601 724 5 2 1F0V M 1 ? 2 ? 1F0V 751 ? 752 ? 751 752 6 2 1F0V N 1 ? 2 ? 1F0V 753 ? 754 ? 753 754 7 2 1F0V O 1 ? 2 ? 1F0V 755 ? 756 ? 755 756 8 2 1F0V P 1 ? 2 ? 1F0V 757 ? 758 ? 757 758 # 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 DC 'DNA linking' y "2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE" ? 'C9 H14 N3 O7 P' 307.197 DG 'DNA linking' y "2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O7 P' 347.221 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 GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 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 PO4 non-polymer . 'PHOSPHATE ION' ? 'O4 P -3' 94.971 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 1F0V _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_percent_sol 61.96 _exptl_crystal.density_Matthews 3.23 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.pH 6.5 _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pdbx_details '0.1 M Phosphate buffer, 16 % PEG 4000, 2 % Dioxane, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K' _exptl_crystal_grow.pdbx_pH_range . # loop_ _exptl_crystal_grow_comp.crystal_id _exptl_crystal_grow_comp.id _exptl_crystal_grow_comp.sol_id _exptl_crystal_grow_comp.name _exptl_crystal_grow_comp.conc _exptl_crystal_grow_comp.volume _exptl_crystal_grow_comp.details 1 1 1 'Phosphate buffer' ? ? ? 1 2 1 'PEG 4000' ? ? ? 1 3 1 Dioxane ? ? ? 1 4 2 'Phosphate buffer' ? ? ? 1 5 2 'PEG 4000' ? ? ? 1 6 2 Dioxane ? ? ? # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector 'AREA DETECTOR' _diffrn_detector.type ? _diffrn_detector.pdbx_collection_date ? _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.monochromator ? _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.072 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'NSLS BEAMLINE X12B' _diffrn_source.pdbx_wavelength 1.072 _diffrn_source.pdbx_synchrotron_site NSLS _diffrn_source.pdbx_synchrotron_beamline X12B _diffrn_source.pdbx_wavelength_list ? # _reflns.entry_id 1F0V _reflns.observed_criterion_sigma_I 0.0 _reflns.observed_criterion_sigma_F 0.0 _reflns.d_resolution_low 100 _reflns.d_resolution_high 1.70 _reflns.number_obs 76047 _reflns.number_all 76047 _reflns.percent_possible_obs 95.0 _reflns.pdbx_Rmerge_I_obs 0.052 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 14 _reflns.B_iso_Wilson_estimate 20 _reflns.pdbx_redundancy 10 _reflns.R_free_details ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _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_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 1.70 _reflns_shell.d_res_low 1.76 _reflns_shell.percent_possible_obs ? _reflns_shell.percent_possible_all 95.0 _reflns_shell.Rmerge_I_obs 0.08 _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_Rsym_value ? _reflns_shell.pdbx_redundancy 3 _reflns_shell.number_unique_all 7548 _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 1F0V _refine.ls_number_reflns_obs 68191 _refine.ls_number_reflns_all 75842 _refine.pdbx_ls_sigma_I 0.0 _refine.pdbx_ls_sigma_F 0.0 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_d_res_low 10.0 _refine.ls_d_res_high 1.7 _refine.ls_percent_reflns_obs 90.0 _refine.ls_R_factor_obs ? _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.184 _refine.ls_R_factor_R_free 0.213 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 11.2 _refine.ls_number_reflns_R_free 7651 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.B_iso_mean ? _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details ? _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct ? _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 ? _refine.overall_SU_B ? _refine.ls_redundancy_reflns_obs ? _refine.overall_SU_ML ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_data_cutoff_high_rms_absF ? _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.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _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 3804 _refine_hist.pdbx_number_atoms_nucleic_acid 152 _refine_hist.pdbx_number_atoms_ligand 164 _refine_hist.number_atoms_solvent 554 _refine_hist.number_atoms_total 4674 _refine_hist.d_res_high 1.7 _refine_hist.d_res_low 10.0 # 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 c_angle_deg 2.072 ? ? ? 'X-RAY DIFFRACTION' ? c_bond_d 0.019 ? ? ? 'X-RAY DIFFRACTION' ? # _struct.entry_id 1F0V _struct.title 'Crystal structure of an Rnase A dimer displaying a new type of 3D domain swapping' _struct.pdbx_descriptor 'RIBONUCLEASE A/DNA COMPLEX' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1F0V _struct_keywords.pdbx_keywords hydrolase/DNA _struct_keywords.text 'domain swapping, crystal, ribonuclease, bovine pancreas, hydrolase-DNA COMPLEX' # 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 1 ? C N N 1 ? D N N 1 ? E N N 2 ? F N N 2 ? G N N 2 ? H N N 2 ? I N N 3 ? J N N 3 ? K N N 4 ? L N N 4 ? M N N 4 ? N N N 4 ? O N N 4 ? P N N 4 ? Q N N 3 ? R N N 4 ? S N N 4 ? T N N 4 ? U N N 4 ? V N N 4 ? W N N 4 ? X N N 4 ? Y N N 4 ? Z N N 4 ? AA N N 3 ? BA N N 4 ? CA N N 4 ? DA N N 4 ? EA N N 4 ? FA N N 4 ? GA N N 4 ? HA N N 4 ? IA N N 4 ? JA N N 4 ? KA N N 5 ? LA N N 5 ? MA N N 5 ? NA N N 5 ? OA N N 5 ? PA N N 5 ? QA N N 5 ? RA N N 5 ? # _struct_biol.id 1 # 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 E 3 ? MET E 13 ? THR A 3 MET A 13 1 ? 11 HELX_P HELX_P2 2 ASN E 24 ? ARG E 33 ? ASN A 24 ARG A 33 1 ? 10 HELX_P HELX_P3 3 SER E 50 ? VAL E 57 ? SER A 50 VAL A 57 1 ? 8 HELX_P HELX_P4 4 CYS E 58 ? GLN E 60 ? CYS A 58 GLN A 60 5 ? 3 HELX_P HELX_P5 5 THR F 3 ? MET F 13 ? THR B 203 MET B 213 1 ? 11 HELX_P HELX_P6 6 ASN F 24 ? ARG F 33 ? ASN B 224 ARG B 233 1 ? 10 HELX_P HELX_P7 7 SER F 50 ? VAL F 57 ? SER B 250 VAL B 257 1 ? 8 HELX_P HELX_P8 8 CYS F 58 ? GLN F 60 ? CYS B 258 GLN B 260 5 ? 3 HELX_P HELX_P9 9 THR G 3 ? MET G 13 ? THR C 403 MET C 413 1 ? 11 HELX_P HELX_P10 10 ASN G 24 ? ARG G 33 ? ASN C 424 ARG C 433 1 ? 10 HELX_P HELX_P11 11 SER G 50 ? VAL G 57 ? SER C 450 VAL C 457 1 ? 8 HELX_P HELX_P12 12 CYS G 58 ? GLN G 60 ? CYS C 458 GLN C 460 5 ? 3 HELX_P HELX_P13 13 THR H 3 ? MET H 13 ? THR D 603 MET D 613 1 ? 11 HELX_P HELX_P14 14 ASN H 24 ? ARG H 33 ? ASN D 624 ARG D 633 1 ? 10 HELX_P HELX_P15 15 SER H 50 ? ALA H 56 ? SER D 650 ALA D 656 1 ? 7 HELX_P HELX_P16 16 VAL H 57 ? GLN H 60 ? VAL D 657 GLN D 660 5 ? 4 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? E CYS 26 SG ? ? ? 1_555 E CYS 84 SG ? ? A CYS 26 A CYS 84 1_555 ? ? ? ? ? ? ? 2.079 ? disulf2 disulf ? ? E CYS 40 SG ? ? ? 1_555 E CYS 95 SG ? ? A CYS 40 A CYS 95 1_555 ? ? ? ? ? ? ? 2.058 ? disulf3 disulf ? ? E CYS 58 SG ? ? ? 1_555 E CYS 110 SG ? ? A CYS 58 A CYS 110 1_555 ? ? ? ? ? ? ? 2.093 ? disulf4 disulf ? ? E CYS 65 SG ? ? ? 1_555 E CYS 72 SG ? ? A CYS 65 A CYS 72 1_555 ? ? ? ? ? ? ? 2.084 ? disulf5 disulf ? ? F CYS 26 SG ? ? ? 1_555 F CYS 84 SG ? ? B CYS 226 B CYS 284 1_555 ? ? ? ? ? ? ? 2.077 ? disulf6 disulf ? ? F CYS 40 SG ? ? ? 1_555 F CYS 95 SG ? ? B CYS 240 B CYS 295 1_555 ? ? ? ? ? ? ? 2.040 ? disulf7 disulf ? ? F CYS 58 SG ? ? ? 1_555 F CYS 110 SG ? ? B CYS 258 B CYS 310 1_555 ? ? ? ? ? ? ? 2.115 ? disulf8 disulf ? ? F CYS 65 SG ? ? ? 1_555 F CYS 72 SG ? ? B CYS 265 B CYS 272 1_555 ? ? ? ? ? ? ? 2.105 ? disulf9 disulf ? ? G CYS 26 SG ? ? ? 1_555 G CYS 84 SG ? ? C CYS 426 C CYS 484 1_555 ? ? ? ? ? ? ? 2.085 ? disulf10 disulf ? ? G CYS 40 SG ? ? ? 1_555 G CYS 95 SG ? ? C CYS 440 C CYS 495 1_555 ? ? ? ? ? ? ? 2.055 ? disulf11 disulf ? ? G CYS 58 SG ? ? ? 1_555 G CYS 110 SG ? ? C CYS 458 C CYS 510 1_555 ? ? ? ? ? ? ? 2.075 ? disulf12 disulf ? ? G CYS 65 SG ? ? ? 1_555 G CYS 72 SG ? ? C CYS 465 C CYS 472 1_555 ? ? ? ? ? ? ? 2.078 ? disulf13 disulf ? ? H CYS 26 SG ? ? ? 1_555 H CYS 84 SG ? ? D CYS 626 D CYS 684 1_555 ? ? ? ? ? ? ? 2.061 ? disulf14 disulf ? ? H CYS 40 SG ? ? ? 1_555 H CYS 95 SG ? ? D CYS 640 D CYS 695 1_555 ? ? ? ? ? ? ? 2.022 ? disulf15 disulf ? ? H CYS 58 SG ? ? ? 1_555 H CYS 110 SG ? ? D CYS 658 D CYS 710 1_555 ? ? ? ? ? ? ? 2.098 ? disulf16 disulf ? ? H CYS 65 SG ? ? ? 1_555 H CYS 72 SG ? ? D CYS 665 D CYS 672 1_555 ? ? ? ? ? ? ? 2.087 ? # _struct_conn_type.id disulf _struct_conn_type.criteria ? _struct_conn_type.reference ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 TYR 92 E . ? TYR 92 A PRO 93 E ? PRO 93 A 1 0.69 2 TYR 92 F . ? TYR 292 B PRO 93 F ? PRO 293 B 1 1.06 3 TYR 92 G . ? TYR 492 C PRO 93 G ? PRO 493 C 1 0.01 4 TYR 92 H . ? TYR 692 D PRO 93 H ? PRO 693 D 1 -0.53 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 3 ? B ? 6 ? C ? 6 ? D ? 6 ? E ? 6 ? F ? 3 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel B 4 5 ? anti-parallel B 5 6 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel C 4 5 ? anti-parallel C 5 6 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel D 4 5 ? anti-parallel D 5 6 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel E 4 5 ? anti-parallel E 5 6 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 VAL E 43 ? VAL E 47 ? VAL A 43 VAL A 47 A 2 MET E 79 ? GLU E 86 ? MET A 79 GLU A 86 A 3 TYR E 97 ? LYS E 104 ? TYR A 97 LYS A 104 B 1 LYS E 61 ? VAL E 63 ? LYS A 61 VAL A 63 B 2 CYS E 72 ? GLN E 74 ? CYS A 72 GLN A 74 B 3 ILE E 106 ? VAL E 124 ? ILE A 106 VAL A 124 B 4 TYR F 97 ? SER F 123 ? TYR B 297 SER B 323 B 5 CYS F 72 ? GLN F 74 ? CYS B 272 GLN B 274 B 6 LYS F 61 ? VAL F 63 ? LYS B 261 VAL B 263 C 1 LYS E 61 ? VAL E 63 ? LYS A 61 VAL A 63 C 2 CYS E 72 ? GLN E 74 ? CYS A 72 GLN A 74 C 3 ILE E 106 ? VAL E 124 ? ILE A 106 VAL A 124 C 4 TYR F 97 ? SER F 123 ? TYR B 297 SER B 323 C 5 MET F 79 ? GLU F 86 ? MET B 279 GLU B 286 C 6 VAL F 43 ? VAL F 47 ? VAL B 243 VAL B 247 D 1 LYS H 61 ? VAL H 63 ? LYS D 661 VAL D 663 D 2 CYS H 72 ? GLN H 74 ? CYS D 672 GLN D 674 D 3 ILE H 106 ? VAL H 124 ? ILE D 706 VAL D 724 D 4 TYR G 97 ? SER G 123 ? TYR C 497 SER C 523 D 5 CYS G 72 ? GLN G 74 ? CYS C 472 GLN C 474 D 6 LYS G 61 ? VAL G 63 ? LYS C 461 VAL C 463 E 1 LYS H 61 ? VAL H 63 ? LYS D 661 VAL D 663 E 2 CYS H 72 ? GLN H 74 ? CYS D 672 GLN D 674 E 3 ILE H 106 ? VAL H 124 ? ILE D 706 VAL D 724 E 4 TYR G 97 ? SER G 123 ? TYR C 497 SER C 523 E 5 MET G 79 ? GLU G 86 ? MET C 479 GLU C 486 E 6 VAL G 43 ? VAL G 47 ? VAL C 443 VAL C 447 F 1 VAL H 43 ? VAL H 47 ? VAL D 643 VAL D 647 F 2 MET H 79 ? GLU H 86 ? MET D 679 GLU D 686 F 3 TYR H 97 ? LYS H 104 ? TYR D 697 LYS D 704 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N PHE E 46 ? N PHE A 46 O THR E 82 ? O THR A 82 A 2 3 O ARG E 85 ? O ARG A 85 N LYS E 98 ? N LYS A 98 B 1 2 N VAL E 63 ? N VAL A 63 O CYS E 72 ? O CYS A 72 B 2 3 N TYR E 73 ? N TYR A 73 O VAL E 108 ? O VAL A 108 B 3 4 O VAL E 124 ? O VAL A 124 N HIS F 105 ? N HIS B 305 B 4 5 O VAL F 108 ? O VAL B 308 N TYR F 73 ? N TYR B 273 B 5 6 N GLN F 74 ? N GLN B 274 O LYS F 61 ? O LYS B 261 C 1 2 N VAL E 63 ? N VAL A 63 O CYS E 72 ? O CYS A 72 C 2 3 N TYR E 73 ? N TYR A 73 O VAL E 108 ? O VAL A 108 C 3 4 O VAL E 124 ? O VAL A 124 N HIS F 105 ? N HIS B 305 C 4 5 O LYS F 104 ? O LYS B 304 N MET F 79 ? N MET B 279 C 5 6 N CYS F 84 ? N CYS B 284 O ASN F 44 ? O ASN B 244 D 1 2 N VAL H 63 ? N VAL D 663 O CYS H 72 ? O CYS D 672 D 2 3 O TYR H 73 ? O TYR D 673 N VAL H 108 ? N VAL D 708 D 3 4 O VAL H 124 ? O VAL D 724 N HIS G 105 ? N HIS C 505 D 4 5 O VAL G 108 ? O VAL C 508 N TYR G 73 ? N TYR C 473 D 5 6 N GLN G 74 ? N GLN C 474 O LYS G 61 ? O LYS C 461 E 1 2 N VAL H 63 ? N VAL D 663 O CYS H 72 ? O CYS D 672 E 2 3 O TYR H 73 ? O TYR D 673 N VAL H 108 ? N VAL D 708 E 3 4 O VAL H 124 ? O VAL D 724 N HIS G 105 ? N HIS C 505 E 4 5 O LYS G 104 ? O LYS C 504 N MET G 79 ? N MET C 479 E 5 6 O CYS G 84 ? O CYS C 484 N ASN G 44 ? N ASN C 444 F 1 2 O PHE H 46 ? O PHE D 646 N THR H 82 ? N THR D 682 F 2 3 O ARG H 85 ? O ARG D 685 N LYS H 98 ? N LYS D 698 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE PO4 A 801' AC2 Software ? ? ? ? 10 'BINDING SITE FOR RESIDUE PO4 B 802' AC3 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE PO4 C 803' AC4 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE PO4 P 804' AC5 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE GOL D 901' AC6 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE GOL B 902' AC7 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE GOL C 903' AC8 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE GOL A 904' AC9 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE GOL B 905' BC1 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE GOL B 906' BC2 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE GOL B 907' BC3 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE GOL A 908' BC4 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE GOL D 909' BC5 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE GOL B 910' BC6 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE GOL A 911' BC7 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE GOL C 912' BC8 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE GOL D 913' BC9 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE GOL B 914' CC1 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE GOL A 915' CC2 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE GOL D 916' CC3 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE GOL C 917' CC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE GOL A 918' CC5 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE GOL C 919' CC6 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE GOL B 920' CC7 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE GOL B 921' CC8 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE GOL B 922' CC9 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE GOL A 923' DC1 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE GOL D 924' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 9 GLN E 11 ? GLN A 11 . ? 1_555 ? 2 AC1 9 HIS E 12 ? HIS A 12 . ? 1_555 ? 3 AC1 9 LYS E 41 ? LYS A 41 . ? 1_555 ? 4 AC1 9 HOH OA . ? HOH A 1004 . ? 1_555 ? 5 AC1 9 HOH OA . ? HOH A 1252 . ? 1_555 ? 6 AC1 9 HOH OA . ? HOH A 1553 . ? 1_555 ? 7 AC1 9 HIS F 119 ? HIS B 319 . ? 1_555 ? 8 AC1 9 PHE F 120 ? PHE B 320 . ? 1_555 ? 9 AC1 9 DG A 2 ? DG M 752 . ? 1_555 ? 10 AC2 10 HIS E 119 ? HIS A 119 . ? 1_555 ? 11 AC2 10 PHE E 120 ? PHE A 120 . ? 1_555 ? 12 AC2 10 GLN F 11 ? GLN B 211 . ? 1_555 ? 13 AC2 10 HIS F 12 ? HIS B 212 . ? 1_555 ? 14 AC2 10 LYS F 41 ? LYS B 241 . ? 1_555 ? 15 AC2 10 HOH PA . ? HOH B 1074 . ? 1_555 ? 16 AC2 10 HOH PA . ? HOH B 1396 . ? 1_555 ? 17 AC2 10 HOH PA . ? HOH B 1554 . ? 1_555 ? 18 AC2 10 HOH PA . ? HOH B 1555 . ? 1_555 ? 19 AC2 10 DG B 2 ? DG N 754 . ? 1_555 ? 20 AC3 8 GLN G 11 ? GLN C 411 . ? 1_555 ? 21 AC3 8 HIS G 12 ? HIS C 412 . ? 1_555 ? 22 AC3 8 LYS G 41 ? LYS C 441 . ? 1_555 ? 23 AC3 8 HOH QA . ? HOH C 1045 . ? 1_555 ? 24 AC3 8 HOH QA . ? HOH C 1571 . ? 1_555 ? 25 AC3 8 HIS H 119 ? HIS D 719 . ? 1_555 ? 26 AC3 8 PHE H 120 ? PHE D 720 . ? 1_555 ? 27 AC3 8 DG C 2 ? DG O 756 . ? 1_555 ? 28 AC4 8 HIS G 119 ? HIS C 519 . ? 1_555 ? 29 AC4 8 PHE G 120 ? PHE C 520 . ? 1_555 ? 30 AC4 8 GLN H 11 ? GLN D 611 . ? 1_555 ? 31 AC4 8 HIS H 12 ? HIS D 612 . ? 1_555 ? 32 AC4 8 LYS H 41 ? LYS D 641 . ? 1_555 ? 33 AC4 8 DG D 2 ? DG P 758 . ? 1_555 ? 34 AC4 8 HOH NA . ? HOH P 1029 . ? 1_555 ? 35 AC4 8 HOH NA . ? HOH P 1273 . ? 1_555 ? 36 AC5 9 ALA G 5 ? ALA C 405 . ? 1_555 ? 37 AC5 9 GLU G 111 ? GLU C 511 . ? 1_555 ? 38 AC5 9 ASN H 113 ? ASN D 713 . ? 1_555 ? 39 AC5 9 PRO H 114 ? PRO D 714 . ? 1_555 ? 40 AC5 9 HOH RA . ? HOH D 1051 . ? 1_555 ? 41 AC5 9 HOH RA . ? HOH D 1254 . ? 1_555 ? 42 AC5 9 HOH RA . ? HOH D 1355 . ? 1_555 ? 43 AC5 9 HOH RA . ? HOH D 1575 . ? 1_555 ? 44 AC5 9 HOH RA . ? HOH D 1576 . ? 1_555 ? 45 AC6 4 GLN F 101 ? GLN B 301 . ? 1_555 ? 46 AC6 4 ALA F 102 ? ALA B 302 . ? 1_555 ? 47 AC6 4 ASN F 103 ? ASN B 303 . ? 1_555 ? 48 AC6 4 HOH PA . ? HOH B 1442 . ? 1_555 ? 49 AC7 2 PRO G 42 ? PRO C 442 . ? 1_555 ? 50 AC7 2 HOH QA . ? HOH C 1179 . ? 1_555 ? 51 AC8 2 GLN E 69 ? GLN A 69 . ? 1_555 ? 52 AC8 2 THR E 70 ? THR A 70 . ? 1_555 ? 53 AC9 7 GLU F 2 ? GLU B 202 . ? 1_555 ? 54 AC9 7 ALA F 6 ? ALA B 206 . ? 1_555 ? 55 AC9 7 GLU F 9 ? GLU B 209 . ? 1_555 ? 56 AC9 7 ARG F 10 ? ARG B 210 . ? 1_555 ? 57 AC9 7 GOL Z . ? GOL B 922 . ? 1_555 ? 58 AC9 7 HOH PA . ? HOH B 1307 . ? 1_555 ? 59 AC9 7 HOH PA . ? HOH B 1514 . ? 1_555 ? 60 BC1 4 SER F 23 ? SER B 223 . ? 1_555 ? 61 BC1 4 THR F 99 ? THR B 299 . ? 1_555 ? 62 BC1 4 THR F 100 ? THR B 300 . ? 1_555 ? 63 BC1 4 GLN F 101 ? GLN B 301 . ? 1_555 ? 64 BC2 6 VAL E 124 ? VAL A 124 . ? 1_555 ? 65 BC2 6 VAL F 63 ? VAL B 263 . ? 1_555 ? 66 BC2 6 ALA F 64 ? ALA B 264 . ? 1_555 ? 67 BC2 6 GLN F 74 ? GLN B 274 . ? 1_555 ? 68 BC2 6 ILE F 107 ? ILE B 307 . ? 1_555 ? 69 BC2 6 HOH PA . ? HOH B 1192 . ? 1_555 ? 70 BC3 3 SER E 50 ? SER A 50 . ? 1_555 ? 71 BC3 3 ALA E 52 ? ALA A 52 . ? 1_555 ? 72 BC3 3 ASP E 53 ? ASP A 53 . ? 1_555 ? 73 BC4 6 GLU H 111 ? GLU D 711 . ? 1_555 ? 74 BC4 6 GLY H 112 ? GLY D 712 . ? 1_555 ? 75 BC4 6 ASN H 113 ? ASN D 713 . ? 1_555 ? 76 BC4 6 HOH RA . ? HOH D 1303 . ? 1_555 ? 77 BC4 6 HOH RA . ? HOH D 1581 . ? 1_555 ? 78 BC4 6 HOH RA . ? HOH D 1582 . ? 1_555 ? 79 BC5 9 ASN E 113 ? ASN A 113 . ? 1_555 ? 80 BC5 9 PRO E 114 ? PRO A 114 . ? 1_555 ? 81 BC5 9 VAL E 116 ? VAL A 116 . ? 1_555 ? 82 BC5 9 GLU F 111 ? GLU B 311 . ? 1_555 ? 83 BC5 9 GLY F 112 ? GLY B 312 . ? 1_555 ? 84 BC5 9 ASN F 113 ? ASN B 313 . ? 1_555 ? 85 BC5 9 GOL X . ? GOL B 920 . ? 1_555 ? 86 BC5 9 HOH PA . ? HOH B 1056 . ? 1_555 ? 87 BC5 9 HOH PA . ? HOH B 1123 . ? 1_555 ? 88 BC6 2 ASN G 103 ? ASN C 503 . ? 1_655 ? 89 BC6 2 GOL CA . ? GOL C 912 . ? 1_655 ? 90 BC7 5 THR E 78 ? THR A 78 . ? 1_455 ? 91 BC7 5 GOL M . ? GOL A 911 . ? 1_455 ? 92 BC7 5 THR G 78 ? THR C 478 . ? 1_555 ? 93 BC7 5 ASN G 103 ? ASN C 503 . ? 1_555 ? 94 BC7 5 HOH QA . ? HOH C 1157 . ? 1_555 ? 95 BC8 4 GLN H 101 ? GLN D 701 . ? 1_555 ? 96 BC8 4 ALA H 102 ? ALA D 702 . ? 1_555 ? 97 BC8 4 ASN H 103 ? ASN D 703 . ? 1_555 ? 98 BC8 4 HOH RA . ? HOH D 1509 . ? 1_555 ? 99 BC9 4 ARG F 39 ? ARG B 239 . ? 1_555 ? 100 BC9 4 CYS F 40 ? CYS B 240 . ? 1_555 ? 101 BC9 4 LYS F 41 ? LYS B 241 . ? 1_555 ? 102 BC9 4 PRO F 42 ? PRO B 242 . ? 1_555 ? 103 CC1 3 ARG E 39 ? ARG A 39 . ? 1_555 ? 104 CC1 3 PRO E 42 ? PRO A 42 . ? 1_555 ? 105 CC1 3 HOH OA . ? HOH A 1330 . ? 1_555 ? 106 CC2 5 SER H 23 ? SER D 623 . ? 1_555 ? 107 CC2 5 THR H 99 ? THR D 699 . ? 1_555 ? 108 CC2 5 THR H 100 ? THR D 700 . ? 1_555 ? 109 CC2 5 GLN H 101 ? GLN D 701 . ? 1_555 ? 110 CC2 5 HOH RA . ? HOH D 1281 . ? 1_555 ? 111 CC3 4 SER G 22 ? SER C 422 . ? 1_555 ? 112 CC3 4 THR G 99 ? THR C 499 . ? 1_555 ? 113 CC3 4 THR G 100 ? THR C 500 . ? 1_555 ? 114 CC3 4 GLN G 101 ? GLN C 501 . ? 1_555 ? 115 CC4 3 SER E 23 ? SER A 23 . ? 1_555 ? 116 CC4 3 THR E 99 ? THR A 99 . ? 1_555 ? 117 CC4 3 HOH OA . ? HOH A 1062 . ? 1_555 ? 118 CC5 3 SER G 50 ? SER C 450 . ? 1_555 ? 119 CC5 3 ASP G 53 ? ASP C 453 . ? 1_555 ? 120 CC5 3 HOH QA . ? HOH C 1437 . ? 1_555 ? 121 CC6 6 ALA F 4 ? ALA B 204 . ? 1_555 ? 122 CC6 6 GLU F 111 ? GLU B 311 . ? 1_555 ? 123 CC6 6 ASN F 113 ? ASN B 313 . ? 1_555 ? 124 CC6 6 GOL V . ? GOL B 910 . ? 1_555 ? 125 CC6 6 HOH PA . ? HOH B 1332 . ? 1_555 ? 126 CC6 6 HOH PA . ? HOH B 1494 . ? 1_555 ? 127 CC7 6 ALA F 56 ? ALA B 256 . ? 1_555 ? 128 CC7 6 SER F 59 ? SER B 259 . ? 1_555 ? 129 CC7 6 GLN F 60 ? GLN B 260 . ? 1_555 ? 130 CC7 6 HOH PA . ? HOH B 1010 . ? 1_555 ? 131 CC7 6 HOH PA . ? HOH B 1348 . ? 1_555 ? 132 CC7 6 HOH PA . ? HOH B 1431 . ? 1_555 ? 133 CC8 5 GLU F 2 ? GLU B 202 . ? 1_555 ? 134 CC8 5 ARG F 10 ? ARG B 210 . ? 1_555 ? 135 CC8 5 ASN F 34 ? ASN B 234 . ? 1_555 ? 136 CC8 5 GOL S . ? GOL B 905 . ? 1_555 ? 137 CC8 5 HOH PA . ? HOH B 1269 . ? 1_555 ? 138 CC9 5 SER E 77 ? SER A 77 . ? 1_555 ? 139 CC9 5 HOH OA . ? HOH A 1140 . ? 1_555 ? 140 CC9 5 HOH OA . ? HOH A 1579 . ? 1_555 ? 141 CC9 5 THR G 78 ? THR C 478 . ? 1_655 ? 142 CC9 5 HIS G 105 ? HIS C 505 . ? 1_655 ? 143 DC1 4 ASP H 53 ? ASP D 653 . ? 1_555 ? 144 DC1 4 ALA H 56 ? ALA D 656 . ? 1_555 ? 145 DC1 4 HOH RA . ? HOH D 1021 . ? 1_555 ? 146 DC1 4 HOH RA . ? HOH D 1028 . ? 1_555 ? # _database_PDB_matrix.entry_id 1F0V _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 1F0V _atom_sites.fract_transf_matrix[1][1] 0.011966 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.003773 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.010380 _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] 0.021736 _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 P 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 O "O5'" . DC A 1 1 ? 47.136 -11.625 -5.049 1.00 21.69 ? 751 DC M "O5'" 1 ATOM 2 C "C5'" . DC A 1 1 ? 47.626 -10.960 -6.212 1.00 19.04 ? 751 DC M "C5'" 1 ATOM 3 C "C4'" . DC A 1 1 ? 46.674 -9.850 -6.595 1.00 16.14 ? 751 DC M "C4'" 1 ATOM 4 O "O4'" . DC A 1 1 ? 45.385 -10.411 -6.939 1.00 15.95 ? 751 DC M "O4'" 1 ATOM 5 C "C3'" . DC A 1 1 ? 46.374 -8.905 -5.439 1.00 20.16 ? 751 DC M "C3'" 1 ATOM 6 O "O3'" . DC A 1 1 ? 47.227 -7.796 -5.542 1.00 19.82 ? 751 DC M "O3'" 1 ATOM 7 C "C2'" . DC A 1 1 ? 44.924 -8.502 -5.677 1.00 20.06 ? 751 DC M "C2'" 1 ATOM 8 C "C1'" . DC A 1 1 ? 44.438 -9.381 -6.819 1.00 17.90 ? 751 DC M "C1'" 1 ATOM 9 N N1 . DC A 1 1 ? 43.129 -9.996 -6.511 1.00 16.01 ? 751 DC M N1 1 ATOM 10 C C2 . DC A 1 1 ? 41.970 -9.244 -6.754 1.00 12.40 ? 751 DC M C2 1 ATOM 11 O O2 . DC A 1 1 ? 42.104 -8.132 -7.261 1.00 15.48 ? 751 DC M O2 1 ATOM 12 N N3 . DC A 1 1 ? 40.755 -9.742 -6.412 1.00 14.13 ? 751 DC M N3 1 ATOM 13 C C4 . DC A 1 1 ? 40.679 -10.959 -5.821 1.00 15.65 ? 751 DC M C4 1 ATOM 14 N N4 . DC A 1 1 ? 39.472 -11.407 -5.428 1.00 15.17 ? 751 DC M N4 1 ATOM 15 C C5 . DC A 1 1 ? 41.832 -11.750 -5.594 1.00 12.77 ? 751 DC M C5 1 ATOM 16 C C6 . DC A 1 1 ? 43.031 -11.249 -5.961 1.00 17.04 ? 751 DC M C6 1 ATOM 17 P P . DG A 1 2 ? 47.375 -6.785 -4.284 1.00 26.26 ? 752 DG M P 1 ATOM 18 O OP1 . DG A 1 2 ? 48.671 -6.107 -4.351 1.00 29.73 ? 752 DG M OP1 1 ATOM 19 O OP2 . DG A 1 2 ? 47.016 -7.614 -3.072 1.00 26.20 ? 752 DG M OP2 1 ATOM 20 O "O5'" . DG A 1 2 ? 46.247 -5.754 -4.656 1.00 23.21 ? 752 DG M "O5'" 1 ATOM 21 C "C5'" . DG A 1 2 ? 45.332 -5.305 -3.750 1.00 23.52 ? 752 DG M "C5'" 1 ATOM 22 C "C4'" . DG A 1 2 ? 44.919 -3.914 -4.139 1.00 22.10 ? 752 DG M "C4'" 1 ATOM 23 O "O4'" . DG A 1 2 ? 43.874 -3.590 -3.217 1.00 23.00 ? 752 DG M "O4'" 1 ATOM 24 C "C3'" . DG A 1 2 ? 46.019 -2.875 -3.949 1.00 22.13 ? 752 DG M "C3'" 1 ATOM 25 O "O3'" . DG A 1 2 ? 45.901 -1.857 -4.937 1.00 23.67 ? 752 DG M "O3'" 1 ATOM 26 C "C2'" . DG A 1 2 ? 45.709 -2.292 -2.572 1.00 19.41 ? 752 DG M "C2'" 1 ATOM 27 C "C1'" . DG A 1 2 ? 44.202 -2.452 -2.457 1.00 17.48 ? 752 DG M "C1'" 1 ATOM 28 N N9 . DG A 1 2 ? 43.690 -2.707 -1.115 1.00 13.34 ? 752 DG M N9 1 ATOM 29 C C8 . DG A 1 2 ? 44.229 -3.528 -0.146 1.00 16.53 ? 752 DG M C8 1 ATOM 30 N N7 . DG A 1 2 ? 43.558 -3.489 0.978 1.00 13.24 ? 752 DG M N7 1 ATOM 31 C C5 . DG A 1 2 ? 42.486 -2.640 0.722 1.00 13.96 ? 752 DG M C5 1 ATOM 32 C C6 . DG A 1 2 ? 41.418 -2.207 1.564 1.00 14.31 ? 752 DG M C6 1 ATOM 33 O O6 . DG A 1 2 ? 41.180 -2.507 2.734 1.00 13.45 ? 752 DG M O6 1 ATOM 34 N N1 . DG A 1 2 ? 40.592 -1.311 0.911 1.00 13.76 ? 752 DG M N1 1 ATOM 35 C C2 . DG A 1 2 ? 40.759 -0.876 -0.372 1.00 17.26 ? 752 DG M C2 1 ATOM 36 N N2 . DG A 1 2 ? 39.826 -0.009 -0.806 1.00 18.10 ? 752 DG M N2 1 ATOM 37 N N3 . DG A 1 2 ? 41.746 -1.263 -1.169 1.00 16.15 ? 752 DG M N3 1 ATOM 38 C C4 . DG A 1 2 ? 42.556 -2.141 -0.563 1.00 14.94 ? 752 DG M C4 1 ATOM 39 O "O5'" . DC B 1 1 ? 33.861 48.894 29.383 1.00 24.90 ? 753 DC N "O5'" 1 ATOM 40 C "C5'" . DC B 1 1 ? 34.073 48.143 30.548 1.00 20.10 ? 753 DC N "C5'" 1 ATOM 41 C "C4'" . DC B 1 1 ? 33.279 46.859 30.512 1.00 14.43 ? 753 DC N "C4'" 1 ATOM 42 O "O4'" . DC B 1 1 ? 31.866 47.180 30.356 1.00 15.30 ? 753 DC N "O4'" 1 ATOM 43 C "C3'" . DC B 1 1 ? 33.614 45.927 29.343 1.00 16.08 ? 753 DC N "C3'" 1 ATOM 44 O "O3'" . DC B 1 1 ? 34.514 44.920 29.771 1.00 17.93 ? 753 DC N "O3'" 1 ATOM 45 C "C2'" . DC B 1 1 ? 32.271 45.326 28.958 1.00 17.33 ? 753 DC N "C2'" 1 ATOM 46 C "C1'" . DC B 1 1 ? 31.187 46.172 29.660 1.00 15.08 ? 753 DC N "C1'" 1 ATOM 47 N N1 . DC B 1 1 ? 30.346 46.788 28.615 1.00 16.04 ? 753 DC N N1 1 ATOM 48 C C2 . DC B 1 1 ? 29.076 46.252 28.364 1.00 16.07 ? 753 DC N C2 1 ATOM 49 O O2 . DC B 1 1 ? 28.669 45.242 29.037 1.00 17.22 ? 753 DC N O2 1 ATOM 50 N N3 . DC B 1 1 ? 28.295 46.806 27.390 1.00 17.15 ? 753 DC N N3 1 ATOM 51 C C4 . DC B 1 1 ? 28.760 47.844 26.670 1.00 18.67 ? 753 DC N C4 1 ATOM 52 N N4 . DC B 1 1 ? 27.938 48.354 25.737 1.00 17.29 ? 753 DC N N4 1 ATOM 53 C C5 . DC B 1 1 ? 30.057 48.395 26.890 1.00 14.59 ? 753 DC N C5 1 ATOM 54 C C6 . DC B 1 1 ? 30.814 47.851 27.880 1.00 16.72 ? 753 DC N C6 1 ATOM 55 P P . DG B 1 2 ? 35.737 44.476 28.846 1.00 22.26 ? 754 DG N P 1 ATOM 56 O OP1 . DG B 1 2 ? 36.709 43.784 29.752 1.00 22.03 ? 754 DG N OP1 1 ATOM 57 O OP2 . DG B 1 2 ? 36.188 45.643 28.045 1.00 28.09 ? 754 DG N OP2 1 ATOM 58 O "O5'" . DG B 1 2 ? 35.103 43.348 27.893 1.00 17.35 ? 754 DG N "O5'" 1 ATOM 59 C "C5'" . DG B 1 2 ? 34.279 42.308 28.427 1.00 19.38 ? 754 DG N "C5'" 1 ATOM 60 C "C4'" . DG B 1 2 ? 34.889 40.945 28.174 1.00 17.93 ? 754 DG N "C4'" 1 ATOM 61 O "O4'" . DG B 1 2 ? 34.832 40.688 26.757 1.00 20.30 ? 754 DG N "O4'" 1 ATOM 62 C "C3'" . DG B 1 2 ? 36.363 40.810 28.579 1.00 13.40 ? 754 DG N "C3'" 1 ATOM 63 O "O3'" . DG B 1 2 ? 36.453 39.560 29.293 1.00 15.47 ? 754 DG N "O3'" 1 ATOM 64 C "C2'" . DG B 1 2 ? 37.099 40.801 27.237 1.00 13.61 ? 754 DG N "C2'" 1 ATOM 65 C "C1'" . DG B 1 2 ? 36.069 40.135 26.358 1.00 18.14 ? 754 DG N "C1'" 1 ATOM 66 N N9 . DG B 1 2 ? 36.200 40.355 24.937 1.00 15.84 ? 754 DG N N9 1 ATOM 67 C C8 . DG B 1 2 ? 36.964 41.277 24.254 1.00 17.92 ? 754 DG N C8 1 ATOM 68 N N7 . DG B 1 2 ? 36.867 41.158 22.947 1.00 15.42 ? 754 DG N N7 1 ATOM 69 C C5 . DG B 1 2 ? 35.966 40.106 22.780 1.00 14.48 ? 754 DG N C5 1 ATOM 70 C C6 . DG B 1 2 ? 35.472 39.518 21.600 1.00 14.49 ? 754 DG N C6 1 ATOM 71 O O6 . DG B 1 2 ? 35.746 39.822 20.449 1.00 13.45 ? 754 DG N O6 1 ATOM 72 N N1 . DG B 1 2 ? 34.589 38.482 21.863 1.00 16.92 ? 754 DG N N1 1 ATOM 73 C C2 . DG B 1 2 ? 34.242 38.041 23.128 1.00 21.67 ? 754 DG N C2 1 ATOM 74 N N2 . DG B 1 2 ? 33.409 36.994 23.213 1.00 22.84 ? 754 DG N N2 1 ATOM 75 N N3 . DG B 1 2 ? 34.704 38.596 24.249 1.00 16.70 ? 754 DG N N3 1 ATOM 76 C C4 . DG B 1 2 ? 35.553 39.608 23.992 1.00 20.24 ? 754 DG N C4 1 ATOM 77 O "O5'" . DC C 1 1 ? -12.993 -10.422 28.038 1.00 31.04 ? 755 DC O "O5'" 1 ATOM 78 C "C5'" . DC C 1 1 ? -13.447 -9.910 29.268 1.00 22.51 ? 755 DC O "C5'" 1 ATOM 79 C "C4'" . DC C 1 1 ? -12.492 -8.806 29.656 1.00 18.82 ? 755 DC O "C4'" 1 ATOM 80 O "O4'" . DC C 1 1 ? -11.211 -9.376 30.027 1.00 17.88 ? 755 DC O "O4'" 1 ATOM 81 C "C3'" . DC C 1 1 ? -12.167 -7.872 28.498 1.00 18.91 ? 755 DC O "C3'" 1 ATOM 82 O "O3'" . DC C 1 1 ? -12.971 -6.724 28.597 1.00 20.83 ? 755 DC O "O3'" 1 ATOM 83 C "C2'" . DC C 1 1 ? -10.701 -7.510 28.733 1.00 20.43 ? 755 DC O "C2'" 1 ATOM 84 C "C1'" . DC C 1 1 ? -10.235 -8.389 29.896 1.00 18.61 ? 755 DC O "C1'" 1 ATOM 85 N N1 . DC C 1 1 ? -8.958 -9.061 29.601 1.00 14.99 ? 755 DC O N1 1 ATOM 86 C C2 . DC C 1 1 ? -7.772 -8.373 29.879 1.00 13.93 ? 755 DC O C2 1 ATOM 87 O O2 . DC C 1 1 ? -7.844 -7.276 30.437 1.00 15.04 ? 755 DC O O2 1 ATOM 88 N N3 . DC C 1 1 ? -6.583 -8.913 29.509 1.00 13.00 ? 755 DC O N3 1 ATOM 89 C C4 . DC C 1 1 ? -6.557 -10.099 28.865 1.00 13.56 ? 755 DC O C4 1 ATOM 90 N N4 . DC C 1 1 ? -5.369 -10.577 28.457 1.00 15.06 ? 755 DC O N4 1 ATOM 91 C C5 . DC C 1 1 ? -7.740 -10.840 28.615 1.00 12.93 ? 755 DC O C5 1 ATOM 92 C C6 . DC C 1 1 ? -8.916 -10.301 29.007 1.00 14.09 ? 755 DC O C6 1 ATOM 93 P P . DG C 1 2 ? -13.093 -5.729 27.343 1.00 27.97 ? 756 DG O P 1 ATOM 94 O OP1 . DG C 1 2 ? -14.396 -5.068 27.402 1.00 30.15 ? 756 DG O OP1 1 ATOM 95 O OP2 . DG C 1 2 ? -12.684 -6.471 26.107 1.00 28.78 ? 756 DG O OP2 1 ATOM 96 O "O5'" . DG C 1 2 ? -11.957 -4.713 27.740 1.00 22.99 ? 756 DG O "O5'" 1 ATOM 97 C "C5'" . DG C 1 2 ? -11.005 -4.286 26.829 1.00 19.92 ? 756 DG O "C5'" 1 ATOM 98 C "C4'" . DG C 1 2 ? -10.499 -2.937 27.259 1.00 23.91 ? 756 DG O "C4'" 1 ATOM 99 O "O4'" . DG C 1 2 ? -9.430 -2.633 26.355 1.00 23.00 ? 756 DG O "O4'" 1 ATOM 100 C "C3'" . DG C 1 2 ? -11.539 -1.823 27.106 1.00 22.25 ? 756 DG O "C3'" 1 ATOM 101 O "O3'" . DG C 1 2 ? -11.336 -0.795 28.048 1.00 22.78 ? 756 DG O "O3'" 1 ATOM 102 C "C2'" . DG C 1 2 ? -11.230 -1.240 25.728 1.00 18.16 ? 756 DG O "C2'" 1 ATOM 103 C "C1'" . DG C 1 2 ? -9.722 -1.460 25.602 1.00 20.51 ? 756 DG O "C1'" 1 ATOM 104 N N9 . DG C 1 2 ? -9.244 -1.715 24.242 1.00 14.57 ? 756 DG O N9 1 ATOM 105 C C8 . DG C 1 2 ? -9.825 -2.516 23.276 1.00 16.67 ? 756 DG O C8 1 ATOM 106 N N7 . DG C 1 2 ? -9.127 -2.551 22.169 1.00 16.82 ? 756 DG O N7 1 ATOM 107 C C5 . DG C 1 2 ? -8.046 -1.701 22.408 1.00 15.20 ? 756 DG O C5 1 ATOM 108 C C6 . DG C 1 2 ? -6.957 -1.298 21.562 1.00 14.31 ? 756 DG O C6 1 ATOM 109 O O6 . DG C 1 2 ? -6.745 -1.581 20.411 1.00 13.09 ? 756 DG O O6 1 ATOM 110 N N1 . DG C 1 2 ? -6.082 -0.452 22.205 1.00 16.32 ? 756 DG O N1 1 ATOM 111 C C2 . DG C 1 2 ? -6.234 0.009 23.482 1.00 18.34 ? 756 DG O C2 1 ATOM 112 N N2 . DG C 1 2 ? -5.299 0.864 23.886 1.00 21.92 ? 756 DG O N2 1 ATOM 113 N N3 . DG C 1 2 ? -7.245 -0.340 24.291 1.00 15.99 ? 756 DG O N3 1 ATOM 114 C C4 . DG C 1 2 ? -8.102 -1.192 23.687 1.00 17.32 ? 756 DG O C4 1 ATOM 115 O "O5'" . DC D 1 1 ? 0.543 49.816 -6.684 1.00 22.62 ? 757 DC P "O5'" 1 ATOM 116 C "C5'" . DC D 1 1 ? 0.379 48.993 -7.797 1.00 23.09 ? 757 DC P "C5'" 1 ATOM 117 C "C4'" . DC D 1 1 ? 1.226 47.751 -7.656 1.00 15.78 ? 757 DC P "C4'" 1 ATOM 118 O "O4'" . DC D 1 1 ? 2.613 48.128 -7.487 1.00 16.01 ? 757 DC P "O4'" 1 ATOM 119 C "C3'" . DC D 1 1 ? 0.903 46.866 -6.449 1.00 16.50 ? 757 DC P "C3'" 1 ATOM 120 O "O3'" . DC D 1 1 ? 0.026 45.849 -6.863 1.00 17.98 ? 757 DC P "O3'" 1 ATOM 121 C "C2'" . DC D 1 1 ? 2.254 46.250 -6.118 1.00 16.94 ? 757 DC P "C2'" 1 ATOM 122 C "C1'" . DC D 1 1 ? 3.325 47.124 -6.818 1.00 14.75 ? 757 DC P "C1'" 1 ATOM 123 N N1 . DC D 1 1 ? 4.118 47.798 -5.768 1.00 16.25 ? 757 DC P N1 1 ATOM 124 C C2 . DC D 1 1 ? 5.409 47.371 -5.510 1.00 19.12 ? 757 DC P C2 1 ATOM 125 O O2 . DC D 1 1 ? 5.871 46.365 -6.135 1.00 15.46 ? 757 DC P O2 1 ATOM 126 N N3 . DC D 1 1 ? 6.152 48.018 -4.572 1.00 16.07 ? 757 DC P N3 1 ATOM 127 C C4 . DC D 1 1 ? 5.624 49.024 -3.866 1.00 19.74 ? 757 DC P C4 1 ATOM 128 N N4 . DC D 1 1 ? 6.412 49.595 -2.939 1.00 17.17 ? 757 DC P N4 1 ATOM 129 C C5 . DC D 1 1 ? 4.294 49.470 -4.083 1.00 16.54 ? 757 DC P C5 1 ATOM 130 C C6 . DC D 1 1 ? 3.580 48.848 -5.054 1.00 19.39 ? 757 DC P C6 1 ATOM 131 P P . DG D 1 2 ? -1.165 45.349 -5.903 1.00 20.79 ? 758 DG P P 1 ATOM 132 O OP1 . DG D 1 2 ? -2.129 44.644 -6.792 1.00 22.90 ? 758 DG P OP1 1 ATOM 133 O OP2 . DG D 1 2 ? -1.641 46.488 -5.027 1.00 25.19 ? 758 DG P OP2 1 ATOM 134 O "O5'" . DG D 1 2 ? -0.476 44.221 -4.992 1.00 19.51 ? 758 DG P "O5'" 1 ATOM 135 C "C5'" . DG D 1 2 ? 0.412 43.247 -5.557 1.00 20.70 ? 758 DG P "C5'" 1 ATOM 136 C "C4'" . DG D 1 2 ? -0.106 41.850 -5.279 1.00 14.39 ? 758 DG P "C4'" 1 ATOM 137 O "O4'" . DG D 1 2 ? -0.033 41.558 -3.863 1.00 17.58 ? 758 DG P "O4'" 1 ATOM 138 C "C3'" . DG D 1 2 ? -1.579 41.665 -5.684 1.00 15.59 ? 758 DG P "C3'" 1 ATOM 139 O "O3'" . DG D 1 2 ? -1.706 40.387 -6.345 1.00 16.63 ? 758 DG P "O3'" 1 ATOM 140 C "C2'" . DG D 1 2 ? -2.324 41.632 -4.349 1.00 14.16 ? 758 DG P "C2'" 1 ATOM 141 C "C1'" . DG D 1 2 ? -1.265 40.979 -3.470 1.00 16.14 ? 758 DG P "C1'" 1 ATOM 142 N N9 . DG D 1 2 ? -1.421 41.206 -2.050 1.00 11.70 ? 758 DG P N9 1 ATOM 143 C C8 . DG D 1 2 ? -2.246 42.100 -1.385 1.00 15.56 ? 758 DG P C8 1 ATOM 144 N N7 . DG D 1 2 ? -2.129 42.017 -0.071 1.00 15.76 ? 758 DG P N7 1 ATOM 145 C C5 . DG D 1 2 ? -1.162 41.027 0.129 1.00 12.65 ? 758 DG P C5 1 ATOM 146 C C6 . DG D 1 2 ? -0.644 40.481 1.335 1.00 15.58 ? 758 DG P C6 1 ATOM 147 O O6 . DG D 1 2 ? -0.919 40.796 2.481 1.00 15.58 ? 758 DG P O6 1 ATOM 148 N N1 . DG D 1 2 ? 0.289 39.456 1.094 1.00 16.65 ? 758 DG P N1 1 ATOM 149 C C2 . DG D 1 2 ? 0.651 39.008 -0.171 1.00 20.03 ? 758 DG P C2 1 ATOM 150 N N2 . DG D 1 2 ? 1.521 37.975 -0.241 1.00 22.01 ? 758 DG P N2 1 ATOM 151 N N3 . DG D 1 2 ? 0.172 39.536 -1.306 1.00 17.33 ? 758 DG P N3 1 ATOM 152 C C4 . DG D 1 2 ? -0.723 40.516 -1.077 1.00 17.00 ? 758 DG P C4 1 ATOM 153 N N . LYS E 2 1 ? 24.323 8.766 11.185 1.00 42.72 ? 1 LYS A N 1 ATOM 154 C CA . LYS E 2 1 ? 25.162 7.944 10.256 1.00 41.96 ? 1 LYS A CA 1 ATOM 155 C C . LYS E 2 1 ? 26.543 7.733 10.864 1.00 40.66 ? 1 LYS A C 1 ATOM 156 O O . LYS E 2 1 ? 27.111 8.628 11.509 1.00 37.66 ? 1 LYS A O 1 ATOM 157 C CB . LYS E 2 1 ? 25.358 8.644 8.905 1.00 46.29 ? 1 LYS A CB 1 ATOM 158 C CG . LYS E 2 1 ? 24.395 9.779 8.668 1.00 52.24 ? 1 LYS A CG 1 ATOM 159 C CD . LYS E 2 1 ? 25.032 10.909 7.863 1.00 55.56 ? 1 LYS A CD 1 ATOM 160 C CE . LYS E 2 1 ? 24.131 12.147 7.888 1.00 61.37 ? 1 LYS A CE 1 ATOM 161 N NZ . LYS E 2 1 ? 22.779 11.889 7.285 1.00 60.58 ? 1 LYS A NZ 1 ATOM 162 N N . GLU E 2 2 ? 27.069 6.538 10.637 1.00 30.20 ? 2 GLU A N 1 ATOM 163 C CA . GLU E 2 2 ? 28.395 6.162 11.099 1.00 26.25 ? 2 GLU A CA 1 ATOM 164 C C . GLU E 2 2 ? 29.373 7.187 10.529 1.00 20.50 ? 2 GLU A C 1 ATOM 165 O O . GLU E 2 2 ? 29.254 7.564 9.367 1.00 22.74 ? 2 GLU A O 1 ATOM 166 C CB . GLU E 2 2 ? 28.698 4.788 10.513 1.00 23.87 ? 2 GLU A CB 1 ATOM 167 C CG . GLU E 2 2 ? 30.106 4.291 10.728 1.00 21.47 ? 2 GLU A CG 1 ATOM 168 C CD . GLU E 2 2 ? 30.273 2.908 10.085 1.00 18.59 ? 2 GLU A CD 1 ATOM 169 O OE1 . GLU E 2 2 ? 29.899 2.758 8.903 1.00 21.52 ? 2 GLU A OE1 1 ATOM 170 O OE2 . GLU E 2 2 ? 30.764 2.008 10.782 1.00 20.85 ? 2 GLU A OE2 1 ATOM 171 N N . THR E 2 3 ? 30.333 7.636 11.345 1.00 19.98 ? 3 THR A N 1 ATOM 172 C CA . THR E 2 3 ? 31.321 8.578 10.845 1.00 21.53 ? 3 THR A CA 1 ATOM 173 C C . THR E 2 3 ? 32.406 7.893 9.995 1.00 17.95 ? 3 THR A C 1 ATOM 174 O O . THR E 2 3 ? 32.568 6.674 10.074 1.00 18.59 ? 3 THR A O 1 ATOM 175 C CB . THR E 2 3 ? 32.027 9.302 11.991 1.00 22.00 ? 3 THR A CB 1 ATOM 176 O OG1 . THR E 2 3 ? 32.848 8.395 12.739 1.00 21.24 ? 3 THR A OG1 1 ATOM 177 C CG2 . THR E 2 3 ? 30.946 9.872 12.977 1.00 25.40 ? 3 THR A CG2 1 ATOM 178 N N . ALA E 2 4 ? 33.103 8.694 9.186 1.00 20.22 ? 4 ALA A N 1 ATOM 179 C CA . ALA E 2 4 ? 34.189 8.201 8.327 1.00 18.65 ? 4 ALA A CA 1 ATOM 180 C C . ALA E 2 4 ? 35.251 7.524 9.207 1.00 18.89 ? 4 ALA A C 1 ATOM 181 O O . ALA E 2 4 ? 35.756 6.439 8.858 1.00 15.91 ? 4 ALA A O 1 ATOM 182 C CB . ALA E 2 4 ? 34.821 9.368 7.512 1.00 19.54 ? 4 ALA A CB 1 ATOM 183 N N . ALA E 2 5 ? 35.597 8.143 10.340 1.00 16.26 ? 5 ALA A N 1 ATOM 184 C CA . ALA E 2 5 ? 36.579 7.535 11.210 1.00 14.13 ? 5 ALA A CA 1 ATOM 185 C C . ALA E 2 5 ? 36.117 6.214 11.782 1.00 14.82 ? 5 ALA A C 1 ATOM 186 O O . ALA E 2 5 ? 36.898 5.302 11.898 1.00 15.09 ? 5 ALA A O 1 ATOM 187 C CB . ALA E 2 5 ? 36.947 8.476 12.376 1.00 20.07 ? 5 ALA A CB 1 ATOM 188 N N . ALA E 2 6 ? 34.846 6.128 12.181 1.00 15.93 ? 6 ALA A N 1 ATOM 189 C CA . ALA E 2 6 ? 34.287 4.893 12.755 1.00 14.63 ? 6 ALA A CA 1 ATOM 190 C C . ALA E 2 6 ? 34.239 3.816 11.691 1.00 14.14 ? 6 ALA A C 1 ATOM 191 O O . ALA E 2 6 ? 34.463 2.640 12.002 1.00 15.25 ? 6 ALA A O 1 ATOM 192 C CB . ALA E 2 6 ? 32.851 5.128 13.271 1.00 17.87 ? 6 ALA A CB 1 ATOM 193 N N . LYS E 2 7 ? 33.905 4.216 10.470 1.00 14.62 ? 7 LYS A N 1 ATOM 194 C CA . LYS E 2 7 ? 33.821 3.231 9.388 1.00 13.91 ? 7 LYS A CA 1 ATOM 195 C C . LYS E 2 7 ? 35.245 2.653 9.147 1.00 15.70 ? 7 LYS A C 1 ATOM 196 O O . LYS E 2 7 ? 35.378 1.428 8.945 1.00 12.01 ? 7 LYS A O 1 ATOM 197 C CB . LYS E 2 7 ? 33.245 3.842 8.149 1.00 12.63 ? 7 LYS A CB 1 ATOM 198 C CG . LYS E 2 7 ? 33.272 2.845 6.949 1.00 17.64 ? 7 LYS A CG 1 ATOM 199 C CD . LYS E 2 7 ? 32.660 3.461 5.676 1.00 19.10 ? 7 LYS A CD 1 ATOM 200 C CE . LYS E 2 7 ? 32.674 2.477 4.505 1.00 18.69 ? 7 LYS A CE 1 ATOM 201 N NZ . LYS E 2 7 ? 31.729 2.944 3.433 1.00 23.52 ? 7 LYS A NZ 1 ATOM 202 N N . PHE E 2 8 ? 36.283 3.497 9.238 1.00 12.87 ? 8 PHE A N 1 ATOM 203 C CA . PHE E 2 8 ? 37.645 2.948 9.080 1.00 11.92 ? 8 PHE A CA 1 ATOM 204 C C . PHE E 2 8 ? 37.943 1.948 10.175 1.00 12.43 ? 8 PHE A C 1 ATOM 205 O O . PHE E 2 8 ? 38.502 0.892 9.885 1.00 12.29 ? 8 PHE A O 1 ATOM 206 C CB . PHE E 2 8 ? 38.696 4.081 9.077 1.00 12.23 ? 8 PHE A CB 1 ATOM 207 C CG . PHE E 2 8 ? 40.099 3.577 9.044 1.00 10.37 ? 8 PHE A CG 1 ATOM 208 C CD1 . PHE E 2 8 ? 40.737 3.194 10.221 1.00 11.80 ? 8 PHE A CD1 1 ATOM 209 C CD2 . PHE E 2 8 ? 40.762 3.443 7.783 1.00 11.39 ? 8 PHE A CD2 1 ATOM 210 C CE1 . PHE E 2 8 ? 42.050 2.652 10.180 1.00 10.40 ? 8 PHE A CE1 1 ATOM 211 C CE2 . PHE E 2 8 ? 42.064 2.906 7.736 1.00 14.26 ? 8 PHE A CE2 1 ATOM 212 C CZ . PHE E 2 8 ? 42.693 2.510 8.945 1.00 12.55 ? 8 PHE A CZ 1 ATOM 213 N N . GLU E 2 9 ? 37.560 2.262 11.420 1.00 11.62 ? 9 GLU A N 1 ATOM 214 C CA . GLU E 2 9 ? 37.819 1.319 12.508 1.00 12.35 ? 9 GLU A CA 1 ATOM 215 C C . GLU E 2 9 ? 37.061 0.013 12.242 1.00 12.74 ? 9 GLU A C 1 ATOM 216 O O . GLU E 2 9 ? 37.627 -1.084 12.356 1.00 12.49 ? 9 GLU A O 1 ATOM 217 C CB . GLU E 2 9 ? 37.391 1.907 13.843 1.00 12.27 ? 9 GLU A CB 1 ATOM 218 C CG . GLU E 2 9 ? 38.308 3.027 14.304 1.00 13.28 ? 9 GLU A CG 1 ATOM 219 C CD . GLU E 2 9 ? 37.846 3.578 15.641 1.00 18.57 ? 9 GLU A CD 1 ATOM 220 O OE1 . GLU E 2 9 ? 36.997 2.908 16.288 1.00 19.16 ? 9 GLU A OE1 1 ATOM 221 O OE2 . GLU E 2 9 ? 38.316 4.657 16.041 1.00 17.16 ? 9 GLU A OE2 1 ATOM 222 N N . ARG E 2 10 ? 35.814 0.139 11.843 1.00 11.32 ? 10 ARG A N 1 ATOM 223 C CA . ARG E 2 10 ? 35.019 -1.053 11.607 1.00 12.08 ? 10 ARG A CA 1 ATOM 224 C C . ARG E 2 10 ? 35.599 -1.916 10.506 1.00 11.05 ? 10 ARG A C 1 ATOM 225 O O . ARG E 2 10 ? 35.689 -3.147 10.641 1.00 12.20 ? 10 ARG A O 1 ATOM 226 C CB . ARG E 2 10 ? 33.580 -0.688 11.245 1.00 11.53 ? 10 ARG A CB 1 ATOM 227 C CG . ARG E 2 10 ? 32.751 -1.908 10.783 1.00 14.98 ? 10 ARG A CG 1 ATOM 228 C CD . ARG E 2 10 ? 31.275 -1.570 10.694 1.00 16.56 ? 10 ARG A CD 1 ATOM 229 N NE . ARG E 2 10 ? 31.006 -0.540 9.680 1.00 15.44 ? 10 ARG A NE 1 ATOM 230 C CZ . ARG E 2 10 ? 30.912 -0.750 8.360 1.00 18.79 ? 10 ARG A CZ 1 ATOM 231 N NH1 . ARG E 2 10 ? 31.056 -1.977 7.836 1.00 17.16 ? 10 ARG A NH1 1 ATOM 232 N NH2 . ARG E 2 10 ? 30.663 0.278 7.543 1.00 15.78 ? 10 ARG A NH2 1 ATOM 233 N N . GLN E 2 11 ? 36.053 -1.288 9.434 1.00 11.31 ? 11 GLN A N 1 ATOM 234 C CA . GLN E 2 11 ? 36.570 -2.129 8.334 1.00 14.02 ? 11 GLN A CA 1 ATOM 235 C C . GLN E 2 11 ? 37.991 -2.586 8.466 1.00 11.89 ? 11 GLN A C 1 ATOM 236 O O . GLN E 2 11 ? 38.320 -3.605 7.912 1.00 11.94 ? 11 GLN A O 1 ATOM 237 C CB . GLN E 2 11 ? 36.526 -1.368 7.001 1.00 10.08 ? 11 GLN A CB 1 ATOM 238 C CG . GLN E 2 11 ? 35.130 -0.879 6.615 1.00 13.62 ? 11 GLN A CG 1 ATOM 239 C CD . GLN E 2 11 ? 35.159 -0.339 5.235 1.00 15.66 ? 11 GLN A CD 1 ATOM 240 O OE1 . GLN E 2 11 ? 35.698 0.753 4.995 1.00 18.13 ? 11 GLN A OE1 1 ATOM 241 N NE2 . GLN E 2 11 ? 34.620 -1.091 4.291 1.00 11.95 ? 11 GLN A NE2 1 ATOM 242 N N . HIS E 2 12 ? 38.801 -1.878 9.267 1.00 9.75 ? 12 HIS A N 1 ATOM 243 C CA . HIS E 2 12 ? 40.219 -2.178 9.238 1.00 7.63 ? 12 HIS A CA 1 ATOM 244 C C . HIS E 2 12 ? 40.933 -2.437 10.532 1.00 10.85 ? 12 HIS A C 1 ATOM 245 O O . HIS E 2 12 ? 42.049 -2.900 10.519 1.00 14.71 ? 12 HIS A O 1 ATOM 246 C CB . HIS E 2 12 ? 40.896 -0.957 8.544 1.00 11.56 ? 12 HIS A CB 1 ATOM 247 C CG . HIS E 2 12 ? 40.451 -0.803 7.130 1.00 10.06 ? 12 HIS A CG 1 ATOM 248 N ND1 . HIS E 2 12 ? 39.785 0.305 6.618 1.00 12.39 ? 12 HIS A ND1 1 ATOM 249 C CD2 . HIS E 2 12 ? 40.537 -1.698 6.121 1.00 6.20 ? 12 HIS A CD2 1 ATOM 250 C CE1 . HIS E 2 12 ? 39.483 0.069 5.347 1.00 7.81 ? 12 HIS A CE1 1 ATOM 251 N NE2 . HIS E 2 12 ? 39.931 -1.143 5.027 1.00 15.31 ? 12 HIS A NE2 1 ATOM 252 N N . MET E 2 13 ? 40.307 -2.105 11.654 1.00 12.34 ? 13 MET A N 1 ATOM 253 C CA . MET E 2 13 ? 41.054 -2.278 12.921 1.00 11.71 ? 13 MET A CA 1 ATOM 254 C C . MET E 2 13 ? 40.766 -3.581 13.635 1.00 14.63 ? 13 MET A C 1 ATOM 255 O O . MET E 2 13 ? 39.603 -3.885 13.853 1.00 14.33 ? 13 MET A O 1 ATOM 256 C CB . MET E 2 13 ? 40.668 -1.165 13.905 1.00 13.19 ? 13 MET A CB 1 ATOM 257 C CG . MET E 2 13 ? 41.257 0.239 13.613 1.00 13.23 ? 13 MET A CG 1 ATOM 258 S SD . MET E 2 13 ? 43.052 0.233 13.623 1.00 14.41 ? 13 MET A SD 1 ATOM 259 C CE . MET E 2 13 ? 43.396 -0.391 15.194 1.00 15.49 ? 13 MET A CE 1 ATOM 260 N N . ASP E 2 14 ? 41.810 -4.320 14.027 1.00 12.37 ? 14 ASP A N 1 ATOM 261 C CA . ASP E 2 14 ? 41.576 -5.498 14.856 1.00 11.26 ? 14 ASP A CA 1 ATOM 262 C C . ASP E 2 14 ? 42.745 -5.573 15.849 1.00 15.01 ? 14 ASP A C 1 ATOM 263 O O . ASP E 2 14 ? 43.619 -6.429 15.760 1.00 15.27 ? 14 ASP A O 1 ATOM 264 C CB . ASP E 2 14 ? 41.468 -6.813 14.036 1.00 15.40 ? 14 ASP A CB 1 ATOM 265 C CG . ASP E 2 14 ? 41.130 -7.992 14.926 1.00 20.74 ? 14 ASP A CG 1 ATOM 266 O OD1 . ASP E 2 14 ? 40.652 -7.703 16.038 1.00 18.52 ? 14 ASP A OD1 1 ATOM 267 O OD2 . ASP E 2 14 ? 41.329 -9.169 14.533 1.00 17.58 ? 14 ASP A OD2 1 ATOM 268 N N . SER E 2 15 ? 42.738 -4.636 16.795 1.00 16.15 ? 15 SER A N 1 ATOM 269 C CA . SER E 2 15 ? 43.839 -4.592 17.739 1.00 17.32 ? 15 SER A CA 1 ATOM 270 C C . SER E 2 15 ? 43.717 -5.707 18.753 1.00 19.22 ? 15 SER A C 1 ATOM 271 O O . SER E 2 15 ? 44.661 -5.916 19.510 1.00 21.45 ? 15 SER A O 1 ATOM 272 C CB . SER E 2 15 ? 43.872 -3.202 18.449 1.00 15.85 ? 15 SER A CB 1 ATOM 273 O OG . SER E 2 15 ? 42.792 -2.982 19.306 1.00 22.63 ? 15 SER A OG 1 ATOM 274 N N . SER E 2 16 ? 42.597 -6.413 18.751 1.00 18.19 ? 16 SER A N 1 ATOM 275 C CA . SER E 2 16 ? 42.389 -7.499 19.725 1.00 20.72 ? 16 SER A CA 1 ATOM 276 C C . SER E 2 16 ? 43.236 -8.741 19.453 1.00 23.77 ? 16 SER A C 1 ATOM 277 O O . SER E 2 16 ? 43.381 -9.584 20.335 1.00 26.10 ? 16 SER A O 1 ATOM 278 C CB . SER E 2 16 ? 40.912 -7.902 19.749 1.00 21.11 ? 16 SER A CB 1 ATOM 279 O OG . SER E 2 16 ? 40.075 -6.863 20.265 1.00 29.98 ? 16 SER A OG 1 ATOM 280 N N . THR E 2 17 ? 43.784 -8.872 18.247 1.00 19.88 ? 17 THR A N 1 ATOM 281 C CA . THR E 2 17 ? 44.632 -10.012 17.880 1.00 20.49 ? 17 THR A CA 1 ATOM 282 C C . THR E 2 17 ? 45.958 -9.581 17.309 1.00 23.68 ? 17 THR A C 1 ATOM 283 O O . THR E 2 17 ? 46.047 -8.500 16.710 1.00 21.73 ? 17 THR A O 1 ATOM 284 C CB . THR E 2 17 ? 43.903 -10.967 16.858 1.00 22.05 ? 17 THR A CB 1 ATOM 285 O OG1 . THR E 2 17 ? 43.767 -10.304 15.586 1.00 21.94 ? 17 THR A OG1 1 ATOM 286 C CG2 . THR E 2 17 ? 42.530 -11.340 17.366 1.00 22.96 ? 17 THR A CG2 1 ATOM 287 N N . SER E 2 18 ? 47.014 -10.390 17.474 1.00 21.50 ? 18 SER A N 1 ATOM 288 C CA . SER E 2 18 ? 48.331 -10.019 16.927 1.00 22.85 ? 18 SER A CA 1 ATOM 289 C C . SER E 2 18 ? 48.551 -10.404 15.466 1.00 19.68 ? 18 SER A C 1 ATOM 290 O O . SER E 2 18 ? 49.483 -9.925 14.809 1.00 18.62 ? 18 SER A O 1 ATOM 291 C CB . SER E 2 18 ? 49.481 -10.603 17.771 1.00 24.82 ? 18 SER A CB 1 ATOM 292 O OG . SER E 2 18 ? 49.433 -12.018 17.708 1.00 33.79 ? 18 SER A OG 1 ATOM 293 N N . ALA E 2 19 ? 47.679 -11.281 14.962 1.00 20.84 ? 19 ALA A N 1 ATOM 294 C CA . ALA E 2 19 ? 47.756 -11.740 13.573 1.00 20.93 ? 19 ALA A CA 1 ATOM 295 C C . ALA E 2 19 ? 46.542 -12.604 13.323 1.00 20.01 ? 19 ALA A C 1 ATOM 296 O O . ALA E 2 19 ? 45.807 -12.921 14.265 1.00 21.84 ? 19 ALA A O 1 ATOM 297 C CB . ALA E 2 19 ? 49.005 -12.562 13.344 1.00 16.94 ? 19 ALA A CB 1 ATOM 298 N N . ALA E 2 20 ? 46.310 -12.975 12.061 1.00 17.57 ? 20 ALA A N 1 ATOM 299 C CA . ALA E 2 20 ? 45.150 -13.847 11.754 1.00 18.83 ? 20 ALA A CA 1 ATOM 300 C C . ALA E 2 20 ? 45.438 -15.237 12.396 1.00 23.06 ? 20 ALA A C 1 ATOM 301 O O . ALA E 2 20 ? 46.492 -15.816 12.133 1.00 23.30 ? 20 ALA A O 1 ATOM 302 C CB . ALA E 2 20 ? 45.003 -13.974 10.216 1.00 17.21 ? 20 ALA A CB 1 ATOM 303 N N . SER E 2 21 ? 44.515 -15.786 13.171 1.00 23.71 ? 21 SER A N 1 ATOM 304 C CA . SER E 2 21 ? 44.840 -17.075 13.817 1.00 27.64 ? 21 SER A CA 1 ATOM 305 C C . SER E 2 21 ? 44.551 -18.304 12.998 1.00 30.01 ? 21 SER A C 1 ATOM 306 O O . SER E 2 21 ? 44.962 -19.420 13.375 1.00 31.12 ? 21 SER A O 1 ATOM 307 C CB . SER E 2 21 ? 44.118 -17.226 15.161 1.00 27.99 ? 21 SER A CB 1 ATOM 308 O OG . SER E 2 21 ? 42.708 -17.222 14.982 1.00 30.28 ? 21 SER A OG 1 ATOM 309 N N . SER E 2 22 ? 43.846 -18.121 11.884 1.00 22.89 ? 22 SER A N 1 ATOM 310 C CA . SER E 2 22 ? 43.521 -19.263 11.049 1.00 20.19 ? 22 SER A CA 1 ATOM 311 C C . SER E 2 22 ? 43.172 -18.839 9.633 1.00 20.21 ? 22 SER A C 1 ATOM 312 O O . SER E 2 22 ? 42.947 -17.654 9.372 1.00 17.09 ? 22 SER A O 1 ATOM 313 C CB . SER E 2 22 ? 42.331 -19.994 11.644 1.00 19.79 ? 22 SER A CB 1 ATOM 314 O OG . SER E 2 22 ? 41.090 -19.445 11.286 1.00 20.93 ? 22 SER A OG 1 ATOM 315 N N . SER E 2 23 ? 43.070 -19.834 8.757 1.00 19.05 ? 23 SER A N 1 ATOM 316 C CA . SER E 2 23 ? 42.717 -19.599 7.376 1.00 14.64 ? 23 SER A CA 1 ATOM 317 C C . SER E 2 23 ? 41.275 -19.135 7.193 1.00 14.22 ? 23 SER A C 1 ATOM 318 O O . SER E 2 23 ? 40.899 -18.691 6.088 1.00 16.46 ? 23 SER A O 1 ATOM 319 C CB . SER E 2 23 ? 43.026 -20.858 6.555 1.00 22.70 ? 23 SER A CB 1 ATOM 320 O OG . SER E 2 23 ? 42.237 -21.933 6.989 1.00 23.52 ? 23 SER A OG 1 ATOM 321 N N . ASN E 2 24 ? 40.444 -19.195 8.236 1.00 14.32 ? 24 ASN A N 1 ATOM 322 C CA . ASN E 2 24 ? 39.060 -18.701 8.115 1.00 14.49 ? 24 ASN A CA 1 ATOM 323 C C . ASN E 2 24 ? 38.851 -17.297 8.761 1.00 10.60 ? 24 ASN A C 1 ATOM 324 O O . ASN E 2 24 ? 37.722 -16.818 8.822 1.00 14.54 ? 24 ASN A O 1 ATOM 325 C CB . ASN E 2 24 ? 38.040 -19.685 8.731 1.00 21.32 ? 24 ASN A CB 1 ATOM 326 C CG . ASN E 2 24 ? 37.747 -20.861 7.808 1.00 30.22 ? 24 ASN A CG 1 ATOM 327 O OD1 . ASN E 2 24 ? 37.691 -20.710 6.578 1.00 28.21 ? 24 ASN A OD1 1 ATOM 328 N ND2 . ASN E 2 24 ? 37.552 -22.032 8.396 1.00 32.19 ? 24 ASN A ND2 1 ATOM 329 N N . TYR E 2 25 ? 39.932 -16.677 9.189 1.00 12.25 ? 25 TYR A N 1 ATOM 330 C CA . TYR E 2 25 ? 39.881 -15.335 9.793 1.00 12.82 ? 25 TYR A CA 1 ATOM 331 C C . TYR E 2 25 ? 39.106 -14.373 8.918 1.00 12.23 ? 25 TYR A C 1 ATOM 332 O O . TYR E 2 25 ? 38.181 -13.701 9.407 1.00 12.22 ? 25 TYR A O 1 ATOM 333 C CB . TYR E 2 25 ? 41.309 -14.820 10.016 1.00 13.78 ? 25 TYR A CB 1 ATOM 334 C CG . TYR E 2 25 ? 41.395 -13.403 10.513 1.00 14.77 ? 25 TYR A CG 1 ATOM 335 C CD1 . TYR E 2 25 ? 41.348 -13.140 11.879 1.00 12.99 ? 25 TYR A CD1 1 ATOM 336 C CD2 . TYR E 2 25 ? 41.512 -12.327 9.619 1.00 13.56 ? 25 TYR A CD2 1 ATOM 337 C CE1 . TYR E 2 25 ? 41.425 -11.829 12.370 1.00 15.19 ? 25 TYR A CE1 1 ATOM 338 C CE2 . TYR E 2 25 ? 41.579 -10.983 10.094 1.00 13.75 ? 25 TYR A CE2 1 ATOM 339 C CZ . TYR E 2 25 ? 41.538 -10.761 11.465 1.00 18.15 ? 25 TYR A CZ 1 ATOM 340 O OH . TYR E 2 25 ? 41.572 -9.487 11.985 1.00 16.75 ? 25 TYR A OH 1 ATOM 341 N N . CYS E 2 26 ? 39.476 -14.283 7.646 1.00 14.49 ? 26 CYS A N 1 ATOM 342 C CA . CYS E 2 26 ? 38.767 -13.364 6.771 1.00 12.12 ? 26 CYS A CA 1 ATOM 343 C C . CYS E 2 26 ? 37.311 -13.706 6.613 1.00 11.64 ? 26 CYS A C 1 ATOM 344 O O . CYS E 2 26 ? 36.443 -12.810 6.628 1.00 13.01 ? 26 CYS A O 1 ATOM 345 C CB . CYS E 2 26 ? 39.470 -13.293 5.404 1.00 14.51 ? 26 CYS A CB 1 ATOM 346 S SG . CYS E 2 26 ? 41.091 -12.445 5.533 1.00 15.51 ? 26 CYS A SG 1 ATOM 347 N N . ASN E 2 27 ? 36.999 -14.979 6.420 1.00 12.95 ? 27 ASN A N 1 ATOM 348 C CA . ASN E 2 27 ? 35.594 -15.327 6.282 1.00 13.78 ? 27 ASN A CA 1 ATOM 349 C C . ASN E 2 27 ? 34.819 -14.844 7.492 1.00 15.13 ? 27 ASN A C 1 ATOM 350 O O . ASN E 2 27 ? 33.679 -14.362 7.391 1.00 16.15 ? 27 ASN A O 1 ATOM 351 C CB . ASN E 2 27 ? 35.431 -16.840 6.162 1.00 14.60 ? 27 ASN A CB 1 ATOM 352 C CG . ASN E 2 27 ? 35.830 -17.329 4.818 1.00 17.49 ? 27 ASN A CG 1 ATOM 353 O OD1 . ASN E 2 27 ? 35.757 -16.574 3.849 1.00 14.34 ? 27 ASN A OD1 1 ATOM 354 N ND2 . ASN E 2 27 ? 36.222 -18.606 4.718 1.00 19.16 ? 27 ASN A ND2 1 ATOM 355 N N . GLN E 2 28 ? 35.411 -15.037 8.657 1.00 15.54 ? 28 GLN A N 1 ATOM 356 C CA . GLN E 2 28 ? 34.716 -14.607 9.874 1.00 14.03 ? 28 GLN A CA 1 ATOM 357 C C . GLN E 2 28 ? 34.643 -13.102 10.072 1.00 12.96 ? 28 GLN A C 1 ATOM 358 O O . GLN E 2 28 ? 33.584 -12.561 10.407 1.00 13.33 ? 28 GLN A O 1 ATOM 359 C CB . GLN E 2 28 ? 35.407 -15.181 11.101 1.00 18.00 ? 28 GLN A CB 1 ATOM 360 C CG . GLN E 2 28 ? 35.312 -16.709 11.133 1.00 17.48 ? 28 GLN A CG 1 ATOM 361 C CD . GLN E 2 28 ? 36.414 -17.367 11.941 1.00 22.23 ? 28 GLN A CD 1 ATOM 362 O OE1 . GLN E 2 28 ? 37.175 -16.708 12.677 1.00 25.26 ? 28 GLN A OE1 1 ATOM 363 N NE2 . GLN E 2 28 ? 36.519 -18.706 11.805 1.00 24.30 ? 28 GLN A NE2 1 ATOM 364 N N . MET E 2 29 ? 35.762 -12.441 9.817 1.00 12.94 ? 29 MET A N 1 ATOM 365 C CA . MET E 2 29 ? 35.828 -10.999 10.025 1.00 10.08 ? 29 MET A CA 1 ATOM 366 C C . MET E 2 29 ? 35.101 -10.178 8.973 1.00 14.03 ? 29 MET A C 1 ATOM 367 O O . MET E 2 29 ? 34.509 -9.156 9.300 1.00 12.12 ? 29 MET A O 1 ATOM 368 C CB . MET E 2 29 ? 37.307 -10.592 10.106 1.00 13.78 ? 29 MET A CB 1 ATOM 369 C CG . MET E 2 29 ? 38.000 -11.180 11.346 1.00 14.26 ? 29 MET A CG 1 ATOM 370 S SD . MET E 2 29 ? 37.520 -10.228 12.876 1.00 16.31 ? 29 MET A SD 1 ATOM 371 C CE . MET E 2 29 ? 38.321 -8.608 12.580 1.00 17.86 ? 29 MET A CE 1 ATOM 372 N N . MET E 2 30 ? 35.132 -10.621 7.719 1.00 10.59 ? 30 MET A N 1 ATOM 373 C CA . MET E 2 30 ? 34.391 -9.861 6.718 1.00 13.09 ? 30 MET A CA 1 ATOM 374 C C . MET E 2 30 ? 32.908 -9.901 7.092 1.00 11.70 ? 30 MET A C 1 ATOM 375 O O . MET E 2 30 ? 32.205 -8.913 6.908 1.00 12.96 ? 30 MET A O 1 ATOM 376 C CB . MET E 2 30 ? 34.647 -10.433 5.291 1.00 10.60 ? 30 MET A CB 1 ATOM 377 C CG . MET E 2 30 ? 36.145 -10.253 4.923 1.00 11.89 ? 30 MET A CG 1 ATOM 378 S SD . MET E 2 30 ? 36.696 -8.529 4.770 1.00 11.78 ? 30 MET A SD 1 ATOM 379 C CE . MET E 2 30 ? 35.704 -8.033 3.219 1.00 12.58 ? 30 MET A CE 1 ATOM 380 N N . LYS E 2 31 ? 32.441 -11.045 7.610 1.00 12.29 ? 31 LYS A N 1 ATOM 381 C CA . LYS E 2 31 ? 31.058 -11.165 8.015 1.00 10.29 ? 31 LYS A CA 1 ATOM 382 C C . LYS E 2 31 ? 30.781 -10.303 9.302 1.00 12.46 ? 31 LYS A C 1 ATOM 383 O O . LYS E 2 31 ? 29.836 -9.523 9.320 1.00 15.84 ? 31 LYS A O 1 ATOM 384 C CB . LYS E 2 31 ? 30.758 -12.644 8.312 1.00 12.59 ? 31 LYS A CB 1 ATOM 385 C CG . LYS E 2 31 ? 29.339 -12.870 8.908 1.00 16.89 ? 31 LYS A CG 1 ATOM 386 C CD . LYS E 2 31 ? 28.247 -12.625 7.938 1.00 32.15 ? 31 LYS A CD 1 ATOM 387 C CE . LYS E 2 31 ? 26.972 -13.360 8.448 1.00 35.75 ? 31 LYS A CE 1 ATOM 388 N NZ . LYS E 2 31 ? 25.753 -12.714 7.930 1.00 40.96 ? 31 LYS A NZ 1 ATOM 389 N N . SER E 2 32 ? 31.587 -10.497 10.337 1.00 12.37 ? 32 SER A N 1 ATOM 390 C CA . SER E 2 32 ? 31.285 -9.823 11.598 1.00 14.17 ? 32 SER A CA 1 ATOM 391 C C . SER E 2 32 ? 31.453 -8.323 11.543 1.00 16.18 ? 32 SER A C 1 ATOM 392 O O . SER E 2 32 ? 30.857 -7.629 12.384 1.00 17.64 ? 32 SER A O 1 ATOM 393 C CB . SER E 2 32 ? 32.073 -10.469 12.760 1.00 16.85 ? 32 SER A CB 1 ATOM 394 O OG . SER E 2 32 ? 33.444 -10.213 12.647 1.00 19.65 ? 32 SER A OG 1 ATOM 395 N N . ARG E 2 33 ? 32.262 -7.802 10.617 1.00 10.77 ? 33 ARG A N 1 ATOM 396 C CA . ARG E 2 33 ? 32.362 -6.347 10.497 1.00 12.67 ? 33 ARG A CA 1 ATOM 397 C C . ARG E 2 33 ? 31.399 -5.783 9.452 1.00 14.43 ? 33 ARG A C 1 ATOM 398 O O . ARG E 2 33 ? 31.512 -4.632 9.023 1.00 14.69 ? 33 ARG A O 1 ATOM 399 C CB . ARG E 2 33 ? 33.816 -5.930 10.187 1.00 12.54 ? 33 ARG A CB 1 ATOM 400 C CG . ARG E 2 33 ? 34.799 -6.356 11.268 1.00 11.79 ? 33 ARG A CG 1 ATOM 401 C CD . ARG E 2 33 ? 34.440 -5.691 12.676 1.00 10.39 ? 33 ARG A CD 1 ATOM 402 N NE . ARG E 2 33 ? 35.496 -6.031 13.609 1.00 12.45 ? 33 ARG A NE 1 ATOM 403 C CZ . ARG E 2 33 ? 36.647 -5.369 13.750 1.00 13.42 ? 33 ARG A CZ 1 ATOM 404 N NH1 . ARG E 2 33 ? 36.893 -4.300 13.000 1.00 11.48 ? 33 ARG A NH1 1 ATOM 405 N NH2 . ARG E 2 33 ? 37.567 -5.799 14.646 1.00 15.79 ? 33 ARG A NH2 1 ATOM 406 N N . ASN E 2 34 ? 30.421 -6.609 9.027 1.00 14.63 ? 34 ASN A N 1 ATOM 407 C CA . ASN E 2 34 ? 29.387 -6.190 8.066 1.00 17.17 ? 34 ASN A CA 1 ATOM 408 C C . ASN E 2 34 ? 29.861 -5.827 6.654 1.00 14.48 ? 34 ASN A C 1 ATOM 409 O O . ASN E 2 34 ? 29.246 -5.038 5.913 1.00 17.59 ? 34 ASN A O 1 ATOM 410 C CB . ASN E 2 34 ? 28.545 -5.030 8.636 1.00 21.55 ? 34 ASN A CB 1 ATOM 411 C CG . ASN E 2 34 ? 27.480 -5.524 9.595 1.00 33.23 ? 34 ASN A CG 1 ATOM 412 O OD1 . ASN E 2 34 ? 27.078 -6.681 9.525 1.00 33.40 ? 34 ASN A OD1 1 ATOM 413 N ND2 . ASN E 2 34 ? 27.027 -4.660 10.510 1.00 33.08 ? 34 ASN A ND2 1 ATOM 414 N N . LEU E 2 35 ? 30.978 -6.423 6.259 1.00 13.00 ? 35 LEU A N 1 ATOM 415 C CA . LEU E 2 35 ? 31.532 -6.155 4.947 1.00 13.85 ? 35 LEU A CA 1 ATOM 416 C C . LEU E 2 35 ? 30.963 -7.158 3.925 1.00 17.08 ? 35 LEU A C 1 ATOM 417 O O . LEU E 2 35 ? 31.449 -7.244 2.778 1.00 16.90 ? 35 LEU A O 1 ATOM 418 C CB . LEU E 2 35 ? 33.070 -6.270 5.000 1.00 14.09 ? 35 LEU A CB 1 ATOM 419 C CG . LEU E 2 35 ? 33.635 -5.374 6.113 1.00 13.83 ? 35 LEU A CG 1 ATOM 420 C CD1 . LEU E 2 35 ? 35.192 -5.404 6.166 1.00 16.86 ? 35 LEU A CD1 1 ATOM 421 C CD2 . LEU E 2 35 ? 33.150 -3.982 5.908 1.00 17.02 ? 35 LEU A CD2 1 ATOM 422 N N . THR E 2 36 ? 29.966 -7.947 4.344 1.00 13.55 ? 36 THR A N 1 ATOM 423 C CA . THR E 2 36 ? 29.338 -8.897 3.394 1.00 15.58 ? 36 THR A CA 1 ATOM 424 C C . THR E 2 36 ? 27.826 -8.759 3.512 1.00 16.36 ? 36 THR A C 1 ATOM 425 O O . THR E 2 36 ? 27.035 -9.604 3.028 1.00 18.15 ? 36 THR A O 1 ATOM 426 C CB . THR E 2 36 ? 29.698 -10.347 3.672 1.00 16.72 ? 36 THR A CB 1 ATOM 427 O OG1 . THR E 2 36 ? 29.217 -10.731 4.982 1.00 18.32 ? 36 THR A OG1 1 ATOM 428 C CG2 . THR E 2 36 ? 31.266 -10.543 3.560 1.00 15.80 ? 36 THR A CG2 1 ATOM 429 N N . LYS E 2 37 ? 27.417 -7.663 4.134 1.00 18.36 ? 37 LYS A N 1 ATOM 430 C CA . LYS E 2 37 ? 25.983 -7.463 4.396 1.00 20.98 ? 37 LYS A CA 1 ATOM 431 C C . LYS E 2 37 ? 25.084 -7.435 3.184 1.00 18.49 ? 37 LYS A C 1 ATOM 432 O O . LYS E 2 37 ? 24.066 -8.190 3.154 1.00 22.34 ? 37 LYS A O 1 ATOM 433 C CB . LYS E 2 37 ? 25.780 -6.197 5.261 1.00 21.12 ? 37 LYS A CB 1 ATOM 434 C CG . LYS E 2 37 ? 24.286 -6.010 5.669 1.00 35.31 ? 37 LYS A CG 1 ATOM 435 C CD . LYS E 2 37 ? 24.008 -4.611 6.196 1.00 39.09 ? 37 LYS A CD 1 ATOM 436 C CE . LYS E 2 37 ? 24.720 -4.340 7.527 1.00 48.90 ? 37 LYS A CE 1 ATOM 437 N NZ . LYS E 2 37 ? 26.139 -3.831 7.427 1.00 54.95 ? 37 LYS A NZ 1 ATOM 438 N N . ASP E 2 38 ? 25.438 -6.627 2.194 1.00 22.15 ? 38 ASP A N 1 ATOM 439 C CA . ASP E 2 38 ? 24.661 -6.495 0.954 1.00 21.95 ? 38 ASP A CA 1 ATOM 440 C C . ASP E 2 38 ? 25.427 -6.890 -0.297 1.00 23.34 ? 38 ASP A C 1 ATOM 441 O O . ASP E 2 38 ? 24.871 -7.096 -1.402 1.00 23.48 ? 38 ASP A O 1 ATOM 442 C CB . ASP E 2 38 ? 24.141 -5.061 0.861 1.00 24.38 ? 38 ASP A CB 1 ATOM 443 C CG . ASP E 2 38 ? 23.183 -4.751 1.971 1.00 31.68 ? 38 ASP A CG 1 ATOM 444 O OD1 . ASP E 2 38 ? 22.209 -5.516 2.140 1.00 34.56 ? 38 ASP A OD1 1 ATOM 445 O OD2 . ASP E 2 38 ? 23.392 -3.756 2.676 1.00 36.23 ? 38 ASP A OD2 1 ATOM 446 N N . ARG E 2 39 ? 26.738 -7.003 -0.165 1.00 15.74 ? 39 ARG A N 1 ATOM 447 C CA . ARG E 2 39 ? 27.515 -7.450 -1.292 1.00 16.92 ? 39 ARG A CA 1 ATOM 448 C C . ARG E 2 39 ? 28.801 -7.909 -0.661 1.00 14.24 ? 39 ARG A C 1 ATOM 449 O O . ARG E 2 39 ? 29.033 -7.626 0.535 1.00 17.33 ? 39 ARG A O 1 ATOM 450 C CB . ARG E 2 39 ? 27.810 -6.327 -2.290 1.00 21.49 ? 39 ARG A CB 1 ATOM 451 C CG . ARG E 2 39 ? 28.504 -5.125 -1.686 1.00 29.62 ? 39 ARG A CG 1 ATOM 452 C CD . ARG E 2 39 ? 28.828 -4.098 -2.799 1.00 38.51 ? 39 ARG A CD 1 ATOM 453 N NE . ARG E 2 39 ? 29.414 -2.866 -2.271 1.00 46.42 ? 39 ARG A NE 1 ATOM 454 C CZ . ARG E 2 39 ? 30.691 -2.712 -1.904 1.00 53.03 ? 39 ARG A CZ 1 ATOM 455 N NH1 . ARG E 2 39 ? 31.562 -3.712 -2.001 1.00 51.99 ? 39 ARG A NH1 1 ATOM 456 N NH2 . ARG E 2 39 ? 31.104 -1.539 -1.431 1.00 55.42 ? 39 ARG A NH2 1 ATOM 457 N N . CYS E 2 40 ? 29.582 -8.647 -1.431 1.00 15.03 ? 40 CYS A N 1 ATOM 458 C CA . CYS E 2 40 ? 30.865 -9.118 -0.905 1.00 13.44 ? 40 CYS A CA 1 ATOM 459 C C . CYS E 2 40 ? 31.936 -8.075 -1.203 1.00 13.54 ? 40 CYS A C 1 ATOM 460 O O . CYS E 2 40 ? 32.328 -7.888 -2.351 1.00 18.23 ? 40 CYS A O 1 ATOM 461 C CB . CYS E 2 40 ? 31.312 -10.427 -1.560 1.00 16.44 ? 40 CYS A CB 1 ATOM 462 S SG . CYS E 2 40 ? 30.116 -11.806 -1.540 1.00 18.53 ? 40 CYS A SG 1 ATOM 463 N N . LYS E 2 41 ? 32.425 -7.351 -0.180 1.00 11.98 ? 41 LYS A N 1 ATOM 464 C CA . LYS E 2 41 ? 33.522 -6.416 -0.458 1.00 10.42 ? 41 LYS A CA 1 ATOM 465 C C . LYS E 2 41 ? 34.657 -7.281 -1.021 1.00 10.21 ? 41 LYS A C 1 ATOM 466 O O . LYS E 2 41 ? 35.054 -8.252 -0.390 1.00 14.16 ? 41 LYS A O 1 ATOM 467 C CB . LYS E 2 41 ? 33.946 -5.680 0.814 1.00 13.19 ? 41 LYS A CB 1 ATOM 468 C CG . LYS E 2 41 ? 34.986 -4.602 0.509 1.00 14.50 ? 41 LYS A CG 1 ATOM 469 C CD . LYS E 2 41 ? 35.402 -3.857 1.787 1.00 13.83 ? 41 LYS A CD 1 ATOM 470 C CE . LYS E 2 41 ? 36.470 -2.862 1.419 1.00 12.45 ? 41 LYS A CE 1 ATOM 471 N NZ . LYS E 2 41 ? 36.736 -2.048 2.647 1.00 14.60 ? 41 LYS A NZ 1 ATOM 472 N N . PRO E 2 42 ? 35.252 -6.905 -2.169 1.00 12.78 ? 42 PRO A N 1 ATOM 473 C CA . PRO E 2 42 ? 36.298 -7.768 -2.748 1.00 10.77 ? 42 PRO A CA 1 ATOM 474 C C . PRO E 2 42 ? 37.660 -7.924 -2.109 1.00 13.99 ? 42 PRO A C 1 ATOM 475 O O . PRO E 2 42 ? 38.204 -9.052 -2.078 1.00 14.31 ? 42 PRO A O 1 ATOM 476 C CB . PRO E 2 42 ? 36.406 -7.271 -4.220 1.00 14.57 ? 42 PRO A CB 1 ATOM 477 C CG . PRO E 2 42 ? 36.037 -5.849 -4.093 1.00 16.02 ? 42 PRO A CG 1 ATOM 478 C CD . PRO E 2 42 ? 34.880 -5.802 -3.084 1.00 15.69 ? 42 PRO A CD 1 ATOM 479 N N . VAL E 2 43 ? 38.197 -6.814 -1.586 1.00 11.37 ? 43 VAL A N 1 ATOM 480 C CA . VAL E 2 43 ? 39.514 -6.800 -0.974 1.00 10.46 ? 43 VAL A CA 1 ATOM 481 C C . VAL E 2 43 ? 39.445 -5.913 0.238 1.00 14.81 ? 43 VAL A C 1 ATOM 482 O O . VAL E 2 43 ? 38.918 -4.805 0.182 1.00 15.11 ? 43 VAL A O 1 ATOM 483 C CB . VAL E 2 43 ? 40.572 -6.212 -1.938 1.00 12.68 ? 43 VAL A CB 1 ATOM 484 C CG1 . VAL E 2 43 ? 41.931 -6.152 -1.267 1.00 14.54 ? 43 VAL A CG1 1 ATOM 485 C CG2 . VAL E 2 43 ? 40.713 -7.182 -3.179 1.00 13.53 ? 43 VAL A CG2 1 ATOM 486 N N . ASN E 2 44 ? 40.007 -6.408 1.349 1.00 10.68 ? 44 ASN A N 1 ATOM 487 C CA . ASN E 2 44 ? 39.967 -5.614 2.555 1.00 9.39 ? 44 ASN A CA 1 ATOM 488 C C . ASN E 2 44 ? 41.144 -5.956 3.430 1.00 11.44 ? 44 ASN A C 1 ATOM 489 O O . ASN E 2 44 ? 41.457 -7.124 3.589 1.00 15.24 ? 44 ASN A O 1 ATOM 490 C CB . ASN E 2 44 ? 38.677 -5.877 3.326 1.00 10.93 ? 44 ASN A CB 1 ATOM 491 C CG . ASN E 2 44 ? 38.533 -4.926 4.515 1.00 11.06 ? 44 ASN A CG 1 ATOM 492 O OD1 . ASN E 2 44 ? 38.288 -3.721 4.332 1.00 11.08 ? 44 ASN A OD1 1 ATOM 493 N ND2 . ASN E 2 44 ? 38.700 -5.453 5.737 1.00 11.46 ? 44 ASN A ND2 1 ATOM 494 N N . THR E 2 45 ? 41.775 -4.953 4.006 1.00 10.65 ? 45 THR A N 1 ATOM 495 C CA . THR E 2 45 ? 42.879 -5.233 4.930 1.00 10.76 ? 45 THR A CA 1 ATOM 496 C C . THR E 2 45 ? 42.561 -4.933 6.393 1.00 11.69 ? 45 THR A C 1 ATOM 497 O O . THR E 2 45 ? 41.953 -3.900 6.710 1.00 10.15 ? 45 THR A O 1 ATOM 498 C CB . THR E 2 45 ? 44.155 -4.384 4.542 1.00 13.39 ? 45 THR A CB 1 ATOM 499 O OG1 . THR E 2 45 ? 44.546 -4.709 3.184 1.00 13.55 ? 45 THR A OG1 1 ATOM 500 C CG2 . THR E 2 45 ? 45.340 -4.671 5.558 1.00 12.70 ? 45 THR A CG2 1 ATOM 501 N N . PHE E 2 46 ? 42.944 -5.866 7.286 1.00 10.12 ? 46 PHE A N 1 ATOM 502 C CA . PHE E 2 46 ? 42.816 -5.628 8.723 1.00 9.13 ? 46 PHE A CA 1 ATOM 503 C C . PHE E 2 46 ? 44.189 -5.383 9.319 1.00 10.29 ? 46 PHE A C 1 ATOM 504 O O . PHE E 2 46 ? 45.186 -5.955 8.910 1.00 13.58 ? 46 PHE A O 1 ATOM 505 C CB . PHE E 2 46 ? 42.174 -6.809 9.479 1.00 9.71 ? 46 PHE A CB 1 ATOM 506 C CG . PHE E 2 46 ? 40.685 -6.983 9.197 1.00 9.63 ? 46 PHE A CG 1 ATOM 507 C CD1 . PHE E 2 46 ? 39.752 -6.186 9.853 1.00 13.47 ? 46 PHE A CD1 1 ATOM 508 C CD2 . PHE E 2 46 ? 40.254 -7.897 8.236 1.00 10.65 ? 46 PHE A CD2 1 ATOM 509 C CE1 . PHE E 2 46 ? 38.369 -6.272 9.563 1.00 13.51 ? 46 PHE A CE1 1 ATOM 510 C CE2 . PHE E 2 46 ? 38.851 -7.990 7.928 1.00 10.41 ? 46 PHE A CE2 1 ATOM 511 C CZ . PHE E 2 46 ? 37.948 -7.185 8.591 1.00 13.06 ? 46 PHE A CZ 1 ATOM 512 N N . VAL E 2 47 ? 44.212 -4.474 10.307 1.00 12.16 ? 47 VAL A N 1 ATOM 513 C CA . VAL E 2 47 ? 45.489 -4.078 10.955 1.00 11.92 ? 47 VAL A CA 1 ATOM 514 C C . VAL E 2 47 ? 45.496 -4.517 12.404 1.00 12.34 ? 47 VAL A C 1 ATOM 515 O O . VAL E 2 47 ? 44.619 -4.153 13.204 1.00 12.95 ? 47 VAL A O 1 ATOM 516 C CB . VAL E 2 47 ? 45.668 -2.548 10.890 1.00 10.00 ? 47 VAL A CB 1 ATOM 517 C CG1 . VAL E 2 47 ? 47.058 -2.189 11.472 1.00 13.49 ? 47 VAL A CG1 1 ATOM 518 C CG2 . VAL E 2 47 ? 45.579 -2.057 9.404 1.00 10.26 ? 47 VAL A CG2 1 ATOM 519 N N . HIS E 2 48 ? 46.525 -5.286 12.747 1.00 13.41 ? 48 HIS A N 1 ATOM 520 C CA . HIS E 2 48 ? 46.664 -5.838 14.110 1.00 11.96 ? 48 HIS A CA 1 ATOM 521 C C . HIS E 2 48 ? 47.662 -4.996 14.921 1.00 17.99 ? 48 HIS A C 1 ATOM 522 O O . HIS E 2 48 ? 48.738 -5.492 15.311 1.00 18.43 ? 48 HIS A O 1 ATOM 523 C CB . HIS E 2 48 ? 47.212 -7.273 14.047 1.00 15.40 ? 48 HIS A CB 1 ATOM 524 C CG . HIS E 2 48 ? 46.406 -8.192 13.185 1.00 14.94 ? 48 HIS A CG 1 ATOM 525 N ND1 . HIS E 2 48 ? 45.254 -8.810 13.632 1.00 21.49 ? 48 HIS A ND1 1 ATOM 526 C CD2 . HIS E 2 48 ? 46.545 -8.544 11.885 1.00 14.51 ? 48 HIS A CD2 1 ATOM 527 C CE1 . HIS E 2 48 ? 44.713 -9.496 12.640 1.00 21.01 ? 48 HIS A CE1 1 ATOM 528 N NE2 . HIS E 2 48 ? 45.472 -9.352 11.570 1.00 17.84 ? 48 HIS A NE2 1 ATOM 529 N N . GLU E 2 49 ? 47.280 -3.752 15.167 1.00 17.27 ? 49 GLU A N 1 ATOM 530 C CA . GLU E 2 49 ? 48.090 -2.868 15.958 1.00 15.97 ? 49 GLU A CA 1 ATOM 531 C C . GLU E 2 49 ? 47.144 -2.031 16.790 1.00 15.12 ? 49 GLU A C 1 ATOM 532 O O . GLU E 2 49 ? 45.955 -1.955 16.509 1.00 16.50 ? 49 GLU A O 1 ATOM 533 C CB . GLU E 2 49 ? 48.954 -1.951 15.070 1.00 17.23 ? 49 GLU A CB 1 ATOM 534 C CG . GLU E 2 49 ? 49.921 -2.693 14.125 1.00 16.43 ? 49 GLU A CG 1 ATOM 535 C CD . GLU E 2 49 ? 51.103 -3.418 14.775 1.00 21.56 ? 49 GLU A CD 1 ATOM 536 O OE1 . GLU E 2 49 ? 51.403 -3.180 15.967 1.00 19.62 ? 49 GLU A OE1 1 ATOM 537 O OE2 . GLU E 2 49 ? 51.759 -4.219 14.079 1.00 19.58 ? 49 GLU A OE2 1 ATOM 538 N N . SER E 2 50 ? 47.667 -1.336 17.812 1.00 14.48 ? 50 SER A N 1 ATOM 539 C CA . SER E 2 50 ? 46.783 -0.522 18.630 1.00 15.38 ? 50 SER A CA 1 ATOM 540 C C . SER E 2 50 ? 46.181 0.620 17.825 1.00 15.17 ? 50 SER A C 1 ATOM 541 O O . SER E 2 50 ? 46.738 1.019 16.791 1.00 15.43 ? 50 SER A O 1 ATOM 542 C CB . SER E 2 50 ? 47.542 0.086 19.828 1.00 18.11 ? 50 SER A CB 1 ATOM 543 O OG . SER E 2 50 ? 48.504 1.054 19.379 1.00 17.67 ? 50 SER A OG 1 ATOM 544 N N . LEU E 2 51 ? 45.036 1.119 18.297 1.00 15.66 ? 51 LEU A N 1 ATOM 545 C CA . LEU E 2 51 ? 44.387 2.222 17.639 1.00 13.15 ? 51 LEU A CA 1 ATOM 546 C C . LEU E 2 51 ? 45.324 3.439 17.706 1.00 15.12 ? 51 LEU A C 1 ATOM 547 O O . LEU E 2 51 ? 45.400 4.231 16.744 1.00 16.38 ? 51 LEU A O 1 ATOM 548 C CB . LEU E 2 51 ? 43.024 2.504 18.308 1.00 16.48 ? 51 LEU A CB 1 ATOM 549 C CG . LEU E 2 51 ? 42.250 3.677 17.685 1.00 15.70 ? 51 LEU A CG 1 ATOM 550 C CD1 . LEU E 2 51 ? 41.887 3.427 16.176 1.00 15.25 ? 51 LEU A CD1 1 ATOM 551 C CD2 . LEU E 2 51 ? 40.994 3.923 18.507 1.00 19.94 ? 51 LEU A CD2 1 ATOM 552 N N . ALA E 2 52 ? 46.063 3.590 18.815 1.00 15.51 ? 52 ALA A N 1 ATOM 553 C CA . ALA E 2 52 ? 46.999 4.702 18.883 1.00 16.73 ? 52 ALA A CA 1 ATOM 554 C C . ALA E 2 52 ? 48.064 4.608 17.797 1.00 14.42 ? 52 ALA A C 1 ATOM 555 O O . ALA E 2 52 ? 48.386 5.637 17.162 1.00 15.97 ? 52 ALA A O 1 ATOM 556 C CB . ALA E 2 52 ? 47.677 4.768 20.258 1.00 23.21 ? 52 ALA A CB 1 ATOM 557 N N . ASP E 2 53 ? 48.654 3.411 17.583 1.00 14.91 ? 53 ASP A N 1 ATOM 558 C CA . ASP E 2 53 ? 49.664 3.275 16.547 1.00 15.55 ? 53 ASP A CA 1 ATOM 559 C C . ASP E 2 53 ? 49.124 3.494 15.150 1.00 14.99 ? 53 ASP A C 1 ATOM 560 O O . ASP E 2 53 ? 49.799 4.046 14.289 1.00 14.10 ? 53 ASP A O 1 ATOM 561 C CB . ASP E 2 53 ? 50.361 1.925 16.663 1.00 15.44 ? 53 ASP A CB 1 ATOM 562 C CG . ASP E 2 53 ? 51.312 1.852 17.855 1.00 23.35 ? 53 ASP A CG 1 ATOM 563 O OD1 . ASP E 2 53 ? 51.587 2.903 18.476 1.00 26.64 ? 53 ASP A OD1 1 ATOM 564 O OD2 . ASP E 2 53 ? 51.772 0.733 18.149 1.00 29.76 ? 53 ASP A OD2 1 ATOM 565 N N . VAL E 2 54 ? 47.880 3.079 14.898 1.00 12.77 ? 54 VAL A N 1 ATOM 566 C CA . VAL E 2 54 ? 47.346 3.309 13.554 1.00 12.51 ? 54 VAL A CA 1 ATOM 567 C C . VAL E 2 54 ? 46.999 4.776 13.345 1.00 10.66 ? 54 VAL A C 1 ATOM 568 O O . VAL E 2 54 ? 47.309 5.346 12.313 1.00 13.20 ? 54 VAL A O 1 ATOM 569 C CB . VAL E 2 54 ? 46.128 2.386 13.312 1.00 11.34 ? 54 VAL A CB 1 ATOM 570 C CG1 . VAL E 2 54 ? 45.455 2.656 11.912 1.00 12.23 ? 54 VAL A CG1 1 ATOM 571 C CG2 . VAL E 2 54 ? 46.644 0.953 13.407 1.00 14.04 ? 54 VAL A CG2 1 ATOM 572 N N . GLN E 2 55 ? 46.366 5.416 14.321 1.00 13.17 ? 55 GLN A N 1 ATOM 573 C CA . GLN E 2 55 ? 46.078 6.832 14.168 1.00 11.95 ? 55 GLN A CA 1 ATOM 574 C C . GLN E 2 55 ? 47.408 7.638 14.008 1.00 14.07 ? 55 GLN A C 1 ATOM 575 O O . GLN E 2 55 ? 47.448 8.668 13.294 1.00 14.85 ? 55 GLN A O 1 ATOM 576 C CB . GLN E 2 55 ? 45.326 7.387 15.403 1.00 13.28 ? 55 GLN A CB 1 ATOM 577 C CG . GLN E 2 55 ? 43.882 6.862 15.507 1.00 13.23 ? 55 GLN A CG 1 ATOM 578 C CD . GLN E 2 55 ? 43.140 7.472 16.664 1.00 17.06 ? 55 GLN A CD 1 ATOM 579 O OE1 . GLN E 2 55 ? 43.768 8.062 17.577 1.00 23.27 ? 55 GLN A OE1 1 ATOM 580 N NE2 . GLN E 2 55 ? 41.812 7.311 16.706 1.00 17.03 ? 55 GLN A NE2 1 ATOM 581 N N . ALA E 2 56 ? 48.455 7.187 14.668 1.00 14.37 ? 56 ALA A N 1 ATOM 582 C CA . ALA E 2 56 ? 49.736 7.916 14.554 1.00 19.59 ? 56 ALA A CA 1 ATOM 583 C C . ALA E 2 56 ? 50.265 7.964 13.123 1.00 19.13 ? 56 ALA A C 1 ATOM 584 O O . ALA E 2 56 ? 51.061 8.838 12.779 1.00 16.38 ? 56 ALA A O 1 ATOM 585 C CB . ALA E 2 56 ? 50.849 7.289 15.535 1.00 15.13 ? 56 ALA A CB 1 ATOM 586 N N . VAL E 2 57 ? 49.850 7.026 12.270 1.00 15.17 ? 57 VAL A N 1 ATOM 587 C CA . VAL E 2 57 ? 50.356 7.044 10.891 1.00 12.81 ? 57 VAL A CA 1 ATOM 588 C C . VAL E 2 57 ? 50.028 8.362 10.175 1.00 15.55 ? 57 VAL A C 1 ATOM 589 O O . VAL E 2 57 ? 50.755 8.780 9.272 1.00 13.73 ? 57 VAL A O 1 ATOM 590 C CB . VAL E 2 57 ? 49.774 5.817 10.134 1.00 12.60 ? 57 VAL A CB 1 ATOM 591 C CG1 . VAL E 2 57 ? 50.172 5.797 8.640 1.00 12.23 ? 57 VAL A CG1 1 ATOM 592 C CG2 . VAL E 2 57 ? 50.294 4.543 10.884 1.00 14.28 ? 57 VAL A CG2 1 ATOM 593 N N . CYS E 2 58 ? 48.961 9.044 10.624 1.00 16.57 ? 58 CYS A N 1 ATOM 594 C CA . CYS E 2 58 ? 48.583 10.302 9.981 1.00 14.32 ? 58 CYS A CA 1 ATOM 595 C C . CYS E 2 58 ? 49.636 11.389 10.193 1.00 17.12 ? 58 CYS A C 1 ATOM 596 O O . CYS E 2 58 ? 49.576 12.420 9.539 1.00 20.54 ? 58 CYS A O 1 ATOM 597 C CB . CYS E 2 58 ? 47.229 10.802 10.488 1.00 16.43 ? 58 CYS A CB 1 ATOM 598 S SG . CYS E 2 58 ? 45.837 9.667 10.065 1.00 18.88 ? 58 CYS A SG 1 ATOM 599 N N . SER E 2 59 ? 50.575 11.178 11.113 1.00 17.35 ? 59 SER A N 1 ATOM 600 C CA . SER E 2 59 ? 51.651 12.163 11.315 1.00 19.55 ? 59 SER A CA 1 ATOM 601 C C . SER E 2 59 ? 52.996 11.579 10.872 1.00 19.78 ? 59 SER A C 1 ATOM 602 O O . SER E 2 59 ? 54.059 12.045 11.341 1.00 20.83 ? 59 SER A O 1 ATOM 603 C CB A SER E 2 59 ? 51.708 12.650 12.768 0.37 19.05 ? 59 SER A CB 1 ATOM 604 C CB B SER E 2 59 ? 51.722 12.269 12.928 0.63 19.79 ? 59 SER A CB 1 ATOM 605 O OG A SER E 2 59 ? 51.888 11.597 13.691 0.37 17.89 ? 59 SER A OG 1 ATOM 606 O OG B SER E 2 59 ? 50.476 12.689 13.469 0.63 25.39 ? 59 SER A OG 1 ATOM 607 N N . GLN E 2 60 ? 52.964 10.569 10.000 1.00 17.34 ? 60 GLN A N 1 ATOM 608 C CA . GLN E 2 60 ? 54.197 9.929 9.536 1.00 17.28 ? 60 GLN A CA 1 ATOM 609 C C . GLN E 2 60 ? 54.500 10.276 8.118 1.00 17.84 ? 60 GLN A C 1 ATOM 610 O O . GLN E 2 60 ? 54.418 11.479 7.785 1.00 19.87 ? 60 GLN A O 1 ATOM 611 C CB . GLN E 2 60 ? 54.145 8.419 9.821 1.00 15.06 ? 60 GLN A CB 1 ATOM 612 C CG . GLN E 2 60 ? 54.046 8.232 11.342 1.00 14.26 ? 60 GLN A CG 1 ATOM 613 C CD . GLN E 2 60 ? 53.960 6.794 11.839 1.00 14.57 ? 60 GLN A CD 1 ATOM 614 O OE1 . GLN E 2 60 ? 54.157 5.826 11.077 1.00 15.29 ? 60 GLN A OE1 1 ATOM 615 N NE2 . GLN E 2 60 ? 53.614 6.652 13.099 1.00 16.48 ? 60 GLN A NE2 1 ATOM 616 N N . LYS E 2 61 ? 54.829 9.324 7.257 1.00 17.65 ? 61 LYS A N 1 ATOM 617 C CA . LYS E 2 61 ? 55.213 9.699 5.894 1.00 19.34 ? 61 LYS A CA 1 ATOM 618 C C . LYS E 2 61 ? 54.117 10.017 4.884 1.00 21.82 ? 61 LYS A C 1 ATOM 619 O O . LYS E 2 61 ? 53.377 9.160 4.421 1.00 19.48 ? 61 LYS A O 1 ATOM 620 C CB . LYS E 2 61 ? 56.190 8.666 5.319 1.00 18.88 ? 61 LYS A CB 1 ATOM 621 C CG . LYS E 2 61 ? 56.752 9.025 3.890 1.00 23.13 ? 61 LYS A CG 1 ATOM 622 C CD . LYS E 2 61 ? 57.540 7.853 3.312 1.00 29.46 ? 61 LYS A CD 1 ATOM 623 C CE . LYS E 2 61 ? 58.179 8.257 1.995 1.00 34.29 ? 61 LYS A CE 1 ATOM 624 N NZ . LYS E 2 61 ? 58.834 7.102 1.297 1.00 32.40 ? 61 LYS A NZ 1 ATOM 625 N N . ASN E 2 62 ? 54.035 11.299 4.523 1.00 19.79 ? 62 ASN A N 1 ATOM 626 C CA . ASN E 2 62 ? 53.083 11.743 3.539 1.00 21.66 ? 62 ASN A CA 1 ATOM 627 C C . ASN E 2 62 ? 53.483 11.186 2.145 1.00 23.02 ? 62 ASN A C 1 ATOM 628 O O . ASN E 2 62 ? 54.619 11.370 1.655 1.00 24.88 ? 62 ASN A O 1 ATOM 629 C CB . ASN E 2 62 ? 53.078 13.298 3.572 1.00 23.01 ? 62 ASN A CB 1 ATOM 630 C CG . ASN E 2 62 ? 52.032 13.925 2.678 1.00 31.94 ? 62 ASN A CG 1 ATOM 631 O OD1 . ASN E 2 62 ? 52.271 15.020 2.140 1.00 33.75 ? 62 ASN A OD1 1 ATOM 632 N ND2 . ASN E 2 62 ? 50.862 13.279 2.517 1.00 23.83 ? 62 ASN A ND2 1 ATOM 633 N N . VAL E 2 63 ? 52.547 10.534 1.475 1.00 20.85 ? 63 VAL A N 1 ATOM 634 C CA . VAL E 2 63 ? 52.756 9.958 0.148 1.00 22.45 ? 63 VAL A CA 1 ATOM 635 C C . VAL E 2 63 ? 51.469 10.167 -0.642 1.00 24.73 ? 63 VAL A C 1 ATOM 636 O O . VAL E 2 63 ? 50.417 10.530 -0.086 1.00 23.97 ? 63 VAL A O 1 ATOM 637 C CB . VAL E 2 63 ? 53.042 8.448 0.220 1.00 26.79 ? 63 VAL A CB 1 ATOM 638 C CG1 . VAL E 2 63 ? 54.252 8.178 1.063 1.00 24.24 ? 63 VAL A CG1 1 ATOM 639 C CG2 . VAL E 2 63 ? 51.801 7.724 0.806 1.00 24.78 ? 63 VAL A CG2 1 ATOM 640 N N . ALA E 2 64 ? 51.546 9.989 -1.952 1.00 26.23 ? 64 ALA A N 1 ATOM 641 C CA . ALA E 2 64 ? 50.370 10.144 -2.761 1.00 28.67 ? 64 ALA A CA 1 ATOM 642 C C . ALA E 2 64 ? 49.453 8.952 -2.640 1.00 26.55 ? 64 ALA A C 1 ATOM 643 O O . ALA E 2 64 ? 49.882 7.822 -2.505 1.00 28.76 ? 64 ALA A O 1 ATOM 644 C CB . ALA E 2 64 ? 50.742 10.322 -4.234 1.00 34.36 ? 64 ALA A CB 1 ATOM 645 N N . CYS E 2 65 ? 48.174 9.244 -2.660 1.00 24.19 ? 65 CYS A N 1 ATOM 646 C CA . CYS E 2 65 ? 47.148 8.227 -2.667 1.00 20.75 ? 65 CYS A CA 1 ATOM 647 C C . CYS E 2 65 ? 47.026 7.676 -4.079 1.00 26.07 ? 65 CYS A C 1 ATOM 648 O O . CYS E 2 65 ? 47.363 8.342 -5.064 1.00 25.34 ? 65 CYS A O 1 ATOM 649 C CB . CYS E 2 65 ? 45.805 8.835 -2.369 1.00 20.78 ? 65 CYS A CB 1 ATOM 650 S SG . CYS E 2 65 ? 45.668 9.670 -0.766 1.00 23.31 ? 65 CYS A SG 1 ATOM 651 N N . LYS E 2 66 ? 46.456 6.483 -4.144 1.00 22.99 ? 66 LYS A N 1 ATOM 652 C CA . LYS E 2 66 ? 46.135 5.746 -5.351 1.00 31.23 ? 66 LYS A CA 1 ATOM 653 C C . LYS E 2 66 ? 45.401 6.623 -6.366 1.00 35.89 ? 66 LYS A C 1 ATOM 654 O O . LYS E 2 66 ? 45.620 6.532 -7.573 1.00 34.25 ? 66 LYS A O 1 ATOM 655 C CB . LYS E 2 66 ? 45.175 4.637 -4.953 1.00 33.70 ? 66 LYS A CB 1 ATOM 656 C CG . LYS E 2 66 ? 43.776 5.184 -4.401 1.00 38.60 ? 66 LYS A CG 1 ATOM 657 C CD . LYS E 2 66 ? 43.819 6.446 -3.406 1.00 29.72 ? 66 LYS A CD 1 ATOM 658 C CE . LYS E 2 66 ? 42.528 6.726 -2.582 1.00 34.85 ? 66 LYS A CE 1 ATOM 659 N NZ . LYS E 2 66 ? 42.430 7.869 -1.450 1.00 27.11 ? 66 LYS A NZ 1 ATOM 660 N N . ASN E 2 67 ? 44.511 7.465 -5.862 1.00 33.59 ? 67 ASN A N 1 ATOM 661 C CA . ASN E 2 67 ? 43.692 8.298 -6.731 1.00 31.56 ? 67 ASN A CA 1 ATOM 662 C C . ASN E 2 67 ? 44.300 9.646 -7.017 1.00 32.43 ? 67 ASN A C 1 ATOM 663 O O . ASN E 2 67 ? 43.648 10.513 -7.591 1.00 35.82 ? 67 ASN A O 1 ATOM 664 C CB . ASN E 2 67 ? 42.297 8.447 -6.122 1.00 31.39 ? 67 ASN A CB 1 ATOM 665 C CG . ASN E 2 67 ? 42.291 9.261 -4.819 1.00 24.02 ? 67 ASN A CG 1 ATOM 666 O OD1 . ASN E 2 67 ? 43.309 9.794 -4.378 1.00 27.97 ? 67 ASN A OD1 1 ATOM 667 N ND2 . ASN E 2 67 ? 41.119 9.367 -4.222 1.00 29.35 ? 67 ASN A ND2 1 ATOM 668 N N . GLY E 2 68 ? 45.533 9.849 -6.595 1.00 28.48 ? 68 GLY A N 1 ATOM 669 C CA . GLY E 2 68 ? 46.170 11.130 -6.866 1.00 30.66 ? 68 GLY A CA 1 ATOM 670 C C . GLY E 2 68 ? 46.001 12.183 -5.802 1.00 31.50 ? 68 GLY A C 1 ATOM 671 O O . GLY E 2 68 ? 46.649 13.233 -5.882 1.00 34.04 ? 68 GLY A O 1 ATOM 672 N N . GLN E 2 69 ? 45.157 11.942 -4.800 1.00 27.61 ? 69 GLN A N 1 ATOM 673 C CA . GLN E 2 69 ? 44.996 12.939 -3.720 1.00 27.46 ? 69 GLN A CA 1 ATOM 674 C C . GLN E 2 69 ? 46.268 13.014 -2.867 1.00 23.54 ? 69 GLN A C 1 ATOM 675 O O . GLN E 2 69 ? 47.126 12.128 -2.947 1.00 26.65 ? 69 GLN A O 1 ATOM 676 C CB . GLN E 2 69 ? 43.745 12.607 -2.917 1.00 27.15 ? 69 GLN A CB 1 ATOM 677 C CG . GLN E 2 69 ? 42.533 12.880 -3.762 1.00 32.05 ? 69 GLN A CG 1 ATOM 678 C CD . GLN E 2 69 ? 41.259 12.805 -2.977 1.00 41.19 ? 69 GLN A CD 1 ATOM 679 O OE1 . GLN E 2 69 ? 40.875 11.736 -2.500 1.00 41.37 ? 69 GLN A OE1 1 ATOM 680 N NE2 . GLN E 2 69 ? 40.587 13.948 -2.824 1.00 44.48 ? 69 GLN A NE2 1 ATOM 681 N N . THR E 2 70 ? 46.431 14.036 -2.032 1.00 22.83 ? 70 THR A N 1 ATOM 682 C CA . THR E 2 70 ? 47.694 14.166 -1.313 1.00 22.52 ? 70 THR A CA 1 ATOM 683 C C . THR E 2 70 ? 47.641 13.931 0.189 1.00 23.83 ? 70 THR A C 1 ATOM 684 O O . THR E 2 70 ? 48.596 14.253 0.900 1.00 25.09 ? 70 THR A O 1 ATOM 685 C CB . THR E 2 70 ? 48.289 15.614 -1.582 1.00 29.95 ? 70 THR A CB 1 ATOM 686 O OG1 . THR E 2 70 ? 47.424 16.607 -1.009 1.00 31.03 ? 70 THR A OG1 1 ATOM 687 C CG2 . THR E 2 70 ? 48.331 15.884 -3.085 1.00 29.09 ? 70 THR A CG2 1 ATOM 688 N N . ASN E 2 71 ? 46.536 13.372 0.675 1.00 20.51 ? 71 ASN A N 1 ATOM 689 C CA . ASN E 2 71 ? 46.392 13.179 2.107 1.00 19.13 ? 71 ASN A CA 1 ATOM 690 C C . ASN E 2 71 ? 46.607 11.743 2.552 1.00 19.54 ? 71 ASN A C 1 ATOM 691 O O . ASN E 2 71 ? 45.973 11.302 3.514 1.00 17.79 ? 71 ASN A O 1 ATOM 692 C CB . ASN E 2 71 ? 44.998 13.647 2.578 1.00 19.15 ? 71 ASN A CB 1 ATOM 693 C CG . ASN E 2 71 ? 43.852 12.822 1.942 1.00 18.78 ? 71 ASN A CG 1 ATOM 694 O OD1 . ASN E 2 71 ? 43.921 12.463 0.771 1.00 23.68 ? 71 ASN A OD1 1 ATOM 695 N ND2 . ASN E 2 71 ? 42.794 12.523 2.716 1.00 19.72 ? 71 ASN A ND2 1 ATOM 696 N N . CYS E 2 72 ? 47.468 11.012 1.858 1.00 19.34 ? 72 CYS A N 1 ATOM 697 C CA . CYS E 2 72 ? 47.752 9.627 2.314 1.00 16.76 ? 72 CYS A CA 1 ATOM 698 C C . CYS E 2 72 ? 49.071 9.642 3.106 1.00 17.37 ? 72 CYS A C 1 ATOM 699 O O . CYS E 2 72 ? 49.982 10.460 2.870 1.00 17.66 ? 72 CYS A O 1 ATOM 700 C CB . CYS E 2 72 ? 47.847 8.649 1.124 1.00 17.11 ? 72 CYS A CB 1 ATOM 701 S SG . CYS E 2 72 ? 46.166 8.178 0.601 1.00 22.17 ? 72 CYS A SG 1 ATOM 702 N N . TYR E 2 73 ? 49.152 8.744 4.089 1.00 13.74 ? 73 TYR A N 1 ATOM 703 C CA . TYR E 2 73 ? 50.305 8.625 4.935 1.00 15.43 ? 73 TYR A CA 1 ATOM 704 C C . TYR E 2 73 ? 50.708 7.189 5.019 1.00 17.50 ? 73 TYR A C 1 ATOM 705 O O . TYR E 2 73 ? 49.866 6.303 5.058 1.00 15.09 ? 73 TYR A O 1 ATOM 706 C CB . TYR E 2 73 ? 49.996 9.161 6.347 1.00 14.42 ? 73 TYR A CB 1 ATOM 707 C CG . TYR E 2 73 ? 49.875 10.648 6.276 1.00 15.79 ? 73 TYR A CG 1 ATOM 708 C CD1 . TYR E 2 73 ? 48.694 11.244 5.820 1.00 18.70 ? 73 TYR A CD1 1 ATOM 709 C CD2 . TYR E 2 73 ? 50.995 11.454 6.588 1.00 21.50 ? 73 TYR A CD2 1 ATOM 710 C CE1 . TYR E 2 73 ? 48.625 12.641 5.656 1.00 24.75 ? 73 TYR A CE1 1 ATOM 711 C CE2 . TYR E 2 73 ? 50.935 12.875 6.427 1.00 21.67 ? 73 TYR A CE2 1 ATOM 712 C CZ . TYR E 2 73 ? 49.738 13.429 5.950 1.00 23.40 ? 73 TYR A CZ 1 ATOM 713 O OH . TYR E 2 73 ? 49.641 14.776 5.665 1.00 27.97 ? 73 TYR A OH 1 ATOM 714 N N . GLN E 2 74 ? 52.013 6.977 5.051 1.00 15.77 ? 74 GLN A N 1 ATOM 715 C CA . GLN E 2 74 ? 52.577 5.637 5.106 1.00 16.56 ? 74 GLN A CA 1 ATOM 716 C C . GLN E 2 74 ? 53.282 5.439 6.437 1.00 14.63 ? 74 GLN A C 1 ATOM 717 O O . GLN E 2 74 ? 54.011 6.320 6.915 1.00 17.08 ? 74 GLN A O 1 ATOM 718 C CB . GLN E 2 74 ? 53.545 5.467 3.919 1.00 18.47 ? 74 GLN A CB 1 ATOM 719 C CG . GLN E 2 74 ? 54.210 4.085 3.820 1.00 21.41 ? 74 GLN A CG 1 ATOM 720 C CD . GLN E 2 74 ? 55.075 3.962 2.556 1.00 25.22 ? 74 GLN A CD 1 ATOM 721 O OE1 . GLN E 2 74 ? 54.634 4.265 1.441 1.00 23.64 ? 74 GLN A OE1 1 ATOM 722 N NE2 . GLN E 2 74 ? 56.328 3.538 2.741 1.00 24.92 ? 74 GLN A NE2 1 ATOM 723 N N . SER E 2 75 ? 53.080 4.279 7.067 1.00 12.83 ? 75 SER A N 1 ATOM 724 C CA . SER E 2 75 ? 53.690 4.057 8.363 1.00 12.73 ? 75 SER A CA 1 ATOM 725 C C . SER E 2 75 ? 55.224 3.935 8.243 1.00 16.44 ? 75 SER A C 1 ATOM 726 O O . SER E 2 75 ? 55.736 3.354 7.275 1.00 17.04 ? 75 SER A O 1 ATOM 727 C CB . SER E 2 75 ? 53.154 2.805 9.067 1.00 16.24 ? 75 SER A CB 1 ATOM 728 O OG . SER E 2 75 ? 53.322 1.640 8.277 1.00 15.34 ? 75 SER A OG 1 ATOM 729 N N . TYR E 2 76 ? 55.928 4.499 9.207 1.00 15.15 ? 76 TYR A N 1 ATOM 730 C CA . TYR E 2 76 ? 57.414 4.414 9.182 1.00 15.68 ? 76 TYR A CA 1 ATOM 731 C C . TYR E 2 76 ? 57.856 2.967 9.378 1.00 18.59 ? 76 TYR A C 1 ATOM 732 O O . TYR E 2 76 ? 58.777 2.517 8.686 1.00 16.54 ? 76 TYR A O 1 ATOM 733 C CB . TYR E 2 76 ? 57.999 5.254 10.309 1.00 13.96 ? 76 TYR A CB 1 ATOM 734 C CG . TYR E 2 76 ? 57.880 6.749 10.091 1.00 16.76 ? 76 TYR A CG 1 ATOM 735 C CD1 . TYR E 2 76 ? 58.234 7.318 8.859 1.00 21.08 ? 76 TYR A CD1 1 ATOM 736 C CD2 . TYR E 2 76 ? 57.482 7.594 11.138 1.00 19.43 ? 76 TYR A CD2 1 ATOM 737 C CE1 . TYR E 2 76 ? 58.202 8.710 8.672 1.00 20.93 ? 76 TYR A CE1 1 ATOM 738 C CE2 . TYR E 2 76 ? 57.440 9.009 10.950 1.00 19.97 ? 76 TYR A CE2 1 ATOM 739 C CZ . TYR E 2 76 ? 57.806 9.521 9.708 1.00 21.01 ? 76 TYR A CZ 1 ATOM 740 O OH . TYR E 2 76 ? 57.724 10.892 9.479 1.00 24.47 ? 76 TYR A OH 1 ATOM 741 N N . SER E 2 77 ? 57.185 2.233 10.281 1.00 16.69 ? 77 SER A N 1 ATOM 742 C CA . SER E 2 77 ? 57.514 0.833 10.569 1.00 14.83 ? 77 SER A CA 1 ATOM 743 C C . SER E 2 77 ? 56.500 -0.081 9.918 1.00 14.64 ? 77 SER A C 1 ATOM 744 O O . SER E 2 77 ? 55.395 0.355 9.570 1.00 17.79 ? 77 SER A O 1 ATOM 745 C CB . SER E 2 77 ? 57.448 0.517 12.085 1.00 19.40 ? 77 SER A CB 1 ATOM 746 O OG . SER E 2 77 ? 58.256 1.344 12.901 1.00 24.01 ? 77 SER A OG 1 ATOM 747 N N . THR E 2 78 ? 56.864 -1.338 9.761 1.00 17.44 ? 78 THR A N 1 ATOM 748 C CA . THR E 2 78 ? 55.908 -2.315 9.264 1.00 14.22 ? 78 THR A CA 1 ATOM 749 C C . THR E 2 78 ? 54.938 -2.579 10.425 1.00 16.53 ? 78 THR A C 1 ATOM 750 O O . THR E 2 78 ? 55.223 -2.344 11.603 1.00 17.42 ? 78 THR A O 1 ATOM 751 C CB . THR E 2 78 ? 56.539 -3.657 8.887 1.00 17.82 ? 78 THR A CB 1 ATOM 752 O OG1 . THR E 2 78 ? 57.186 -4.212 10.057 1.00 19.26 ? 78 THR A OG1 1 ATOM 753 C CG2 . THR E 2 78 ? 57.498 -3.478 7.739 1.00 16.76 ? 78 THR A CG2 1 ATOM 754 N N . MET E 2 79 ? 53.760 -3.087 10.059 1.00 14.49 ? 79 MET A N 1 ATOM 755 C CA . MET E 2 79 ? 52.699 -3.439 10.982 1.00 14.94 ? 79 MET A CA 1 ATOM 756 C C . MET E 2 79 ? 52.167 -4.812 10.563 1.00 13.44 ? 79 MET A C 1 ATOM 757 O O . MET E 2 79 ? 52.225 -5.181 9.399 1.00 14.28 ? 79 MET A O 1 ATOM 758 C CB . MET E 2 79 ? 51.557 -2.405 10.872 1.00 15.96 ? 79 MET A CB 1 ATOM 759 C CG . MET E 2 79 ? 51.987 -1.021 11.355 1.00 15.38 ? 79 MET A CG 1 ATOM 760 S SD . MET E 2 79 ? 50.471 0.008 11.390 1.00 16.56 ? 79 MET A SD 1 ATOM 761 C CE . MET E 2 79 ? 51.027 1.358 12.451 1.00 19.36 ? 79 MET A CE 1 ATOM 762 N N . SER E 2 80 ? 51.678 -5.537 11.550 1.00 13.93 ? 80 SER A N 1 ATOM 763 C CA . SER E 2 80 ? 51.093 -6.847 11.332 1.00 14.54 ? 80 SER A CA 1 ATOM 764 C C . SER E 2 80 ? 49.721 -6.596 10.681 1.00 12.53 ? 80 SER A C 1 ATOM 765 O O . SER E 2 80 ? 48.866 -5.863 11.249 1.00 13.47 ? 80 SER A O 1 ATOM 766 C CB . SER E 2 80 ? 50.859 -7.515 12.695 1.00 16.23 ? 80 SER A CB 1 ATOM 767 O OG . SER E 2 80 ? 50.091 -8.714 12.493 1.00 17.81 ? 80 SER A OG 1 ATOM 768 N N . ILE E 2 81 ? 49.508 -7.176 9.513 1.00 13.40 ? 81 ILE A N 1 ATOM 769 C CA . ILE E 2 81 ? 48.228 -6.995 8.809 1.00 12.80 ? 81 ILE A CA 1 ATOM 770 C C . ILE E 2 81 ? 47.719 -8.296 8.241 1.00 12.97 ? 81 ILE A C 1 ATOM 771 O O . ILE E 2 81 ? 48.432 -9.285 8.137 1.00 16.69 ? 81 ILE A O 1 ATOM 772 C CB . ILE E 2 81 ? 48.354 -5.999 7.634 1.00 13.63 ? 81 ILE A CB 1 ATOM 773 C CG1 . ILE E 2 81 ? 49.348 -6.532 6.565 1.00 13.32 ? 81 ILE A CG1 1 ATOM 774 C CG2 . ILE E 2 81 ? 48.829 -4.636 8.239 1.00 15.08 ? 81 ILE A CG2 1 ATOM 775 C CD1 . ILE E 2 81 ? 49.476 -5.617 5.341 1.00 17.83 ? 81 ILE A CD1 1 ATOM 776 N N . THR E 2 82 ? 46.428 -8.321 7.901 1.00 13.00 ? 82 THR A N 1 ATOM 777 C CA . THR E 2 82 ? 45.889 -9.504 7.237 1.00 11.31 ? 82 THR A CA 1 ATOM 778 C C . THR E 2 82 ? 45.189 -9.006 5.976 1.00 16.67 ? 82 THR A C 1 ATOM 779 O O . THR E 2 82 ? 44.408 -8.093 6.086 1.00 14.81 ? 82 THR A O 1 ATOM 780 C CB . THR E 2 82 ? 44.849 -10.225 8.104 1.00 14.43 ? 82 THR A CB 1 ATOM 781 O OG1 . THR E 2 82 ? 45.503 -10.687 9.314 1.00 15.52 ? 82 THR A OG1 1 ATOM 782 C CG2 . THR E 2 82 ? 44.271 -11.470 7.326 1.00 14.51 ? 82 THR A CG2 1 ATOM 783 N N . ASP E 2 83 ? 45.583 -9.524 4.801 1.00 10.36 ? 83 ASP A N 1 ATOM 784 C CA . ASP E 2 83 ? 44.906 -9.214 3.532 1.00 14.15 ? 83 ASP A CA 1 ATOM 785 C C . ASP E 2 83 ? 43.773 -10.185 3.336 1.00 13.69 ? 83 ASP A C 1 ATOM 786 O O . ASP E 2 83 ? 43.983 -11.394 3.495 1.00 14.28 ? 83 ASP A O 1 ATOM 787 C CB . ASP E 2 83 ? 45.872 -9.433 2.367 1.00 19.53 ? 83 ASP A CB 1 ATOM 788 C CG . ASP E 2 83 ? 46.952 -8.393 2.328 1.00 32.55 ? 83 ASP A CG 1 ATOM 789 O OD1 . ASP E 2 83 ? 46.613 -7.200 2.493 1.00 34.16 ? 83 ASP A OD1 1 ATOM 790 O OD2 . ASP E 2 83 ? 48.128 -8.760 2.142 1.00 38.77 ? 83 ASP A OD2 1 ATOM 791 N N . CYS E 2 84 ? 42.564 -9.698 3.073 1.00 11.45 ? 84 CYS A N 1 ATOM 792 C CA . CYS E 2 84 ? 41.437 -10.585 2.815 1.00 11.02 ? 84 CYS A CA 1 ATOM 793 C C . CYS E 2 84 ? 41.069 -10.378 1.360 1.00 14.86 ? 84 CYS A C 1 ATOM 794 O O . CYS E 2 84 ? 40.782 -9.264 0.982 1.00 15.88 ? 84 CYS A O 1 ATOM 795 C CB . CYS E 2 84 ? 40.231 -10.164 3.657 1.00 13.04 ? 84 CYS A CB 1 ATOM 796 S SG . CYS E 2 84 ? 40.517 -10.449 5.443 1.00 16.59 ? 84 CYS A SG 1 ATOM 797 N N . ARG E 2 85 ? 41.045 -11.443 0.538 1.00 12.75 ? 85 ARG A N 1 ATOM 798 C CA . ARG E 2 85 ? 40.771 -11.286 -0.898 1.00 13.55 ? 85 ARG A CA 1 ATOM 799 C C . ARG E 2 85 ? 39.715 -12.322 -1.250 1.00 12.34 ? 85 ARG A C 1 ATOM 800 O O . ARG E 2 85 ? 39.851 -13.498 -0.913 1.00 13.40 ? 85 ARG A O 1 ATOM 801 C CB . ARG E 2 85 ? 42.056 -11.602 -1.714 1.00 13.58 ? 85 ARG A CB 1 ATOM 802 C CG . ARG E 2 85 ? 43.194 -10.618 -1.627 1.00 22.53 ? 85 ARG A CG 1 ATOM 803 C CD . ARG E 2 85 ? 44.166 -10.915 -2.802 1.00 29.79 ? 85 ARG A CD 1 ATOM 804 N NE . ARG E 2 85 ? 45.118 -12.000 -2.530 1.00 40.89 ? 85 ARG A NE 1 ATOM 805 C CZ . ARG E 2 85 ? 45.114 -13.254 -3.019 1.00 46.46 ? 85 ARG A CZ 1 ATOM 806 N NH1 . ARG E 2 85 ? 44.183 -13.730 -3.880 1.00 43.29 ? 85 ARG A NH1 1 ATOM 807 N NH2 . ARG E 2 85 ? 46.105 -14.060 -2.637 1.00 42.36 ? 85 ARG A NH2 1 ATOM 808 N N . GLU E 2 86 ? 38.665 -11.913 -1.963 1.00 11.44 ? 86 GLU A N 1 ATOM 809 C CA . GLU E 2 86 ? 37.648 -12.870 -2.334 1.00 11.11 ? 86 GLU A CA 1 ATOM 810 C C . GLU E 2 86 ? 38.175 -14.030 -3.150 1.00 10.61 ? 86 GLU A C 1 ATOM 811 O O . GLU E 2 86 ? 39.091 -13.882 -3.972 1.00 14.68 ? 86 GLU A O 1 ATOM 812 C CB . GLU E 2 86 ? 36.634 -12.157 -3.229 1.00 15.14 ? 86 GLU A CB 1 ATOM 813 C CG . GLU E 2 86 ? 35.360 -11.852 -2.632 1.00 19.63 ? 86 GLU A CG 1 ATOM 814 C CD . GLU E 2 86 ? 34.347 -11.419 -3.724 1.00 15.89 ? 86 GLU A CD 1 ATOM 815 O OE1 . GLU E 2 86 ? 34.781 -10.594 -4.588 1.00 19.79 ? 86 GLU A OE1 1 ATOM 816 O OE2 . GLU E 2 86 ? 33.199 -11.928 -3.698 1.00 17.26 ? 86 GLU A OE2 1 ATOM 817 N N . THR E 2 87 ? 37.599 -15.207 -2.939 1.00 11.27 ? 87 THR A N 1 ATOM 818 C CA . THR E 2 87 ? 38.009 -16.348 -3.769 1.00 12.44 ? 87 THR A CA 1 ATOM 819 C C . THR E 2 87 ? 37.106 -16.352 -4.992 1.00 13.31 ? 87 THR A C 1 ATOM 820 O O . THR E 2 87 ? 36.084 -15.649 -5.065 1.00 13.79 ? 87 THR A O 1 ATOM 821 C CB . THR E 2 87 ? 37.778 -17.692 -3.079 1.00 12.05 ? 87 THR A CB 1 ATOM 822 O OG1 . THR E 2 87 ? 36.366 -17.899 -2.898 1.00 16.28 ? 87 THR A OG1 1 ATOM 823 C CG2 . THR E 2 87 ? 38.430 -17.712 -1.746 1.00 20.81 ? 87 THR A CG2 1 ATOM 824 N N . GLY E 2 88 ? 37.433 -17.226 -5.946 1.00 14.86 ? 88 GLY A N 1 ATOM 825 C CA . GLY E 2 88 ? 36.579 -17.313 -7.128 1.00 16.88 ? 88 GLY A CA 1 ATOM 826 C C . GLY E 2 88 ? 35.191 -17.904 -6.926 1.00 16.31 ? 88 GLY A C 1 ATOM 827 O O . GLY E 2 88 ? 34.284 -17.679 -7.757 1.00 19.52 ? 88 GLY A O 1 ATOM 828 N N . SER E 2 89 ? 35.013 -18.623 -5.813 1.00 15.63 ? 89 SER A N 1 ATOM 829 C CA . SER E 2 89 ? 33.738 -19.254 -5.493 1.00 15.74 ? 89 SER A CA 1 ATOM 830 C C . SER E 2 89 ? 32.821 -18.354 -4.695 1.00 16.05 ? 89 SER A C 1 ATOM 831 O O . SER E 2 89 ? 31.648 -18.686 -4.446 1.00 21.21 ? 89 SER A O 1 ATOM 832 C CB A SER E 2 89 ? 33.974 -20.542 -4.685 0.50 18.96 ? 89 SER A CB 1 ATOM 833 C CB B SER E 2 89 ? 33.787 -20.629 -4.929 0.50 21.83 ? 89 SER A CB 1 ATOM 834 O OG A SER E 2 89 ? 34.763 -21.455 -5.424 0.50 21.70 ? 89 SER A OG 1 ATOM 835 O OG B SER E 2 89 ? 34.523 -20.529 -3.738 0.50 23.02 ? 89 SER A OG 1 ATOM 836 N N . SER E 2 90 ? 33.363 -17.221 -4.288 1.00 16.46 ? 90 SER A N 1 ATOM 837 C CA . SER E 2 90 ? 32.599 -16.260 -3.503 1.00 16.35 ? 90 SER A CA 1 ATOM 838 C C . SER E 2 90 ? 31.326 -15.783 -4.259 1.00 20.06 ? 90 SER A C 1 ATOM 839 O O . SER E 2 90 ? 31.439 -15.250 -5.376 1.00 22.01 ? 90 SER A O 1 ATOM 840 C CB . SER E 2 90 ? 33.487 -15.082 -3.205 1.00 14.58 ? 90 SER A CB 1 ATOM 841 O OG . SER E 2 90 ? 32.750 -14.254 -2.285 1.00 15.85 ? 90 SER A OG 1 ATOM 842 N N . LYS E 2 91 ? 30.144 -15.963 -3.667 1.00 17.77 ? 91 LYS A N 1 ATOM 843 C CA . LYS E 2 91 ? 28.903 -15.536 -4.336 1.00 19.44 ? 91 LYS A CA 1 ATOM 844 C C . LYS E 2 91 ? 27.872 -15.130 -3.322 1.00 18.28 ? 91 LYS A C 1 ATOM 845 O O . LYS E 2 91 ? 27.325 -15.986 -2.615 1.00 21.09 ? 91 LYS A O 1 ATOM 846 C CB . LYS E 2 91 ? 28.395 -16.678 -5.222 1.00 18.86 ? 91 LYS A CB 1 ATOM 847 C CG . LYS E 2 91 ? 26.984 -16.410 -5.848 1.00 25.10 ? 91 LYS A CG 1 ATOM 848 C CD . LYS E 2 91 ? 26.406 -17.775 -6.341 1.00 31.78 ? 91 LYS A CD 1 ATOM 849 C CE . LYS E 2 91 ? 27.242 -18.356 -7.469 1.00 40.91 ? 91 LYS A CE 1 ATOM 850 N NZ . LYS E 2 91 ? 26.568 -18.277 -8.829 1.00 47.92 ? 91 LYS A NZ 1 ATOM 851 N N . TYR E 2 92 ? 27.651 -13.808 -3.230 1.00 18.06 ? 92 TYR A N 1 ATOM 852 C CA . TYR E 2 92 ? 26.694 -13.245 -2.268 1.00 17.43 ? 92 TYR A CA 1 ATOM 853 C C . TYR E 2 92 ? 25.407 -14.084 -2.290 1.00 20.36 ? 92 TYR A C 1 ATOM 854 O O . TYR E 2 92 ? 24.894 -14.358 -3.375 1.00 24.12 ? 92 TYR A O 1 ATOM 855 C CB . TYR E 2 92 ? 26.388 -11.776 -2.620 1.00 14.48 ? 92 TYR A CB 1 ATOM 856 C CG . TYR E 2 92 ? 25.448 -11.138 -1.632 1.00 19.19 ? 92 TYR A CG 1 ATOM 857 C CD1 . TYR E 2 92 ? 25.912 -10.616 -0.432 1.00 18.42 ? 92 TYR A CD1 1 ATOM 858 C CD2 . TYR E 2 92 ? 24.072 -11.132 -1.867 1.00 17.20 ? 92 TYR A CD2 1 ATOM 859 C CE1 . TYR E 2 92 ? 25.026 -10.101 0.520 1.00 18.79 ? 92 TYR A CE1 1 ATOM 860 C CE2 . TYR E 2 92 ? 23.190 -10.627 -0.919 1.00 14.20 ? 92 TYR A CE2 1 ATOM 861 C CZ . TYR E 2 92 ? 23.665 -10.108 0.270 1.00 17.81 ? 92 TYR A CZ 1 ATOM 862 O OH . TYR E 2 92 ? 22.800 -9.550 1.193 1.00 18.94 ? 92 TYR A OH 1 ATOM 863 N N . PRO E 2 93 ? 24.822 -14.399 -1.111 1.00 18.29 ? 93 PRO A N 1 ATOM 864 C CA . PRO E 2 93 ? 25.232 -14.040 0.246 1.00 20.70 ? 93 PRO A CA 1 ATOM 865 C C . PRO E 2 93 ? 26.342 -14.917 0.845 1.00 22.49 ? 93 PRO A C 1 ATOM 866 O O . PRO E 2 93 ? 26.785 -14.615 1.947 1.00 25.32 ? 93 PRO A O 1 ATOM 867 C CB . PRO E 2 93 ? 23.945 -14.192 1.038 1.00 21.09 ? 93 PRO A CB 1 ATOM 868 C CG . PRO E 2 93 ? 23.398 -15.453 0.466 1.00 21.52 ? 93 PRO A CG 1 ATOM 869 C CD . PRO E 2 93 ? 23.587 -15.228 -1.064 1.00 21.10 ? 93 PRO A CD 1 ATOM 870 N N . ASN E 2 94 ? 26.798 -15.917 0.101 1.00 20.03 ? 94 ASN A N 1 ATOM 871 C CA . ASN E 2 94 ? 27.857 -16.828 0.598 1.00 20.80 ? 94 ASN A CA 1 ATOM 872 C C . ASN E 2 94 ? 29.217 -16.339 0.145 1.00 18.95 ? 94 ASN A C 1 ATOM 873 O O . ASN E 2 94 ? 29.852 -16.886 -0.759 1.00 22.13 ? 94 ASN A O 1 ATOM 874 C CB . ASN E 2 94 ? 27.602 -18.248 0.094 1.00 26.48 ? 94 ASN A CB 1 ATOM 875 C CG . ASN E 2 94 ? 26.283 -18.764 0.575 1.00 28.85 ? 94 ASN A CG 1 ATOM 876 O OD1 . ASN E 2 94 ? 26.059 -18.882 1.788 1.00 34.69 ? 94 ASN A OD1 1 ATOM 877 N ND2 . ASN E 2 94 ? 25.375 -19.003 -0.345 1.00 26.12 ? 94 ASN A ND2 1 ATOM 878 N N . CYS E 2 95 ? 29.648 -15.257 0.780 1.00 17.87 ? 95 CYS A N 1 ATOM 879 C CA . CYS E 2 95 ? 30.939 -14.652 0.435 1.00 17.99 ? 95 CYS A CA 1 ATOM 880 C C . CYS E 2 95 ? 32.052 -15.525 0.946 1.00 19.35 ? 95 CYS A C 1 ATOM 881 O O . CYS E 2 95 ? 31.850 -16.244 1.909 1.00 25.62 ? 95 CYS A O 1 ATOM 882 C CB . CYS E 2 95 ? 31.014 -13.275 1.058 1.00 18.60 ? 95 CYS A CB 1 ATOM 883 S SG . CYS E 2 95 ? 29.682 -12.168 0.439 1.00 19.47 ? 95 CYS A SG 1 ATOM 884 N N . ALA E 2 96 ? 33.222 -15.492 0.305 1.00 13.33 ? 96 ALA A N 1 ATOM 885 C CA . ALA E 2 96 ? 34.308 -16.378 0.731 1.00 11.37 ? 96 ALA A CA 1 ATOM 886 C C . ALA E 2 96 ? 35.632 -15.692 0.413 1.00 12.82 ? 96 ALA A C 1 ATOM 887 O O . ALA E 2 96 ? 35.790 -15.077 -0.646 1.00 12.60 ? 96 ALA A O 1 ATOM 888 C CB . ALA E 2 96 ? 34.231 -17.679 -0.026 1.00 14.72 ? 96 ALA A CB 1 ATOM 889 N N . TYR E 2 97 ? 36.583 -15.836 1.314 1.00 11.92 ? 97 TYR A N 1 ATOM 890 C CA . TYR E 2 97 ? 37.866 -15.143 1.213 1.00 8.89 ? 97 TYR A CA 1 ATOM 891 C C . TYR E 2 97 ? 39.086 -15.968 1.549 1.00 10.40 ? 97 TYR A C 1 ATOM 892 O O . TYR E 2 97 ? 39.003 -16.900 2.349 1.00 14.96 ? 97 TYR A O 1 ATOM 893 C CB . TYR E 2 97 ? 37.872 -13.975 2.266 1.00 9.65 ? 97 TYR A CB 1 ATOM 894 C CG . TYR E 2 97 ? 36.834 -12.934 2.054 1.00 8.48 ? 97 TYR A CG 1 ATOM 895 C CD1 . TYR E 2 97 ? 35.543 -13.095 2.534 1.00 9.11 ? 97 TYR A CD1 1 ATOM 896 C CD2 . TYR E 2 97 ? 37.126 -11.806 1.239 1.00 11.38 ? 97 TYR A CD2 1 ATOM 897 C CE1 . TYR E 2 97 ? 34.524 -12.177 2.216 1.00 9.46 ? 97 TYR A CE1 1 ATOM 898 C CE2 . TYR E 2 97 ? 36.125 -10.871 0.916 1.00 10.93 ? 97 TYR A CE2 1 ATOM 899 C CZ . TYR E 2 97 ? 34.851 -11.062 1.392 1.00 13.60 ? 97 TYR A CZ 1 ATOM 900 O OH . TYR E 2 97 ? 33.858 -10.151 1.048 1.00 14.64 ? 97 TYR A OH 1 ATOM 901 N N . LYS E 2 98 ? 40.190 -15.591 0.919 1.00 10.83 ? 98 LYS A N 1 ATOM 902 C CA . LYS E 2 98 ? 41.491 -16.146 1.228 1.00 12.94 ? 98 LYS A CA 1 ATOM 903 C C . LYS E 2 98 ? 42.118 -15.182 2.246 1.00 14.52 ? 98 LYS A C 1 ATOM 904 O O . LYS E 2 98 ? 42.072 -13.957 2.079 1.00 14.53 ? 98 LYS A O 1 ATOM 905 C CB . LYS E 2 98 ? 42.338 -16.219 -0.007 1.00 17.38 ? 98 LYS A CB 1 ATOM 906 C CG . LYS E 2 98 ? 43.794 -16.573 0.310 1.00 22.32 ? 98 LYS A CG 1 ATOM 907 C CD . LYS E 2 98 ? 44.661 -16.420 -0.928 1.00 30.35 ? 98 LYS A CD 1 ATOM 908 C CE . LYS E 2 98 ? 44.176 -17.368 -2.043 1.00 38.61 ? 98 LYS A CE 1 ATOM 909 N NZ . LYS E 2 98 ? 45.010 -17.305 -3.290 1.00 44.39 ? 98 LYS A NZ 1 ATOM 910 N N . THR E 2 99 ? 42.722 -15.761 3.295 1.00 12.27 ? 99 THR A N 1 ATOM 911 C CA . THR E 2 99 ? 43.392 -15.019 4.374 1.00 13.65 ? 99 THR A CA 1 ATOM 912 C C . THR E 2 99 ? 44.889 -15.103 4.170 1.00 15.65 ? 99 THR A C 1 ATOM 913 O O . THR E 2 99 ? 45.416 -16.208 3.985 1.00 15.45 ? 99 THR A O 1 ATOM 914 C CB . THR E 2 99 ? 43.069 -15.672 5.735 1.00 11.71 ? 99 THR A CB 1 ATOM 915 O OG1 . THR E 2 99 ? 41.666 -15.506 6.006 1.00 13.20 ? 99 THR A OG1 1 ATOM 916 C CG2 . THR E 2 99 ? 43.840 -15.043 6.882 1.00 13.83 ? 99 THR A CG2 1 ATOM 917 N N . THR E 2 100 ? 45.571 -13.943 4.187 1.00 12.55 ? 100 THR A N 1 ATOM 918 C CA . THR E 2 100 ? 47.020 -13.915 4.037 1.00 14.83 ? 100 THR A CA 1 ATOM 919 C C . THR E 2 100 ? 47.587 -12.967 5.083 1.00 18.50 ? 100 THR A C 1 ATOM 920 O O . THR E 2 100 ? 47.206 -11.791 5.134 1.00 17.41 ? 100 THR A O 1 ATOM 921 C CB . THR E 2 100 ? 47.460 -13.398 2.632 1.00 19.94 ? 100 THR A CB 1 ATOM 922 O OG1 . THR E 2 100 ? 46.922 -14.262 1.624 1.00 21.53 ? 100 THR A OG1 1 ATOM 923 C CG2 . THR E 2 100 ? 49.003 -13.424 2.515 1.00 27.45 ? 100 THR A CG2 1 ATOM 924 N N . GLN E 2 101 ? 48.519 -13.462 5.900 1.00 18.20 ? 101 GLN A N 1 ATOM 925 C CA . GLN E 2 101 ? 49.131 -12.621 6.962 1.00 17.95 ? 101 GLN A CA 1 ATOM 926 C C . GLN E 2 101 ? 50.380 -11.968 6.419 1.00 22.25 ? 101 GLN A C 1 ATOM 927 O O . GLN E 2 101 ? 51.081 -12.554 5.604 1.00 25.55 ? 101 GLN A O 1 ATOM 928 C CB . GLN E 2 101 ? 49.428 -13.536 8.173 1.00 25.36 ? 101 GLN A CB 1 ATOM 929 C CG . GLN E 2 101 ? 50.024 -12.881 9.433 1.00 29.11 ? 101 GLN A CG 1 ATOM 930 C CD . GLN E 2 101 ? 49.231 -11.689 10.018 1.00 34.70 ? 101 GLN A CD 1 ATOM 931 O OE1 . GLN E 2 101 ? 47.955 -11.710 10.100 1.00 19.10 ? 101 GLN A OE1 1 ATOM 932 N NE2 . GLN E 2 101 ? 50.015 -10.630 10.464 1.00 19.96 ? 101 GLN A NE2 1 ATOM 933 N N . ALA E 2 102 ? 50.645 -10.721 6.824 1.00 18.67 ? 102 ALA A N 1 ATOM 934 C CA . ALA E 2 102 ? 51.819 -9.998 6.308 1.00 21.45 ? 102 ALA A CA 1 ATOM 935 C C . ALA E 2 102 ? 52.308 -8.996 7.333 1.00 16.93 ? 102 ALA A C 1 ATOM 936 O O . ALA E 2 102 ? 51.641 -8.751 8.305 1.00 17.30 ? 102 ALA A O 1 ATOM 937 C CB . ALA E 2 102 ? 51.472 -9.257 5.021 1.00 24.52 ? 102 ALA A CB 1 ATOM 938 N N . ASN E 2 103 ? 53.538 -8.500 7.137 1.00 19.28 ? 103 ASN A N 1 ATOM 939 C CA . ASN E 2 103 ? 54.086 -7.442 7.988 1.00 17.42 ? 103 ASN A CA 1 ATOM 940 C C . ASN E 2 103 ? 54.555 -6.439 6.972 1.00 18.55 ? 103 ASN A C 1 ATOM 941 O O . ASN E 2 103 ? 55.577 -6.642 6.279 1.00 17.85 ? 103 ASN A O 1 ATOM 942 C CB . ASN E 2 103 ? 55.255 -7.926 8.841 1.00 22.08 ? 103 ASN A CB 1 ATOM 943 C CG . ASN E 2 103 ? 54.794 -8.792 9.962 1.00 24.11 ? 103 ASN A CG 1 ATOM 944 O OD1 . ASN E 2 103 ? 54.740 -10.020 9.835 1.00 35.43 ? 103 ASN A OD1 1 ATOM 945 N ND2 . ASN E 2 103 ? 54.399 -8.180 11.043 1.00 22.54 ? 103 ASN A ND2 1 ATOM 946 N N . LYS E 2 104 ? 53.801 -5.364 6.832 1.00 16.30 ? 104 LYS A N 1 ATOM 947 C CA . LYS E 2 104 ? 54.099 -4.357 5.821 1.00 16.87 ? 104 LYS A CA 1 ATOM 948 C C . LYS E 2 104 ? 53.798 -2.959 6.316 1.00 12.50 ? 104 LYS A C 1 ATOM 949 O O . LYS E 2 104 ? 53.095 -2.773 7.304 1.00 14.77 ? 104 LYS A O 1 ATOM 950 C CB . LYS E 2 104 ? 53.215 -4.592 4.598 1.00 16.23 ? 104 LYS A CB 1 ATOM 951 C CG . LYS E 2 104 ? 53.478 -5.951 3.923 1.00 20.79 ? 104 LYS A CG 1 ATOM 952 C CD . LYS E 2 104 ? 52.748 -6.123 2.644 1.00 34.44 ? 104 LYS A CD 1 ATOM 953 C CE . LYS E 2 104 ? 53.480 -7.211 1.847 1.00 42.51 ? 104 LYS A CE 1 ATOM 954 N NZ . LYS E 2 104 ? 52.658 -7.844 0.759 1.00 44.81 ? 104 LYS A NZ 1 ATOM 955 N N . HIS E 2 105 ? 54.312 -1.966 5.612 1.00 15.07 ? 105 HIS A N 1 ATOM 956 C CA . HIS E 2 105 ? 53.945 -0.584 5.977 1.00 15.96 ? 105 HIS A CA 1 ATOM 957 C C . HIS E 2 105 ? 52.533 -0.353 5.419 1.00 16.10 ? 105 HIS A C 1 ATOM 958 O O . HIS E 2 105 ? 52.198 -0.813 4.325 1.00 18.55 ? 105 HIS A O 1 ATOM 959 C CB . HIS E 2 105 ? 54.883 0.417 5.317 1.00 17.13 ? 105 HIS A CB 1 ATOM 960 C CG . HIS E 2 105 ? 56.317 0.114 5.575 1.00 18.35 ? 105 HIS A CG 1 ATOM 961 N ND1 . HIS E 2 105 ? 57.009 0.651 6.636 1.00 21.01 ? 105 HIS A ND1 1 ATOM 962 C CD2 . HIS E 2 105 ? 57.178 -0.710 4.925 1.00 17.74 ? 105 HIS A CD2 1 ATOM 963 C CE1 . HIS E 2 105 ? 58.248 0.176 6.633 1.00 15.83 ? 105 HIS A CE1 1 ATOM 964 N NE2 . HIS E 2 105 ? 58.372 -0.646 5.613 1.00 21.28 ? 105 HIS A NE2 1 ATOM 965 N N . ILE E 2 106 ? 51.687 0.342 6.182 1.00 14.57 ? 106 ILE A N 1 ATOM 966 C CA . ILE E 2 106 ? 50.338 0.627 5.691 1.00 14.21 ? 106 ILE A CA 1 ATOM 967 C C . ILE E 2 106 ? 50.249 2.022 5.143 1.00 13.76 ? 106 ILE A C 1 ATOM 968 O O . ILE E 2 106 ? 51.046 2.903 5.558 1.00 14.72 ? 106 ILE A O 1 ATOM 969 C CB . ILE E 2 106 ? 49.256 0.417 6.798 1.00 12.43 ? 106 ILE A CB 1 ATOM 970 C CG1 . ILE E 2 106 ? 49.449 1.359 8.004 1.00 15.25 ? 106 ILE A CG1 1 ATOM 971 C CG2 . ILE E 2 106 ? 49.296 -1.094 7.235 1.00 14.09 ? 106 ILE A CG2 1 ATOM 972 C CD1 . ILE E 2 106 ? 48.148 1.487 8.848 1.00 17.90 ? 106 ILE A CD1 1 ATOM 973 N N . ILE E 2 107 ? 49.309 2.225 4.199 1.00 12.43 ? 107 ILE A N 1 ATOM 974 C CA . ILE E 2 107 ? 49.107 3.545 3.604 1.00 11.20 ? 107 ILE A CA 1 ATOM 975 C C . ILE E 2 107 ? 47.656 3.862 3.758 1.00 12.39 ? 107 ILE A C 1 ATOM 976 O O . ILE E 2 107 ? 46.831 3.136 3.286 1.00 12.60 ? 107 ILE A O 1 ATOM 977 C CB . ILE E 2 107 ? 49.480 3.585 2.124 1.00 14.17 ? 107 ILE A CB 1 ATOM 978 C CG1 . ILE E 2 107 ? 50.970 3.222 1.981 1.00 16.46 ? 107 ILE A CG1 1 ATOM 979 C CG2 . ILE E 2 107 ? 49.141 4.974 1.547 1.00 17.49 ? 107 ILE A CG2 1 ATOM 980 C CD1 . ILE E 2 107 ? 51.308 2.876 0.514 1.00 27.24 ? 107 ILE A CD1 1 ATOM 981 N N . VAL E 2 108 ? 47.356 4.932 4.471 1.00 13.31 ? 108 VAL A N 1 ATOM 982 C CA . VAL E 2 108 ? 45.950 5.291 4.733 1.00 14.35 ? 108 VAL A CA 1 ATOM 983 C C . VAL E 2 108 ? 45.694 6.751 4.373 1.00 18.17 ? 108 VAL A C 1 ATOM 984 O O . VAL E 2 108 ? 46.627 7.562 4.391 1.00 16.14 ? 108 VAL A O 1 ATOM 985 C CB . VAL E 2 108 ? 45.592 5.105 6.219 1.00 13.21 ? 108 VAL A CB 1 ATOM 986 C CG1 . VAL E 2 108 ? 45.732 3.596 6.617 1.00 11.82 ? 108 VAL A CG1 1 ATOM 987 C CG2 . VAL E 2 108 ? 46.548 5.927 7.131 1.00 15.93 ? 108 VAL A CG2 1 ATOM 988 N N . ALA E 2 109 ? 44.440 7.076 4.049 1.00 13.36 ? 109 ALA A N 1 ATOM 989 C CA . ALA E 2 109 ? 44.071 8.482 3.759 1.00 14.16 ? 109 ALA A CA 1 ATOM 990 C C . ALA E 2 109 ? 43.577 9.029 5.091 1.00 13.73 ? 109 ALA A C 1 ATOM 991 O O . ALA E 2 109 ? 42.818 8.343 5.808 1.00 15.16 ? 109 ALA A O 1 ATOM 992 C CB . ALA E 2 109 ? 42.941 8.549 2.721 1.00 15.05 ? 109 ALA A CB 1 ATOM 993 N N . CYS E 2 110 ? 43.998 10.249 5.411 1.00 13.82 ? 110 CYS A N 1 ATOM 994 C CA . CYS E 2 110 ? 43.631 10.842 6.717 1.00 13.73 ? 110 CYS A CA 1 ATOM 995 C C . CYS E 2 110 ? 42.856 12.131 6.550 1.00 17.86 ? 110 CYS A C 1 ATOM 996 O O . CYS E 2 110 ? 43.126 12.900 5.634 1.00 19.22 ? 110 CYS A O 1 ATOM 997 C CB . CYS E 2 110 ? 44.895 11.161 7.478 1.00 16.53 ? 110 CYS A CB 1 ATOM 998 S SG . CYS E 2 110 ? 45.806 9.634 7.972 1.00 21.41 ? 110 CYS A SG 1 ATOM 999 N N . GLU E 2 111 ? 41.894 12.371 7.436 1.00 18.03 ? 111 GLU A N 1 ATOM 1000 C CA . GLU E 2 111 ? 41.117 13.620 7.394 1.00 15.04 ? 111 GLU A CA 1 ATOM 1001 C C . GLU E 2 111 ? 41.030 14.175 8.795 1.00 15.58 ? 111 GLU A C 1 ATOM 1002 O O . GLU E 2 111 ? 41.038 13.448 9.788 1.00 14.87 ? 111 GLU A O 1 ATOM 1003 C CB . GLU E 2 111 ? 39.698 13.420 6.825 1.00 16.09 ? 111 GLU A CB 1 ATOM 1004 C CG . GLU E 2 111 ? 39.768 13.049 5.332 1.00 20.59 ? 111 GLU A CG 1 ATOM 1005 C CD . GLU E 2 111 ? 38.407 12.827 4.683 1.00 29.27 ? 111 GLU A CD 1 ATOM 1006 O OE1 . GLU E 2 111 ? 37.373 12.782 5.390 1.00 32.07 ? 111 GLU A OE1 1 ATOM 1007 O OE2 . GLU E 2 111 ? 38.398 12.679 3.440 1.00 30.13 ? 111 GLU A OE2 1 ATOM 1008 N N . GLY E 2 112 ? 40.911 15.502 8.842 1.00 14.23 ? 112 GLY A N 1 ATOM 1009 C CA . GLY E 2 112 ? 40.834 16.178 10.146 1.00 14.03 ? 112 GLY A CA 1 ATOM 1010 C C . GLY E 2 112 ? 40.661 17.676 9.825 1.00 19.32 ? 112 GLY A C 1 ATOM 1011 O O . GLY E 2 112 ? 40.388 18.017 8.685 1.00 17.54 ? 112 GLY A O 1 ATOM 1012 N N . ASN E 2 113 ? 40.800 18.533 10.834 1.00 16.99 ? 113 ASN A N 1 ATOM 1013 C CA . ASN E 2 113 ? 40.715 20.015 10.665 1.00 17.32 ? 113 ASN A CA 1 ATOM 1014 C C . ASN E 2 113 ? 41.874 20.571 11.545 1.00 15.68 ? 113 ASN A C 1 ATOM 1015 O O . ASN E 2 113 ? 42.162 20.098 12.640 1.00 15.06 ? 113 ASN A O 1 ATOM 1016 C CB . ASN E 2 113 ? 39.357 20.561 11.154 1.00 15.80 ? 113 ASN A CB 1 ATOM 1017 C CG . ASN E 2 113 ? 38.223 20.206 10.218 1.00 25.07 ? 113 ASN A CG 1 ATOM 1018 O OD1 . ASN E 2 113 ? 38.266 20.544 9.029 1.00 24.48 ? 113 ASN A OD1 1 ATOM 1019 N ND2 . ASN E 2 113 ? 37.189 19.546 10.751 1.00 23.96 ? 113 ASN A ND2 1 ATOM 1020 N N . PRO E 2 114 ? 42.609 21.575 11.027 1.00 16.38 ? 114 PRO A N 1 ATOM 1021 C CA . PRO E 2 114 ? 43.724 22.153 11.770 1.00 14.84 ? 114 PRO A CA 1 ATOM 1022 C C . PRO E 2 114 ? 43.215 22.841 13.025 1.00 13.55 ? 114 PRO A C 1 ATOM 1023 O O . PRO E 2 114 ? 42.054 23.222 13.093 1.00 16.35 ? 114 PRO A O 1 ATOM 1024 C CB . PRO E 2 114 ? 44.391 23.101 10.733 1.00 16.34 ? 114 PRO A CB 1 ATOM 1025 C CG . PRO E 2 114 ? 43.205 23.575 9.950 1.00 17.28 ? 114 PRO A CG 1 ATOM 1026 C CD . PRO E 2 114 ? 42.415 22.258 9.736 1.00 21.41 ? 114 PRO A CD 1 ATOM 1027 N N . TYR E 2 115 ? 44.102 22.942 13.991 1.00 15.08 ? 115 TYR A N 1 ATOM 1028 C CA . TYR E 2 115 ? 43.820 23.542 15.304 1.00 15.64 ? 115 TYR A CA 1 ATOM 1029 C C . TYR E 2 115 ? 43.965 25.071 15.069 1.00 14.45 ? 115 TYR A C 1 ATOM 1030 O O . TYR E 2 115 ? 45.078 25.585 14.930 1.00 15.78 ? 115 TYR A O 1 ATOM 1031 C CB . TYR E 2 115 ? 44.857 22.984 16.294 1.00 16.62 ? 115 TYR A CB 1 ATOM 1032 C CG . TYR E 2 115 ? 44.543 23.207 17.770 1.00 15.13 ? 115 TYR A CG 1 ATOM 1033 C CD1 . TYR E 2 115 ? 43.446 22.600 18.374 1.00 17.40 ? 115 TYR A CD1 1 ATOM 1034 C CD2 . TYR E 2 115 ? 45.378 24.018 18.549 1.00 20.07 ? 115 TYR A CD2 1 ATOM 1035 C CE1 . TYR E 2 115 ? 43.181 22.792 19.773 1.00 19.56 ? 115 TYR A CE1 1 ATOM 1036 C CE2 . TYR E 2 115 ? 45.122 24.215 19.923 1.00 17.53 ? 115 TYR A CE2 1 ATOM 1037 C CZ . TYR E 2 115 ? 44.016 23.579 20.523 1.00 21.80 ? 115 TYR A CZ 1 ATOM 1038 O OH . TYR E 2 115 ? 43.754 23.715 21.893 1.00 21.95 ? 115 TYR A OH 1 ATOM 1039 N N . VAL E 2 116 ? 42.809 25.755 15.061 1.00 11.73 ? 116 VAL A N 1 ATOM 1040 C CA . VAL E 2 116 ? 42.823 27.187 14.740 1.00 11.75 ? 116 VAL A CA 1 ATOM 1041 C C . VAL E 2 116 ? 41.926 27.979 15.690 1.00 11.85 ? 116 VAL A C 1 ATOM 1042 O O . VAL E 2 116 ? 41.119 27.437 16.411 1.00 12.41 ? 116 VAL A O 1 ATOM 1043 C CB . VAL E 2 116 ? 42.341 27.448 13.306 1.00 12.10 ? 116 VAL A CB 1 ATOM 1044 C CG1 . VAL E 2 116 ? 43.312 26.798 12.306 1.00 14.19 ? 116 VAL A CG1 1 ATOM 1045 C CG2 . VAL E 2 116 ? 40.893 26.939 13.097 1.00 12.65 ? 116 VAL A CG2 1 ATOM 1046 N N . PRO E 2 117 ? 42.036 29.318 15.623 1.00 13.47 ? 117 PRO A N 1 ATOM 1047 C CA . PRO E 2 117 ? 41.187 30.118 16.518 1.00 11.59 ? 117 PRO A CA 1 ATOM 1048 C C . PRO E 2 117 ? 39.694 30.019 16.115 1.00 13.06 ? 117 PRO A C 1 ATOM 1049 O O . PRO E 2 117 ? 39.327 30.096 14.919 1.00 13.77 ? 117 PRO A O 1 ATOM 1050 C CB . PRO E 2 117 ? 41.698 31.557 16.285 1.00 12.65 ? 117 PRO A CB 1 ATOM 1051 C CG . PRO E 2 117 ? 43.141 31.390 15.855 1.00 14.41 ? 117 PRO A CG 1 ATOM 1052 C CD . PRO E 2 117 ? 42.988 30.167 14.889 1.00 12.98 ? 117 PRO A CD 1 ATOM 1053 N N . VAL E 2 118 ? 38.836 29.832 17.118 1.00 12.67 ? 118 VAL A N 1 ATOM 1054 C CA . VAL E 2 118 ? 37.408 29.808 16.911 1.00 14.53 ? 118 VAL A CA 1 ATOM 1055 C C . VAL E 2 118 ? 36.644 30.814 17.731 1.00 13.60 ? 118 VAL A C 1 ATOM 1056 O O . VAL E 2 118 ? 35.484 31.113 17.438 1.00 16.88 ? 118 VAL A O 1 ATOM 1057 C CB . VAL E 2 118 ? 36.786 28.422 17.131 1.00 13.61 ? 118 VAL A CB 1 ATOM 1058 C CG1 . VAL E 2 118 ? 37.335 27.463 16.043 1.00 13.64 ? 118 VAL A CG1 1 ATOM 1059 C CG2 . VAL E 2 118 ? 37.060 27.888 18.499 1.00 14.73 ? 118 VAL A CG2 1 ATOM 1060 N N . HIS E 2 119 ? 37.291 31.380 18.733 1.00 13.26 ? 119 HIS A N 1 ATOM 1061 C CA . HIS E 2 119 ? 36.614 32.454 19.482 1.00 13.62 ? 119 HIS A CA 1 ATOM 1062 C C . HIS E 2 119 ? 37.676 33.421 19.967 1.00 12.63 ? 119 HIS A C 1 ATOM 1063 O O . HIS E 2 119 ? 38.819 33.042 20.212 1.00 12.10 ? 119 HIS A O 1 ATOM 1064 C CB . HIS E 2 119 ? 35.929 31.936 20.759 1.00 16.15 ? 119 HIS A CB 1 ATOM 1065 C CG . HIS E 2 119 ? 35.001 30.796 20.568 1.00 19.29 ? 119 HIS A CG 1 ATOM 1066 N ND1 . HIS E 2 119 ? 33.865 30.869 19.787 1.00 24.05 ? 119 HIS A ND1 1 ATOM 1067 C CD2 . HIS E 2 119 ? 35.033 29.535 21.077 1.00 22.99 ? 119 HIS A CD2 1 ATOM 1068 C CE1 . HIS E 2 119 ? 33.251 29.697 19.806 1.00 26.28 ? 119 HIS A CE1 1 ATOM 1069 N NE2 . HIS E 2 119 ? 33.936 28.870 20.577 1.00 26.80 ? 119 HIS A NE2 1 ATOM 1070 N N . PHE E 2 120 ? 37.302 34.701 20.128 1.00 12.43 ? 120 PHE A N 1 ATOM 1071 C CA . PHE E 2 120 ? 38.245 35.667 20.655 1.00 13.72 ? 120 PHE A CA 1 ATOM 1072 C C . PHE E 2 120 ? 37.862 35.804 22.115 1.00 14.84 ? 120 PHE A C 1 ATOM 1073 O O . PHE E 2 120 ? 36.675 36.055 22.434 1.00 13.33 ? 120 PHE A O 1 ATOM 1074 C CB . PHE E 2 120 ? 38.096 36.992 19.961 1.00 13.55 ? 120 PHE A CB 1 ATOM 1075 C CG . PHE E 2 120 ? 39.177 37.934 20.305 1.00 13.58 ? 120 PHE A CG 1 ATOM 1076 C CD1 . PHE E 2 120 ? 39.108 38.686 21.500 1.00 10.16 ? 120 PHE A CD1 1 ATOM 1077 C CD2 . PHE E 2 120 ? 40.297 38.048 19.495 1.00 13.50 ? 120 PHE A CD2 1 ATOM 1078 C CE1 . PHE E 2 120 ? 40.176 39.542 21.853 1.00 11.84 ? 120 PHE A CE1 1 ATOM 1079 C CE2 . PHE E 2 120 ? 41.384 38.884 19.851 1.00 11.03 ? 120 PHE A CE2 1 ATOM 1080 C CZ . PHE E 2 120 ? 41.338 39.638 21.026 1.00 14.45 ? 120 PHE A CZ 1 ATOM 1081 N N . ASP E 2 121 ? 38.829 35.633 23.010 1.00 12.48 ? 121 ASP A N 1 ATOM 1082 C CA . ASP E 2 121 ? 38.474 35.629 24.420 1.00 14.96 ? 121 ASP A CA 1 ATOM 1083 C C . ASP E 2 121 ? 38.670 36.940 25.135 1.00 16.19 ? 121 ASP A C 1 ATOM 1084 O O . ASP E 2 121 ? 37.753 37.405 25.830 1.00 18.27 ? 121 ASP A O 1 ATOM 1085 C CB . ASP E 2 121 ? 39.263 34.535 25.158 1.00 14.80 ? 121 ASP A CB 1 ATOM 1086 C CG . ASP E 2 121 ? 38.536 33.992 26.393 1.00 18.14 ? 121 ASP A CG 1 ATOM 1087 O OD1 . ASP E 2 121 ? 37.346 33.602 26.285 1.00 17.35 ? 121 ASP A OD1 1 ATOM 1088 O OD2 . ASP E 2 121 ? 39.193 33.938 27.452 1.00 19.22 ? 121 ASP A OD2 1 ATOM 1089 N N . ALA E 2 122 ? 39.829 37.547 24.943 1.00 12.59 ? 122 ALA A N 1 ATOM 1090 C CA . ALA E 2 122 ? 40.196 38.759 25.665 1.00 14.24 ? 122 ALA A CA 1 ATOM 1091 C C . ALA E 2 122 ? 41.577 39.187 25.198 1.00 16.21 ? 122 ALA A C 1 ATOM 1092 O O . ALA E 2 122 ? 42.183 38.547 24.364 1.00 16.25 ? 122 ALA A O 1 ATOM 1093 C CB . ALA E 2 122 ? 40.273 38.398 27.193 1.00 15.60 ? 122 ALA A CB 1 ATOM 1094 N N . SER E 2 123 ? 42.079 40.316 25.687 1.00 14.92 ? 123 SER A N 1 ATOM 1095 C CA . SER E 2 123 ? 43.452 40.709 25.338 1.00 13.44 ? 123 SER A CA 1 ATOM 1096 C C . SER E 2 123 ? 44.071 41.176 26.626 1.00 18.25 ? 123 SER A C 1 ATOM 1097 O O . SER E 2 123 ? 43.348 41.514 27.597 1.00 18.61 ? 123 SER A O 1 ATOM 1098 C CB A SER E 2 123 ? 43.479 41.839 24.304 0.47 13.13 ? 123 SER A CB 1 ATOM 1099 C CB B SER E 2 123 ? 43.331 41.947 24.439 0.53 21.60 ? 123 SER A CB 1 ATOM 1100 O OG A SER E 2 123 ? 42.832 43.024 24.765 0.47 10.43 ? 123 SER A OG 1 ATOM 1101 O OG B SER E 2 123 ? 43.065 41.488 23.127 0.53 26.48 ? 123 SER A OG 1 ATOM 1102 N N . VAL E 2 124 ? 45.396 41.215 26.662 1.00 17.90 ? 124 VAL A N 1 ATOM 1103 C CA . VAL E 2 124 ? 46.063 41.619 27.894 1.00 17.14 ? 124 VAL A CA 1 ATOM 1104 C C . VAL E 2 124 ? 47.398 42.206 27.589 1.00 22.00 ? 124 VAL A C 1 ATOM 1105 O O . VAL E 2 124 ? 48.069 41.859 26.583 1.00 22.50 ? 124 VAL A O 1 ATOM 1106 C CB A VAL E 2 124 ? 46.145 40.356 28.886 0.66 16.28 ? 124 VAL A CB 1 ATOM 1107 C CB B VAL E 2 124 ? 46.414 40.439 28.888 0.34 23.88 ? 124 VAL A CB 1 ATOM 1108 C CG1 A VAL E 2 124 ? 47.020 39.231 28.287 0.66 18.63 ? 124 VAL A CG1 1 ATOM 1109 C CG1 B VAL E 2 124 ? 45.146 39.682 29.236 0.34 25.71 ? 124 VAL A CG1 1 ATOM 1110 C CG2 A VAL E 2 124 ? 46.687 40.756 30.260 0.66 20.36 ? 124 VAL A CG2 1 ATOM 1111 C CG2 B VAL E 2 124 ? 47.418 39.508 28.226 0.34 25.39 ? 124 VAL A CG2 1 ATOM 1112 O OXT . VAL E 2 124 ? 47.854 43.069 28.423 1.00 24.63 ? 124 VAL A OXT 1 ATOM 1113 N N . LYS F 2 1 ? 26.111 27.006 7.564 1.00 43.40 ? 201 LYS B N 1 ATOM 1114 C CA . LYS F 2 1 ? 27.164 26.277 6.802 1.00 43.79 ? 201 LYS B CA 1 ATOM 1115 C C . LYS F 2 1 ? 28.514 26.930 7.081 1.00 39.16 ? 201 LYS B C 1 ATOM 1116 O O . LYS F 2 1 ? 29.554 26.359 6.768 1.00 42.50 ? 201 LYS B O 1 ATOM 1117 C CB . LYS F 2 1 ? 26.902 26.323 5.297 1.00 45.01 ? 201 LYS B CB 1 ATOM 1118 C CG . LYS F 2 1 ? 27.932 25.527 4.473 1.00 50.40 ? 201 LYS B CG 1 ATOM 1119 C CD . LYS F 2 1 ? 27.789 25.799 2.973 1.00 54.06 ? 201 LYS B CD 1 ATOM 1120 C CE . LYS F 2 1 ? 28.741 24.949 2.147 1.00 58.66 ? 201 LYS B CE 1 ATOM 1121 N NZ . LYS F 2 1 ? 28.395 23.496 2.256 1.00 59.80 ? 201 LYS B NZ 1 ATOM 1122 N N . GLU F 2 2 ? 28.501 28.148 7.615 1.00 32.46 ? 202 GLU B N 1 ATOM 1123 C CA . GLU F 2 2 ? 29.770 28.801 7.965 1.00 28.80 ? 202 GLU B CA 1 ATOM 1124 C C . GLU F 2 2 ? 30.537 27.952 9.004 1.00 22.75 ? 202 GLU B C 1 ATOM 1125 O O . GLU F 2 2 ? 29.963 27.526 9.999 1.00 23.65 ? 202 GLU B O 1 ATOM 1126 C CB . GLU F 2 2 ? 29.482 30.196 8.526 1.00 26.79 ? 202 GLU B CB 1 ATOM 1127 C CG . GLU F 2 2 ? 30.694 31.017 8.851 1.00 26.57 ? 202 GLU B CG 1 ATOM 1128 C CD . GLU F 2 2 ? 30.325 32.370 9.450 1.00 18.74 ? 202 GLU B CD 1 ATOM 1129 O OE1 . GLU F 2 2 ? 29.464 32.440 10.379 1.00 24.62 ? 202 GLU B OE1 1 ATOM 1130 O OE2 . GLU F 2 2 ? 30.916 33.345 8.994 1.00 23.98 ? 202 GLU B OE2 1 ATOM 1131 N N . THR F 2 3 ? 31.815 27.667 8.749 1.00 25.29 ? 203 THR B N 1 ATOM 1132 C CA . THR F 2 3 ? 32.574 26.887 9.713 1.00 18.99 ? 203 THR B CA 1 ATOM 1133 C C . THR F 2 3 ? 32.950 27.823 10.878 1.00 24.08 ? 203 THR B C 1 ATOM 1134 O O . THR F 2 3 ? 32.914 29.049 10.715 1.00 20.24 ? 203 THR B O 1 ATOM 1135 C CB . THR F 2 3 ? 33.897 26.345 9.148 1.00 22.02 ? 203 THR B CB 1 ATOM 1136 O OG1 . THR F 2 3 ? 34.756 27.443 8.866 1.00 21.91 ? 203 THR B OG1 1 ATOM 1137 C CG2 . THR F 2 3 ? 33.657 25.553 7.832 1.00 21.90 ? 203 THR B CG2 1 ATOM 1138 N N . ALA F 2 4 ? 33.321 27.233 12.011 1.00 18.53 ? 204 ALA B N 1 ATOM 1139 C CA . ALA F 2 4 ? 33.681 28.023 13.213 1.00 17.08 ? 204 ALA B CA 1 ATOM 1140 C C . ALA F 2 4 ? 34.917 28.822 12.881 1.00 17.72 ? 204 ALA B C 1 ATOM 1141 O O . ALA F 2 4 ? 35.051 29.969 13.328 1.00 17.75 ? 204 ALA B O 1 ATOM 1142 C CB . ALA F 2 4 ? 33.934 27.097 14.417 1.00 17.67 ? 204 ALA B CB 1 ATOM 1143 N N . ALA F 2 5 ? 35.823 28.232 12.128 1.00 17.74 ? 205 ALA B N 1 ATOM 1144 C CA . ALA F 2 5 ? 37.017 28.972 11.719 1.00 16.66 ? 205 ALA B CA 1 ATOM 1145 C C . ALA F 2 5 ? 36.676 30.165 10.861 1.00 17.58 ? 205 ALA B C 1 ATOM 1146 O O . ALA F 2 5 ? 37.264 31.242 11.026 1.00 16.76 ? 205 ALA B O 1 ATOM 1147 C CB . ALA F 2 5 ? 38.037 28.032 10.937 1.00 16.59 ? 205 ALA B CB 1 ATOM 1148 N N . ALA F 2 6 ? 35.709 30.023 9.948 1.00 16.48 ? 206 ALA B N 1 ATOM 1149 C CA . ALA F 2 6 ? 35.383 31.159 9.095 1.00 16.42 ? 206 ALA B CA 1 ATOM 1150 C C . ALA F 2 6 ? 34.621 32.228 9.887 1.00 14.84 ? 206 ALA B C 1 ATOM 1151 O O . ALA F 2 6 ? 34.765 33.407 9.593 1.00 17.30 ? 206 ALA B O 1 ATOM 1152 C CB . ALA F 2 6 ? 34.526 30.675 7.854 1.00 20.30 ? 206 ALA B CB 1 ATOM 1153 N N . LYS F 2 7 ? 33.812 31.790 10.845 1.00 13.23 ? 207 LYS B N 1 ATOM 1154 C CA . LYS F 2 7 ? 33.081 32.731 11.704 1.00 12.67 ? 207 LYS B CA 1 ATOM 1155 C C . LYS F 2 7 ? 34.125 33.577 12.488 1.00 13.50 ? 207 LYS B C 1 ATOM 1156 O O . LYS F 2 7 ? 33.960 34.789 12.616 1.00 14.28 ? 207 LYS B O 1 ATOM 1157 C CB . LYS F 2 7 ? 32.189 31.997 12.674 1.00 14.53 ? 207 LYS B CB 1 ATOM 1158 C CG . LYS F 2 7 ? 31.486 32.944 13.651 1.00 19.42 ? 207 LYS B CG 1 ATOM 1159 C CD . LYS F 2 7 ? 30.420 32.214 14.464 1.00 22.05 ? 207 LYS B CD 1 ATOM 1160 C CE . LYS F 2 7 ? 29.685 33.207 15.375 1.00 25.43 ? 207 LYS B CE 1 ATOM 1161 N NZ . LYS F 2 7 ? 28.509 32.576 16.108 1.00 28.10 ? 207 LYS B NZ 1 ATOM 1162 N N . PHE F 2 8 ? 35.220 32.962 12.953 1.00 11.47 ? 208 PHE B N 1 ATOM 1163 C CA . PHE F 2 8 ? 36.251 33.773 13.667 1.00 10.05 ? 208 PHE B CA 1 ATOM 1164 C C . PHE F 2 8 ? 36.885 34.803 12.720 1.00 15.45 ? 208 PHE B C 1 ATOM 1165 O O . PHE F 2 8 ? 37.165 35.935 13.099 1.00 12.37 ? 208 PHE B O 1 ATOM 1166 C CB . PHE F 2 8 ? 37.345 32.849 14.257 1.00 11.64 ? 208 PHE B CB 1 ATOM 1167 C CG . PHE F 2 8 ? 38.491 33.574 14.888 1.00 12.28 ? 208 PHE B CG 1 ATOM 1168 C CD1 . PHE F 2 8 ? 39.552 34.055 14.120 1.00 11.04 ? 208 PHE B CD1 1 ATOM 1169 C CD2 . PHE F 2 8 ? 38.474 33.814 16.263 1.00 11.92 ? 208 PHE B CD2 1 ATOM 1170 C CE1 . PHE F 2 8 ? 40.611 34.790 14.683 1.00 10.86 ? 208 PHE B CE1 1 ATOM 1171 C CE2 . PHE F 2 8 ? 39.496 34.549 16.856 1.00 10.71 ? 208 PHE B CE2 1 ATOM 1172 C CZ . PHE F 2 8 ? 40.556 35.038 16.086 1.00 10.42 ? 208 PHE B CZ 1 ATOM 1173 N N . GLU F 2 9 ? 37.167 34.400 11.485 1.00 13.71 ? 209 GLU B N 1 ATOM 1174 C CA . GLU F 2 9 ? 37.758 35.365 10.545 1.00 12.26 ? 209 GLU B CA 1 ATOM 1175 C C . GLU F 2 9 ? 36.777 36.528 10.306 1.00 13.74 ? 209 GLU B C 1 ATOM 1176 O O . GLU F 2 9 ? 37.168 37.696 10.285 1.00 14.13 ? 209 GLU B O 1 ATOM 1177 C CB . GLU F 2 9 ? 38.063 34.657 9.195 1.00 13.27 ? 209 GLU B CB 1 ATOM 1178 C CG . GLU F 2 9 ? 39.247 33.672 9.296 1.00 15.13 ? 209 GLU B CG 1 ATOM 1179 C CD . GLU F 2 9 ? 39.487 32.893 8.019 1.00 17.67 ? 209 GLU B CD 1 ATOM 1180 O OE1 . GLU F 2 9 ? 38.932 33.330 6.986 1.00 24.24 ? 209 GLU B OE1 1 ATOM 1181 O OE2 . GLU F 2 9 ? 40.224 31.864 8.054 1.00 17.17 ? 209 GLU B OE2 1 ATOM 1182 N N . ARG F 2 10 ? 35.506 36.197 10.090 1.00 13.73 ? 210 ARG B N 1 ATOM 1183 C CA . ARG F 2 10 ? 34.493 37.206 9.838 1.00 13.26 ? 210 ARG B CA 1 ATOM 1184 C C . ARG F 2 10 ? 34.366 38.156 10.996 1.00 15.77 ? 210 ARG B C 1 ATOM 1185 O O . ARG F 2 10 ? 34.288 39.352 10.793 1.00 14.15 ? 210 ARG B O 1 ATOM 1186 C CB . ARG F 2 10 ? 33.122 36.586 9.607 1.00 17.20 ? 210 ARG B CB 1 ATOM 1187 C CG . ARG F 2 10 ? 31.999 37.621 9.510 1.00 16.89 ? 210 ARG B CG 1 ATOM 1188 C CD . ARG F 2 10 ? 30.665 36.957 9.026 1.00 15.52 ? 210 ARG B CD 1 ATOM 1189 N NE . ARG F 2 10 ? 30.214 35.846 9.874 1.00 18.30 ? 210 ARG B NE 1 ATOM 1190 C CZ . ARG F 2 10 ? 29.500 35.981 10.992 1.00 17.19 ? 210 ARG B CZ 1 ATOM 1191 N NH1 . ARG F 2 10 ? 29.142 37.204 11.415 1.00 20.04 ? 210 ARG B NH1 1 ATOM 1192 N NH2 . ARG F 2 10 ? 29.116 34.907 11.701 1.00 18.33 ? 210 ARG B NH2 1 ATOM 1193 N N . GLN F 2 11 ? 34.333 37.630 12.221 1.00 13.85 ? 211 GLN B N 1 ATOM 1194 C CA . GLN F 2 11 ? 34.166 38.521 13.357 1.00 14.59 ? 211 GLN B CA 1 ATOM 1195 C C . GLN F 2 11 ? 35.415 39.242 13.848 1.00 15.66 ? 211 GLN B C 1 ATOM 1196 O O . GLN F 2 11 ? 35.309 40.295 14.488 1.00 13.90 ? 211 GLN B O 1 ATOM 1197 C CB . GLN F 2 11 ? 33.652 37.721 14.567 1.00 14.46 ? 211 GLN B CB 1 ATOM 1198 C CG . GLN F 2 11 ? 32.305 37.016 14.353 1.00 13.79 ? 211 GLN B CG 1 ATOM 1199 C CD . GLN F 2 11 ? 31.732 36.632 15.703 1.00 20.63 ? 211 GLN B CD 1 ATOM 1200 O OE1 . GLN F 2 11 ? 30.851 37.301 16.223 1.00 19.97 ? 211 GLN B OE1 1 ATOM 1201 N NE2 . GLN F 2 11 ? 32.262 35.583 16.288 1.00 16.95 ? 211 GLN B NE2 1 ATOM 1202 N N . HIS F 2 12 ? 36.581 38.684 13.542 1.00 13.68 ? 212 HIS B N 1 ATOM 1203 C CA . HIS F 2 12 ? 37.787 39.242 14.160 1.00 13.65 ? 212 HIS B CA 1 ATOM 1204 C C . HIS F 2 12 ? 38.967 39.585 13.339 1.00 12.54 ? 212 HIS B C 1 ATOM 1205 O O . HIS F 2 12 ? 39.902 40.230 13.839 1.00 14.12 ? 212 HIS B O 1 ATOM 1206 C CB . HIS F 2 12 ? 38.260 38.265 15.265 1.00 14.08 ? 212 HIS B CB 1 ATOM 1207 C CG . HIS F 2 12 ? 37.188 37.905 16.243 1.00 12.07 ? 212 HIS B CG 1 ATOM 1208 N ND1 . HIS F 2 12 ? 36.652 38.844 17.097 1.00 10.90 ? 212 HIS B ND1 1 ATOM 1209 C CD2 . HIS F 2 12 ? 36.554 36.740 16.516 1.00 11.14 ? 212 HIS B CD2 1 ATOM 1210 C CE1 . HIS F 2 12 ? 35.726 38.270 17.851 1.00 9.86 ? 212 HIS B CE1 1 ATOM 1211 N NE2 . HIS F 2 12 ? 35.653 36.995 17.521 1.00 13.50 ? 212 HIS B NE2 1 ATOM 1212 N N . MET F 2 13 ? 39.000 39.130 12.078 1.00 13.94 ? 213 MET B N 1 ATOM 1213 C CA . MET F 2 13 ? 40.195 39.422 11.291 1.00 10.94 ? 213 MET B CA 1 ATOM 1214 C C . MET F 2 13 ? 40.070 40.625 10.391 1.00 15.84 ? 213 MET B C 1 ATOM 1215 O O . MET F 2 13 ? 39.073 40.780 9.719 1.00 14.24 ? 213 MET B O 1 ATOM 1216 C CB . MET F 2 13 ? 40.540 38.216 10.377 1.00 13.06 ? 213 MET B CB 1 ATOM 1217 C CG . MET F 2 13 ? 41.107 36.978 11.113 1.00 13.33 ? 213 MET B CG 1 ATOM 1218 S SD . MET F 2 13 ? 42.671 37.332 11.924 1.00 14.59 ? 213 MET B SD 1 ATOM 1219 C CE . MET F 2 13 ? 43.781 37.852 10.556 1.00 14.32 ? 213 MET B CE 1 ATOM 1220 N N . ASP F 2 14 ? 41.086 41.458 10.397 1.00 11.49 ? 214 ASP B N 1 ATOM 1221 C CA . ASP F 2 14 ? 41.144 42.567 9.421 1.00 13.07 ? 214 ASP B CA 1 ATOM 1222 C C . ASP F 2 14 ? 42.622 42.876 9.116 1.00 14.64 ? 214 ASP B C 1 ATOM 1223 O O . ASP F 2 14 ? 43.189 43.872 9.531 1.00 13.58 ? 214 ASP B O 1 ATOM 1224 C CB . ASP F 2 14 ? 40.417 43.828 9.922 1.00 14.19 ? 214 ASP B CB 1 ATOM 1225 C CG . ASP F 2 14 ? 40.279 44.861 8.790 1.00 24.40 ? 214 ASP B CG 1 ATOM 1226 O OD1 . ASP F 2 14 ? 40.544 44.430 7.642 1.00 20.92 ? 214 ASP B OD1 1 ATOM 1227 O OD2 . ASP F 2 14 ? 39.929 46.053 9.017 1.00 19.31 ? 214 ASP B OD2 1 ATOM 1228 N N . SER F 2 15 ? 43.261 41.970 8.368 1.00 12.88 ? 215 SER B N 1 ATOM 1229 C CA . SER F 2 15 ? 44.638 42.138 8.052 1.00 13.42 ? 215 SER B CA 1 ATOM 1230 C C . SER F 2 15 ? 44.891 43.144 6.973 1.00 13.78 ? 215 SER B C 1 ATOM 1231 O O . SER F 2 15 ? 46.067 43.466 6.717 1.00 15.76 ? 215 SER B O 1 ATOM 1232 C CB . SER F 2 15 ? 45.269 40.782 7.669 1.00 15.48 ? 215 SER B CB 1 ATOM 1233 O OG . SER F 2 15 ? 44.766 40.331 6.421 1.00 14.04 ? 215 SER B OG 1 ATOM 1234 N N . SER F 2 16 ? 43.827 43.690 6.389 1.00 14.57 ? 216 SER B N 1 ATOM 1235 C CA . SER F 2 16 ? 44.042 44.634 5.288 1.00 15.28 ? 216 SER B CA 1 ATOM 1236 C C . SER F 2 16 ? 44.517 45.994 5.733 1.00 17.45 ? 216 SER B C 1 ATOM 1237 O O . SER F 2 16 ? 44.928 46.814 4.901 1.00 21.77 ? 216 SER B O 1 ATOM 1238 C CB . SER F 2 16 ? 42.744 44.817 4.478 1.00 16.29 ? 216 SER B CB 1 ATOM 1239 O OG . SER F 2 16 ? 41.813 45.634 5.166 1.00 21.10 ? 216 SER B OG 1 ATOM 1240 N N . THR F 2 17 ? 44.466 46.254 7.023 1.00 16.42 ? 217 THR B N 1 ATOM 1241 C CA . THR F 2 17 ? 44.890 47.545 7.543 1.00 17.01 ? 217 THR B CA 1 ATOM 1242 C C . THR F 2 17 ? 45.750 47.312 8.782 1.00 19.16 ? 217 THR B C 1 ATOM 1243 O O . THR F 2 17 ? 45.598 46.275 9.453 1.00 18.59 ? 217 THR B O 1 ATOM 1244 C CB . THR F 2 17 ? 43.671 48.405 7.916 1.00 20.70 ? 217 THR B CB 1 ATOM 1245 O OG1 . THR F 2 17 ? 44.136 49.719 8.221 1.00 27.45 ? 217 THR B OG1 1 ATOM 1246 C CG2 . THR F 2 17 ? 42.943 47.883 9.149 1.00 19.81 ? 217 THR B CG2 1 ATOM 1247 N N . SER F 2 18 ? 46.635 48.260 9.070 1.00 19.68 ? 218 SER B N 1 ATOM 1248 C CA . SER F 2 18 ? 47.544 48.115 10.234 1.00 18.70 ? 218 SER B CA 1 ATOM 1249 C C . SER F 2 18 ? 46.971 48.556 11.566 1.00 21.70 ? 218 SER B C 1 ATOM 1250 O O . SER F 2 18 ? 47.529 48.217 12.637 1.00 19.50 ? 218 SER B O 1 ATOM 1251 C CB A SER F 2 18 ? 48.859 48.850 9.961 0.61 20.76 ? 218 SER B CB 1 ATOM 1252 C CB B SER F 2 18 ? 48.868 48.766 10.094 0.39 19.58 ? 218 SER B CB 1 ATOM 1253 O OG A SER F 2 18 ? 48.606 50.241 9.799 0.61 23.53 ? 218 SER B OG 1 ATOM 1254 O OG B SER F 2 18 ? 49.532 48.339 8.933 0.39 23.04 ? 218 SER B OG 1 ATOM 1255 N N . ALA F 2 19 ? 45.861 49.291 11.497 1.00 19.10 ? 219 ALA B N 1 ATOM 1256 C CA . ALA F 2 19 ? 45.159 49.804 12.678 1.00 19.27 ? 219 ALA B CA 1 ATOM 1257 C C . ALA F 2 19 ? 43.869 50.455 12.157 1.00 20.71 ? 219 ALA B C 1 ATOM 1258 O O . ALA F 2 19 ? 43.727 50.707 10.960 1.00 23.94 ? 219 ALA B O 1 ATOM 1259 C CB . ALA F 2 19 ? 46.012 50.887 13.374 1.00 20.19 ? 219 ALA B CB 1 ATOM 1260 N N . ALA F 2 20 ? 42.946 50.751 13.080 1.00 19.81 ? 220 ALA B N 1 ATOM 1261 C CA . ALA F 2 20 ? 41.705 51.434 12.723 1.00 23.14 ? 220 ALA B CA 1 ATOM 1262 C C . ALA F 2 20 ? 42.191 52.849 12.372 1.00 26.07 ? 220 ALA B C 1 ATOM 1263 O O . ALA F 2 20 ? 42.962 53.437 13.117 1.00 33.41 ? 220 ALA B O 1 ATOM 1264 C CB . ALA F 2 20 ? 40.807 51.492 13.932 1.00 22.60 ? 220 ALA B CB 1 ATOM 1265 N N . SER F 2 21 ? 41.822 53.420 11.249 1.00 35.79 ? 221 SER B N 1 ATOM 1266 C CA . SER F 2 21 ? 42.313 54.797 11.099 1.00 39.81 ? 221 SER B CA 1 ATOM 1267 C C . SER F 2 21 ? 41.130 55.700 10.863 1.00 38.89 ? 221 SER B C 1 ATOM 1268 O O . SER F 2 21 ? 41.027 56.343 9.832 1.00 37.50 ? 221 SER B O 1 ATOM 1269 C CB . SER F 2 21 ? 43.345 54.961 9.968 1.00 46.59 ? 221 SER B CB 1 ATOM 1270 O OG . SER F 2 21 ? 42.733 54.925 8.694 1.00 50.45 ? 221 SER B OG 1 ATOM 1271 N N . SER F 2 22 ? 40.225 55.689 11.837 1.00 33.77 ? 222 SER B N 1 ATOM 1272 C CA . SER F 2 22 ? 39.020 56.510 11.851 1.00 27.47 ? 222 SER B CA 1 ATOM 1273 C C . SER F 2 22 ? 38.159 56.035 13.004 1.00 28.73 ? 222 SER B C 1 ATOM 1274 O O . SER F 2 22 ? 38.051 54.823 13.248 1.00 19.43 ? 222 SER B O 1 ATOM 1275 C CB . SER F 2 22 ? 38.248 56.414 10.519 1.00 25.78 ? 222 SER B CB 1 ATOM 1276 O OG . SER F 2 22 ? 36.875 56.229 10.697 1.00 27.50 ? 222 SER B OG 1 ATOM 1277 N N . SER F 2 23 ? 37.594 57.006 13.729 1.00 22.14 ? 223 SER B N 1 ATOM 1278 C CA . SER F 2 23 ? 36.698 56.734 14.861 1.00 19.35 ? 223 SER B CA 1 ATOM 1279 C C . SER F 2 23 ? 35.408 56.032 14.436 1.00 19.51 ? 223 SER B C 1 ATOM 1280 O O . SER F 2 23 ? 34.625 55.601 15.291 1.00 20.86 ? 223 SER B O 1 ATOM 1281 C CB . SER F 2 23 ? 36.376 58.067 15.539 1.00 23.39 ? 223 SER B CB 1 ATOM 1282 O OG . SER F 2 23 ? 35.758 58.947 14.595 1.00 31.37 ? 223 SER B OG 1 ATOM 1283 N N . ASN F 2 24 ? 35.162 55.883 13.129 1.00 16.20 ? 224 ASN B N 1 ATOM 1284 C CA . ASN F 2 24 ? 33.967 55.190 12.673 1.00 19.85 ? 224 ASN B CA 1 ATOM 1285 C C . ASN F 2 24 ? 34.247 53.775 12.236 1.00 18.11 ? 224 ASN B C 1 ATOM 1286 O O . ASN F 2 24 ? 33.358 53.103 11.707 1.00 18.31 ? 224 ASN B O 1 ATOM 1287 C CB . ASN F 2 24 ? 33.274 55.927 11.525 1.00 24.92 ? 224 ASN B CB 1 ATOM 1288 C CG . ASN F 2 24 ? 32.505 57.129 12.039 1.00 33.71 ? 224 ASN B CG 1 ATOM 1289 O OD1 . ASN F 2 24 ? 31.804 57.025 13.053 1.00 35.06 ? 224 ASN B OD1 1 ATOM 1290 N ND2 . ASN F 2 24 ? 32.650 58.276 11.369 1.00 32.96 ? 224 ASN B ND2 1 ATOM 1291 N N . TYR F 2 25 ? 35.482 53.358 12.468 1.00 17.00 ? 225 TYR B N 1 ATOM 1292 C CA . TYR F 2 25 ? 35.884 52.008 12.076 1.00 17.41 ? 225 TYR B CA 1 ATOM 1293 C C . TYR F 2 25 ? 34.928 50.963 12.620 1.00 15.36 ? 225 TYR B C 1 ATOM 1294 O O . TYR F 2 25 ? 34.464 50.127 11.846 1.00 16.47 ? 225 TYR B O 1 ATOM 1295 C CB . TYR F 2 25 ? 37.324 51.721 12.564 1.00 17.99 ? 225 TYR B CB 1 ATOM 1296 C CG . TYR F 2 25 ? 37.823 50.288 12.288 1.00 19.30 ? 225 TYR B CG 1 ATOM 1297 C CD1 . TYR F 2 25 ? 37.496 49.240 13.151 1.00 14.92 ? 225 TYR B CD1 1 ATOM 1298 C CD2 . TYR F 2 25 ? 38.549 49.988 11.138 1.00 22.95 ? 225 TYR B CD2 1 ATOM 1299 C CE1 . TYR F 2 25 ? 37.865 47.925 12.862 1.00 17.91 ? 225 TYR B CE1 1 ATOM 1300 C CE2 . TYR F 2 25 ? 38.936 48.664 10.840 1.00 17.61 ? 225 TYR B CE2 1 ATOM 1301 C CZ . TYR F 2 25 ? 38.579 47.641 11.712 1.00 17.61 ? 225 TYR B CZ 1 ATOM 1302 O OH . TYR F 2 25 ? 38.932 46.336 11.410 1.00 19.61 ? 225 TYR B OH 1 ATOM 1303 N N . CYS F 2 26 ? 34.621 50.988 13.928 1.00 13.64 ? 226 CYS B N 1 ATOM 1304 C CA . CYS F 2 26 ? 33.739 49.970 14.469 1.00 14.84 ? 226 CYS B CA 1 ATOM 1305 C C . CYS F 2 26 ? 32.333 50.083 13.918 1.00 16.11 ? 226 CYS B C 1 ATOM 1306 O O . CYS F 2 26 ? 31.687 49.109 13.616 1.00 17.55 ? 226 CYS B O 1 ATOM 1307 C CB . CYS F 2 26 ? 33.725 50.024 15.996 1.00 17.67 ? 226 CYS B CB 1 ATOM 1308 S SG . CYS F 2 26 ? 35.350 49.531 16.691 1.00 18.51 ? 226 CYS B SG 1 ATOM 1309 N N . ASN F 2 27 ? 31.820 51.298 13.812 1.00 16.54 ? 227 ASN B N 1 ATOM 1310 C CA . ASN F 2 27 ? 30.506 51.389 13.187 1.00 19.09 ? 227 ASN B CA 1 ATOM 1311 C C . ASN F 2 27 ? 30.470 50.720 11.815 1.00 17.74 ? 227 ASN B C 1 ATOM 1312 O O . ASN F 2 27 ? 29.518 50.036 11.514 1.00 18.60 ? 227 ASN B O 1 ATOM 1313 C CB . ASN F 2 27 ? 30.137 52.863 13.001 1.00 17.22 ? 227 ASN B CB 1 ATOM 1314 C CG . ASN F 2 27 ? 29.805 53.531 14.340 1.00 21.25 ? 227 ASN B CG 1 ATOM 1315 O OD1 . ASN F 2 27 ? 29.262 52.884 15.234 1.00 22.58 ? 227 ASN B OD1 1 ATOM 1316 N ND2 . ASN F 2 27 ? 30.108 54.823 14.459 1.00 21.43 ? 227 ASN B ND2 1 ATOM 1317 N N . GLN F 2 28 ? 31.487 50.977 11.000 1.00 21.94 ? 228 GLN B N 1 ATOM 1318 C CA . GLN F 2 28 ? 31.574 50.435 9.643 1.00 19.94 ? 228 GLN B CA 1 ATOM 1319 C C . GLN F 2 28 ? 31.751 48.923 9.631 1.00 21.73 ? 228 GLN B C 1 ATOM 1320 O O . GLN F 2 28 ? 31.018 48.202 8.943 1.00 19.69 ? 228 GLN B O 1 ATOM 1321 C CB . GLN F 2 28 ? 32.737 51.085 8.902 1.00 26.02 ? 228 GLN B CB 1 ATOM 1322 C CG . GLN F 2 28 ? 32.575 52.594 8.747 1.00 34.73 ? 228 GLN B CG 1 ATOM 1323 C CD . GLN F 2 28 ? 33.836 53.332 8.334 1.00 45.96 ? 228 GLN B CD 1 ATOM 1324 O OE1 . GLN F 2 28 ? 33.736 54.411 7.748 1.00 51.41 ? 228 GLN B OE1 1 ATOM 1325 N NE2 . GLN F 2 28 ? 35.020 52.787 8.656 1.00 44.15 ? 228 GLN B NE2 1 ATOM 1326 N N . MET F 2 29 ? 32.677 48.450 10.459 1.00 17.69 ? 229 MET B N 1 ATOM 1327 C CA . MET F 2 29 ? 32.986 47.018 10.469 1.00 16.58 ? 229 MET B CA 1 ATOM 1328 C C . MET F 2 29 ? 32.010 46.114 11.188 1.00 18.90 ? 229 MET B C 1 ATOM 1329 O O . MET F 2 29 ? 31.763 44.964 10.750 1.00 18.57 ? 229 MET B O 1 ATOM 1330 C CB A MET F 2 29 ? 34.423 46.822 10.978 0.52 17.76 ? 229 MET B CB 1 ATOM 1331 C CB B MET F 2 29 ? 34.392 46.825 11.091 0.48 22.64 ? 229 MET B CB 1 ATOM 1332 C CG A MET F 2 29 ? 35.519 47.617 10.181 0.52 17.43 ? 229 MET B CG 1 ATOM 1333 C CG B MET F 2 29 ? 35.501 47.071 10.092 0.48 27.89 ? 229 MET B CG 1 ATOM 1334 S SD A MET F 2 29 ? 35.857 47.051 8.463 0.52 24.58 ? 229 MET B SD 1 ATOM 1335 S SD B MET F 2 29 ? 35.479 45.737 8.870 0.48 28.94 ? 229 MET B SD 1 ATOM 1336 C CE A MET F 2 29 ? 36.364 48.591 7.762 0.52 29.73 ? 229 MET B CE 1 ATOM 1337 C CE B MET F 2 29 ? 36.721 44.674 9.597 0.48 33.06 ? 229 MET B CE 1 ATOM 1338 N N . MET F 2 30 ? 31.452 46.566 12.305 1.00 18.15 ? 230 MET B N 1 ATOM 1339 C CA . MET F 2 30 ? 30.491 45.756 13.008 1.00 17.45 ? 230 MET B CA 1 ATOM 1340 C C . MET F 2 30 ? 29.313 45.555 12.055 1.00 20.69 ? 230 MET B C 1 ATOM 1341 O O . MET F 2 30 ? 28.642 44.528 12.096 1.00 18.89 ? 230 MET B O 1 ATOM 1342 C CB . MET F 2 30 ? 30.025 46.414 14.355 1.00 13.64 ? 230 MET B CB 1 ATOM 1343 C CG . MET F 2 30 ? 31.208 46.575 15.365 1.00 16.19 ? 230 MET B CG 1 ATOM 1344 S SD . MET F 2 30 ? 31.752 44.887 15.896 1.00 16.93 ? 230 MET B SD 1 ATOM 1345 C CE . MET F 2 30 ? 30.468 44.343 16.919 1.00 16.48 ? 230 MET B CE 1 ATOM 1346 N N . LYS F 2 31 ? 29.061 46.543 11.205 1.00 20.39 ? 231 LYS B N 1 ATOM 1347 C CA . LYS F 2 31 ? 27.953 46.346 10.291 1.00 18.82 ? 231 LYS B CA 1 ATOM 1348 C C . LYS F 2 31 ? 28.352 45.451 9.116 1.00 16.43 ? 231 LYS B C 1 ATOM 1349 O O . LYS F 2 31 ? 27.601 44.540 8.786 1.00 20.33 ? 231 LYS B O 1 ATOM 1350 C CB A LYS F 2 31 ? 27.431 47.685 9.770 0.51 22.46 ? 231 LYS B CB 1 ATOM 1351 C CB B LYS F 2 31 ? 27.689 47.817 9.585 0.49 20.19 ? 231 LYS B CB 1 ATOM 1352 C CG A LYS F 2 31 ? 26.136 47.537 8.959 0.51 26.85 ? 231 LYS B CG 1 ATOM 1353 C CG B LYS F 2 31 ? 26.449 47.774 8.679 0.49 25.83 ? 231 LYS B CG 1 ATOM 1354 C CD A LYS F 2 31 ? 25.574 48.916 8.651 0.51 29.54 ? 231 LYS B CD 1 ATOM 1355 C CD B LYS F 2 31 ? 25.177 47.537 9.513 0.49 23.29 ? 231 LYS B CD 1 ATOM 1356 C CE A LYS F 2 31 ? 26.380 49.624 7.602 0.51 30.00 ? 231 LYS B CE 1 ATOM 1357 C CE B LYS F 2 31 ? 24.811 48.771 10.387 0.49 23.37 ? 231 LYS B CE 1 ATOM 1358 N NZ A LYS F 2 31 ? 25.957 49.182 6.245 0.51 31.76 ? 231 LYS B NZ 1 ATOM 1359 N NZ B LYS F 2 31 ? 24.939 48.580 11.884 0.49 15.98 ? 231 LYS B NZ 1 ATOM 1360 N N . SER F 2 32 ? 29.525 45.674 8.537 1.00 19.92 ? 232 SER B N 1 ATOM 1361 C CA . SER F 2 32 ? 29.928 44.887 7.343 1.00 18.29 ? 232 SER B CA 1 ATOM 1362 C C . SER F 2 32 ? 30.142 43.415 7.655 1.00 23.39 ? 232 SER B C 1 ATOM 1363 O O . SER F 2 32 ? 29.953 42.539 6.788 1.00 18.97 ? 232 SER B O 1 ATOM 1364 C CB A SER F 2 32 ? 31.145 45.497 6.631 0.51 22.44 ? 232 SER B CB 1 ATOM 1365 C CB B SER F 2 32 ? 31.297 45.393 6.894 0.49 20.30 ? 232 SER B CB 1 ATOM 1366 O OG A SER F 2 32 ? 32.321 45.509 7.413 0.51 23.26 ? 232 SER B OG 1 ATOM 1367 O OG B SER F 2 32 ? 31.836 44.685 5.785 0.49 18.73 ? 232 SER B OG 1 ATOM 1368 N N . ARG F 2 33 ? 30.520 43.116 8.906 1.00 20.62 ? 233 ARG B N 1 ATOM 1369 C CA . ARG F 2 33 ? 30.712 41.733 9.319 1.00 17.65 ? 233 ARG B CA 1 ATOM 1370 C C . ARG F 2 33 ? 29.484 41.065 9.891 1.00 17.81 ? 233 ARG B C 1 ATOM 1371 O O . ARG F 2 33 ? 29.531 39.967 10.503 1.00 18.88 ? 233 ARG B O 1 ATOM 1372 C CB . ARG F 2 33 ? 31.926 41.658 10.294 1.00 15.45 ? 233 ARG B CB 1 ATOM 1373 C CG . ARG F 2 33 ? 33.207 42.228 9.766 1.00 14.53 ? 233 ARG B CG 1 ATOM 1374 C CD . ARG F 2 33 ? 33.729 41.512 8.502 1.00 12.38 ? 233 ARG B CD 1 ATOM 1375 N NE . ARG F 2 33 ? 34.964 42.100 8.073 1.00 16.04 ? 233 ARG B NE 1 ATOM 1376 C CZ . ARG F 2 33 ? 36.166 41.729 8.518 1.00 17.19 ? 233 ARG B CZ 1 ATOM 1377 N NH1 . ARG F 2 33 ? 36.273 40.743 9.410 1.00 13.79 ? 233 ARG B NH1 1 ATOM 1378 N NH2 . ARG F 2 33 ? 37.265 42.310 8.061 1.00 18.06 ? 233 ARG B NH2 1 ATOM 1379 N N . ASN F 2 34 ? 28.335 41.733 9.703 1.00 17.36 ? 234 ASN B N 1 ATOM 1380 C CA . ASN F 2 34 ? 27.080 41.223 10.127 1.00 19.17 ? 234 ASN B CA 1 ATOM 1381 C C . ASN F 2 34 ? 26.904 41.082 11.629 1.00 19.91 ? 234 ASN B C 1 ATOM 1382 O O . ASN F 2 34 ? 26.135 40.278 12.101 1.00 22.54 ? 234 ASN B O 1 ATOM 1383 C CB . ASN F 2 34 ? 26.830 39.870 9.444 1.00 27.53 ? 234 ASN B CB 1 ATOM 1384 C CG . ASN F 2 34 ? 25.790 39.979 8.361 1.00 40.03 ? 234 ASN B CG 1 ATOM 1385 O OD1 . ASN F 2 34 ? 24.683 40.444 8.614 1.00 44.12 ? 234 ASN B OD1 1 ATOM 1386 N ND2 . ASN F 2 34 ? 26.137 39.571 7.147 1.00 44.88 ? 234 ASN B ND2 1 ATOM 1387 N N . LEU F 2 35 ? 27.621 41.893 12.387 1.00 20.03 ? 235 LEU B N 1 ATOM 1388 C CA . LEU F 2 35 ? 27.526 41.827 13.841 1.00 17.71 ? 235 LEU B CA 1 ATOM 1389 C C . LEU F 2 35 ? 26.495 42.792 14.411 1.00 22.37 ? 235 LEU B C 1 ATOM 1390 O O . LEU F 2 35 ? 26.471 43.039 15.619 1.00 25.31 ? 235 LEU B O 1 ATOM 1391 C CB . LEU F 2 35 ? 28.908 42.105 14.428 1.00 14.77 ? 235 LEU B CB 1 ATOM 1392 C CG . LEU F 2 35 ? 29.923 41.099 13.906 1.00 16.28 ? 235 LEU B CG 1 ATOM 1393 C CD1 . LEU F 2 35 ? 31.290 41.348 14.632 1.00 16.71 ? 235 LEU B CD1 1 ATOM 1394 C CD2 . LEU F 2 35 ? 29.446 39.670 14.080 1.00 22.88 ? 235 LEU B CD2 1 ATOM 1395 N N . THR F 2 36 ? 25.649 43.355 13.554 1.00 20.07 ? 236 THR B N 1 ATOM 1396 C CA . THR F 2 36 ? 24.587 44.211 14.066 1.00 20.56 ? 236 THR B CA 1 ATOM 1397 C C . THR F 2 36 ? 23.282 43.741 13.430 1.00 29.28 ? 236 THR B C 1 ATOM 1398 O O . THR F 2 36 ? 22.302 44.474 13.457 1.00 26.65 ? 236 THR B O 1 ATOM 1399 C CB . THR F 2 36 ? 24.810 45.676 13.720 1.00 21.18 ? 236 THR B CB 1 ATOM 1400 O OG1 . THR F 2 36 ? 24.864 45.837 12.292 1.00 25.89 ? 236 THR B OG1 1 ATOM 1401 C CG2 . THR F 2 36 ? 26.144 46.172 14.328 1.00 22.45 ? 236 THR B CG2 1 ATOM 1402 N N . LYS F 2 37 ? 23.280 42.517 12.891 1.00 28.85 ? 237 LYS B N 1 ATOM 1403 C CA . LYS F 2 37 ? 22.103 41.933 12.210 1.00 35.41 ? 237 LYS B CA 1 ATOM 1404 C C . LYS F 2 37 ? 20.805 41.803 13.019 1.00 36.10 ? 237 LYS B C 1 ATOM 1405 O O . LYS F 2 37 ? 19.785 42.388 12.644 1.00 42.36 ? 237 LYS B O 1 ATOM 1406 C CB . LYS F 2 37 ? 22.460 40.568 11.625 1.00 38.53 ? 237 LYS B CB 1 ATOM 1407 C CG . LYS F 2 37 ? 21.578 40.123 10.461 1.00 46.18 ? 237 LYS B CG 1 ATOM 1408 C CD . LYS F 2 37 ? 21.740 41.059 9.261 1.00 50.37 ? 237 LYS B CD 1 ATOM 1409 C CE . LYS F 2 37 ? 21.550 40.287 7.960 1.00 52.97 ? 237 LYS B CE 1 ATOM 1410 N NZ . LYS F 2 37 ? 20.329 39.406 8.046 1.00 55.53 ? 237 LYS B NZ 1 ATOM 1411 N N . ASP F 2 38 ? 20.813 41.037 14.109 1.00 34.70 ? 238 ASP B N 1 ATOM 1412 C CA . ASP F 2 38 ? 19.603 40.856 14.926 1.00 32.77 ? 238 ASP B CA 1 ATOM 1413 C C . ASP F 2 38 ? 19.676 41.580 16.267 1.00 33.17 ? 238 ASP B C 1 ATOM 1414 O O . ASP F 2 38 ? 18.693 41.665 17.023 1.00 33.49 ? 238 ASP B O 1 ATOM 1415 C CB . ASP F 2 38 ? 19.368 39.362 15.171 1.00 36.78 ? 238 ASP B CB 1 ATOM 1416 C CG . ASP F 2 38 ? 19.427 38.549 13.887 1.00 44.29 ? 238 ASP B CG 1 ATOM 1417 O OD1 . ASP F 2 38 ? 18.690 38.905 12.935 1.00 43.49 ? 238 ASP B OD1 1 ATOM 1418 O OD2 . ASP F 2 38 ? 20.209 37.563 13.827 1.00 43.60 ? 238 ASP B OD2 1 ATOM 1419 N N . ARG F 2 39 ? 20.861 42.084 16.582 1.00 28.58 ? 239 ARG B N 1 ATOM 1420 C CA . ARG F 2 39 ? 21.060 42.814 17.830 1.00 28.83 ? 239 ARG B CA 1 ATOM 1421 C C . ARG F 2 39 ? 22.435 43.482 17.657 1.00 24.40 ? 239 ARG B C 1 ATOM 1422 O O . ARG F 2 39 ? 23.134 43.186 16.686 1.00 23.40 ? 239 ARG B O 1 ATOM 1423 C CB . ARG F 2 39 ? 21.045 41.846 19.026 1.00 31.72 ? 239 ARG B CB 1 ATOM 1424 C CG . ARG F 2 39 ? 22.186 40.837 19.047 1.00 38.21 ? 239 ARG B CG 1 ATOM 1425 C CD . ARG F 2 39 ? 21.848 39.579 19.855 1.00 43.10 ? 239 ARG B CD 1 ATOM 1426 N NE . ARG F 2 39 ? 20.906 38.707 19.145 1.00 53.44 ? 239 ARG B NE 1 ATOM 1427 C CZ . ARG F 2 39 ? 19.585 38.679 19.346 1.00 56.18 ? 239 ARG B CZ 1 ATOM 1428 N NH1 . ARG F 2 39 ? 19.027 39.479 20.252 1.00 55.53 ? 239 ARG B NH1 1 ATOM 1429 N NH2 . ARG F 2 39 ? 18.819 37.848 18.637 1.00 57.04 ? 239 ARG B NH2 1 ATOM 1430 N N . CYS F 2 40 ? 22.799 44.415 18.525 1.00 20.33 ? 240 CYS B N 1 ATOM 1431 C CA . CYS F 2 40 ? 24.155 44.998 18.378 1.00 22.45 ? 240 CYS B CA 1 ATOM 1432 C C . CYS F 2 40 ? 25.090 44.171 19.282 1.00 21.46 ? 240 CYS B C 1 ATOM 1433 O O . CYS F 2 40 ? 24.903 44.168 20.499 1.00 22.08 ? 240 CYS B O 1 ATOM 1434 C CB . CYS F 2 40 ? 24.231 46.438 18.865 1.00 26.08 ? 240 CYS B CB 1 ATOM 1435 S SG . CYS F 2 40 ? 22.894 47.511 18.201 1.00 26.32 ? 240 CYS B SG 1 ATOM 1436 N N . LYS F 2 41 ? 26.049 43.429 18.698 1.00 19.53 ? 241 LYS B N 1 ATOM 1437 C CA . LYS F 2 41 ? 26.994 42.668 19.562 1.00 16.83 ? 241 LYS B CA 1 ATOM 1438 C C . LYS F 2 41 ? 27.694 43.799 20.337 1.00 17.44 ? 241 LYS B C 1 ATOM 1439 O O . LYS F 2 41 ? 28.320 44.660 19.752 1.00 16.47 ? 241 LYS B O 1 ATOM 1440 C CB . LYS F 2 41 ? 28.007 41.926 18.681 1.00 17.35 ? 241 LYS B CB 1 ATOM 1441 C CG . LYS F 2 41 ? 28.906 41.004 19.515 1.00 17.07 ? 241 LYS B CG 1 ATOM 1442 C CD . LYS F 2 41 ? 29.899 40.299 18.616 1.00 15.13 ? 241 LYS B CD 1 ATOM 1443 C CE . LYS F 2 41 ? 30.735 39.338 19.477 1.00 15.12 ? 241 LYS B CE 1 ATOM 1444 N NZ . LYS F 2 41 ? 31.730 38.603 18.612 1.00 12.73 ? 241 LYS B NZ 1 ATOM 1445 N N . PRO F 2 42 ? 27.690 43.736 21.679 1.00 17.20 ? 242 PRO B N 1 ATOM 1446 C CA . PRO F 2 42 ? 28.286 44.813 22.447 1.00 15.65 ? 242 PRO B CA 1 ATOM 1447 C C . PRO F 2 42 ? 29.777 44.979 22.582 1.00 14.44 ? 242 PRO B C 1 ATOM 1448 O O . PRO F 2 42 ? 30.251 46.117 22.742 1.00 16.01 ? 242 PRO B O 1 ATOM 1449 C CB . PRO F 2 42 ? 27.673 44.648 23.824 1.00 18.51 ? 242 PRO B CB 1 ATOM 1450 C CG . PRO F 2 42 ? 26.505 43.727 23.637 1.00 28.73 ? 242 PRO B CG 1 ATOM 1451 C CD . PRO F 2 42 ? 26.935 42.818 22.536 1.00 18.85 ? 242 PRO B CD 1 ATOM 1452 N N . VAL F 2 43 ? 30.480 43.852 22.477 1.00 13.83 ? 243 VAL B N 1 ATOM 1453 C CA . VAL F 2 43 ? 31.929 43.844 22.691 1.00 13.81 ? 243 VAL B CA 1 ATOM 1454 C C . VAL F 2 43 ? 32.563 42.987 21.593 1.00 10.04 ? 243 VAL B C 1 ATOM 1455 O O . VAL F 2 43 ? 32.150 41.836 21.460 1.00 13.71 ? 243 VAL B O 1 ATOM 1456 C CB . VAL F 2 43 ? 32.222 43.191 24.067 1.00 15.83 ? 243 VAL B CB 1 ATOM 1457 C CG1 . VAL F 2 43 ? 33.705 43.036 24.281 1.00 18.96 ? 243 VAL B CG1 1 ATOM 1458 C CG2 . VAL F 2 43 ? 31.676 44.113 25.234 1.00 16.35 ? 243 VAL B CG2 1 ATOM 1459 N N . ASN F 2 44 ? 33.495 43.535 20.811 1.00 14.33 ? 244 ASN B N 1 ATOM 1460 C CA . ASN F 2 44 ? 34.126 42.718 19.755 1.00 11.90 ? 244 ASN B CA 1 ATOM 1461 C C . ASN F 2 44 ? 35.485 43.264 19.455 1.00 16.19 ? 244 ASN B C 1 ATOM 1462 O O . ASN F 2 44 ? 35.646 44.450 19.315 1.00 18.33 ? 244 ASN B O 1 ATOM 1463 C CB . ASN F 2 44 ? 33.299 42.756 18.470 1.00 12.59 ? 244 ASN B CB 1 ATOM 1464 C CG . ASN F 2 44 ? 33.743 41.709 17.462 1.00 11.00 ? 244 ASN B CG 1 ATOM 1465 O OD1 . ASN F 2 44 ? 33.546 40.500 17.670 1.00 15.47 ? 244 ASN B OD1 1 ATOM 1466 N ND2 . ASN F 2 44 ? 34.351 42.164 16.383 1.00 14.59 ? 244 ASN B ND2 1 ATOM 1467 N N . THR F 2 45 ? 36.476 42.390 19.305 1.00 11.44 ? 245 THR B N 1 ATOM 1468 C CA . THR F 2 45 ? 37.820 42.879 18.939 1.00 12.17 ? 245 THR B CA 1 ATOM 1469 C C . THR F 2 45 ? 38.195 42.509 17.512 1.00 11.46 ? 245 THR B C 1 ATOM 1470 O O . THR F 2 45 ? 37.869 41.393 17.108 1.00 13.82 ? 245 THR B O 1 ATOM 1471 C CB . THR F 2 45 ? 38.852 42.178 19.854 1.00 13.41 ? 245 THR B CB 1 ATOM 1472 O OG1 . THR F 2 45 ? 38.553 42.502 21.229 1.00 16.70 ? 245 THR B OG1 1 ATOM 1473 C CG2 . THR F 2 45 ? 40.283 42.599 19.489 1.00 14.02 ? 245 THR B CG2 1 ATOM 1474 N N . PHE F 2 46 ? 38.847 43.408 16.766 1.00 11.73 ? 246 PHE B N 1 ATOM 1475 C CA . PHE F 2 46 ? 39.375 43.072 15.430 1.00 9.88 ? 246 PHE B CA 1 ATOM 1476 C C . PHE F 2 46 ? 40.891 43.044 15.551 1.00 12.15 ? 246 PHE B C 1 ATOM 1477 O O . PHE F 2 46 ? 41.499 43.798 16.331 1.00 14.76 ? 246 PHE B O 1 ATOM 1478 C CB . PHE F 2 46 ? 38.980 44.097 14.343 1.00 13.80 ? 246 PHE B CB 1 ATOM 1479 C CG . PHE F 2 46 ? 37.540 44.004 13.951 1.00 14.66 ? 246 PHE B CG 1 ATOM 1480 C CD1 . PHE F 2 46 ? 37.117 43.061 13.005 1.00 14.77 ? 246 PHE B CD1 1 ATOM 1481 C CD2 . PHE F 2 46 ? 36.590 44.810 14.568 1.00 12.69 ? 246 PHE B CD2 1 ATOM 1482 C CE1 . PHE F 2 46 ? 35.758 42.934 12.697 1.00 15.51 ? 246 PHE B CE1 1 ATOM 1483 C CE2 . PHE F 2 46 ? 35.235 44.672 14.251 1.00 16.12 ? 246 PHE B CE2 1 ATOM 1484 C CZ . PHE F 2 46 ? 34.836 43.740 13.325 1.00 17.99 ? 246 PHE B CZ 1 ATOM 1485 N N . VAL F 2 47 ? 41.529 42.176 14.761 1.00 10.13 ? 247 VAL B N 1 ATOM 1486 C CA . VAL F 2 47 ? 42.971 42.016 14.864 1.00 11.35 ? 247 VAL B CA 1 ATOM 1487 C C . VAL F 2 47 ? 43.574 42.354 13.495 1.00 13.48 ? 247 VAL B C 1 ATOM 1488 O O . VAL F 2 47 ? 43.208 41.805 12.454 1.00 14.74 ? 247 VAL B O 1 ATOM 1489 C CB . VAL F 2 47 ? 43.345 40.572 15.231 1.00 11.86 ? 247 VAL B CB 1 ATOM 1490 C CG1 . VAL F 2 47 ? 44.875 40.488 15.402 1.00 14.05 ? 247 VAL B CG1 1 ATOM 1491 C CG2 . VAL F 2 47 ? 42.645 40.096 16.550 1.00 15.19 ? 247 VAL B CG2 1 ATOM 1492 N N . HIS F 2 48 ? 44.547 43.253 13.524 1.00 13.16 ? 248 HIS B N 1 ATOM 1493 C CA . HIS F 2 48 ? 45.230 43.752 12.324 1.00 13.27 ? 248 HIS B CA 1 ATOM 1494 C C . HIS F 2 48 ? 46.612 43.123 12.205 1.00 13.44 ? 248 HIS B C 1 ATOM 1495 O O . HIS F 2 48 ? 47.627 43.802 12.354 1.00 16.11 ? 248 HIS B O 1 ATOM 1496 C CB . HIS F 2 48 ? 45.357 45.266 12.451 1.00 14.17 ? 248 HIS B CB 1 ATOM 1497 C CG . HIS F 2 48 ? 44.054 45.932 12.739 1.00 15.22 ? 248 HIS B CG 1 ATOM 1498 N ND1 . HIS F 2 48 ? 42.985 45.894 11.866 1.00 18.62 ? 248 HIS B ND1 1 ATOM 1499 C CD2 . HIS F 2 48 ? 43.616 46.579 13.851 1.00 11.58 ? 248 HIS B CD2 1 ATOM 1500 C CE1 . HIS F 2 48 ? 41.942 46.489 12.434 1.00 20.60 ? 248 HIS B CE1 1 ATOM 1501 N NE2 . HIS F 2 48 ? 42.303 46.911 13.642 1.00 16.99 ? 248 HIS B NE2 1 ATOM 1502 N N . GLU F 2 49 ? 46.620 41.795 12.000 1.00 13.16 ? 249 GLU B N 1 ATOM 1503 C CA . GLU F 2 49 ? 47.827 41.038 11.774 1.00 11.60 ? 249 GLU B CA 1 ATOM 1504 C C . GLU F 2 49 ? 47.462 39.995 10.721 1.00 11.37 ? 249 GLU B C 1 ATOM 1505 O O . GLU F 2 49 ? 46.285 39.765 10.438 1.00 12.49 ? 249 GLU B O 1 ATOM 1506 C CB . GLU F 2 49 ? 48.314 40.296 13.033 1.00 12.16 ? 249 GLU B CB 1 ATOM 1507 C CG . GLU F 2 49 ? 48.644 41.254 14.268 1.00 15.68 ? 249 GLU B CG 1 ATOM 1508 C CD . GLU F 2 49 ? 49.810 42.209 14.013 1.00 16.54 ? 249 GLU B CD 1 ATOM 1509 O OE1 . GLU F 2 49 ? 50.628 42.013 13.084 1.00 16.12 ? 249 GLU B OE1 1 ATOM 1510 O OE2 . GLU F 2 49 ? 49.938 43.209 14.775 1.00 16.00 ? 249 GLU B OE2 1 ATOM 1511 N N . SER F 2 50 ? 48.485 39.394 10.150 1.00 13.25 ? 250 SER B N 1 ATOM 1512 C CA . SER F 2 50 ? 48.238 38.384 9.126 1.00 13.28 ? 250 SER B CA 1 ATOM 1513 C C . SER F 2 50 ? 47.470 37.196 9.728 1.00 14.55 ? 250 SER B C 1 ATOM 1514 O O . SER F 2 50 ? 47.547 36.881 10.905 1.00 11.19 ? 250 SER B O 1 ATOM 1515 C CB . SER F 2 50 ? 49.595 37.904 8.548 1.00 15.71 ? 250 SER B CB 1 ATOM 1516 O OG . SER F 2 50 ? 50.319 37.107 9.501 1.00 12.63 ? 250 SER B OG 1 ATOM 1517 N N . LEU F 2 51 ? 46.723 36.524 8.877 1.00 11.93 ? 251 LEU B N 1 ATOM 1518 C CA . LEU F 2 51 ? 45.999 35.347 9.333 1.00 14.76 ? 251 LEU B CA 1 ATOM 1519 C C . LEU F 2 51 ? 47.008 34.314 9.850 1.00 12.15 ? 251 LEU B C 1 ATOM 1520 O O . LEU F 2 51 ? 46.703 33.576 10.815 1.00 12.87 ? 251 LEU B O 1 ATOM 1521 C CB . LEU F 2 51 ? 45.144 34.789 8.160 1.00 12.69 ? 251 LEU B CB 1 ATOM 1522 C CG . LEU F 2 51 ? 44.325 33.546 8.549 1.00 13.58 ? 251 LEU B CG 1 ATOM 1523 C CD1 . LEU F 2 51 ? 43.402 33.812 9.762 1.00 16.85 ? 251 LEU B CD1 1 ATOM 1524 C CD2 . LEU F 2 51 ? 43.454 33.129 7.327 1.00 15.72 ? 251 LEU B CD2 1 ATOM 1525 N N . ALA F 2 52 ? 48.168 34.195 9.181 1.00 11.35 ? 252 ALA B N 1 ATOM 1526 C CA . ALA F 2 52 ? 49.202 33.241 9.639 1.00 15.10 ? 252 ALA B CA 1 ATOM 1527 C C . ALA F 2 52 ? 49.616 33.564 11.069 1.00 12.21 ? 252 ALA B C 1 ATOM 1528 O O . ALA F 2 52 ? 49.741 32.656 11.913 1.00 14.16 ? 252 ALA B O 1 ATOM 1529 C CB . ALA F 2 52 ? 50.444 33.296 8.723 1.00 17.44 ? 252 ALA B CB 1 ATOM 1530 N N . ASP F 2 53 ? 49.856 34.840 11.328 1.00 12.49 ? 253 ASP B N 1 ATOM 1531 C CA . ASP F 2 53 ? 50.276 35.190 12.709 1.00 13.50 ? 253 ASP B CA 1 ATOM 1532 C C . ASP F 2 53 ? 49.192 34.963 13.706 1.00 13.17 ? 253 ASP B C 1 ATOM 1533 O O . ASP F 2 53 ? 49.488 34.591 14.846 1.00 12.95 ? 253 ASP B O 1 ATOM 1534 C CB . ASP F 2 53 ? 50.732 36.644 12.830 1.00 13.35 ? 253 ASP B CB 1 ATOM 1535 C CG . ASP F 2 53 ? 52.091 36.922 12.182 1.00 17.59 ? 253 ASP B CG 1 ATOM 1536 O OD1 . ASP F 2 53 ? 52.820 35.992 11.775 1.00 16.66 ? 253 ASP B OD1 1 ATOM 1537 O OD2 . ASP F 2 53 ? 52.483 38.109 12.128 1.00 19.97 ? 253 ASP B OD2 1 ATOM 1538 N N . VAL F 2 54 ? 47.935 35.191 13.352 1.00 10.24 ? 254 VAL B N 1 ATOM 1539 C CA . VAL F 2 54 ? 46.874 34.952 14.356 1.00 11.44 ? 254 VAL B CA 1 ATOM 1540 C C . VAL F 2 54 ? 46.700 33.446 14.543 1.00 12.31 ? 254 VAL B C 1 ATOM 1541 O O . VAL F 2 54 ? 46.572 32.953 15.669 1.00 12.93 ? 254 VAL B O 1 ATOM 1542 C CB . VAL F 2 54 ? 45.580 35.620 13.884 1.00 10.61 ? 254 VAL B CB 1 ATOM 1543 C CG1 . VAL F 2 54 ? 44.389 35.209 14.808 1.00 12.85 ? 254 VAL B CG1 1 ATOM 1544 C CG2 . VAL F 2 54 ? 45.790 37.162 13.853 1.00 11.75 ? 254 VAL B CG2 1 ATOM 1545 N N . GLN F 2 55 ? 46.657 32.681 13.448 1.00 10.92 ? 255 GLN B N 1 ATOM 1546 C CA . GLN F 2 55 ? 46.568 31.230 13.623 1.00 14.14 ? 255 GLN B CA 1 ATOM 1547 C C . GLN F 2 55 ? 47.711 30.642 14.453 1.00 12.33 ? 255 GLN B C 1 ATOM 1548 O O . GLN F 2 55 ? 47.516 29.604 15.163 1.00 13.48 ? 255 GLN B O 1 ATOM 1549 C CB . GLN F 2 55 ? 46.562 30.532 12.240 1.00 13.92 ? 255 GLN B CB 1 ATOM 1550 C CG . GLN F 2 55 ? 45.255 30.699 11.556 1.00 11.62 ? 255 GLN B CG 1 ATOM 1551 C CD . GLN F 2 55 ? 45.229 29.856 10.232 1.00 13.81 ? 255 GLN B CD 1 ATOM 1552 O OE1 . GLN F 2 55 ? 46.227 29.248 9.853 1.00 16.83 ? 255 GLN B OE1 1 ATOM 1553 N NE2 . GLN F 2 55 ? 44.079 29.859 9.549 1.00 14.69 ? 255 GLN B NE2 1 ATOM 1554 N N . ALA F 2 56 ? 48.895 31.240 14.343 1.00 12.43 ? 256 ALA B N 1 ATOM 1555 C CA . ALA F 2 56 ? 50.064 30.748 15.085 1.00 14.94 ? 256 ALA B CA 1 ATOM 1556 C C . ALA F 2 56 ? 49.861 30.852 16.579 1.00 13.57 ? 256 ALA B C 1 ATOM 1557 O O . ALA F 2 56 ? 50.550 30.140 17.343 1.00 12.36 ? 256 ALA B O 1 ATOM 1558 C CB . ALA F 2 56 ? 51.340 31.505 14.708 1.00 12.01 ? 256 ALA B CB 1 ATOM 1559 N N . VAL F 2 57 ? 48.949 31.732 16.990 1.00 11.72 ? 257 VAL B N 1 ATOM 1560 C CA . VAL F 2 57 ? 48.733 31.846 18.450 1.00 13.68 ? 257 VAL B CA 1 ATOM 1561 C C . VAL F 2 57 ? 48.322 30.514 19.091 1.00 13.97 ? 257 VAL B C 1 ATOM 1562 O O . VAL F 2 57 ? 48.626 30.257 20.283 1.00 12.65 ? 257 VAL B O 1 ATOM 1563 C CB . VAL F 2 57 ? 47.708 32.966 18.749 1.00 11.20 ? 257 VAL B CB 1 ATOM 1564 C CG1 . VAL F 2 57 ? 47.390 33.074 20.291 1.00 11.15 ? 257 VAL B CG1 1 ATOM 1565 C CG2 . VAL F 2 57 ? 48.308 34.309 18.290 1.00 12.13 ? 257 VAL B CG2 1 ATOM 1566 N N . CYS F 2 58 ? 47.642 29.654 18.332 1.00 10.84 ? 258 CYS B N 1 ATOM 1567 C CA . CYS F 2 58 ? 47.205 28.349 18.856 1.00 13.36 ? 258 CYS B CA 1 ATOM 1568 C C . CYS F 2 58 ? 48.329 27.418 19.268 1.00 15.85 ? 258 CYS B C 1 ATOM 1569 O O . CYS F 2 58 ? 48.054 26.353 19.858 1.00 17.90 ? 258 CYS B O 1 ATOM 1570 C CB . CYS F 2 58 ? 46.311 27.649 17.820 1.00 15.38 ? 258 CYS B CB 1 ATOM 1571 S SG . CYS F 2 58 ? 44.763 28.570 17.503 1.00 19.85 ? 258 CYS B SG 1 ATOM 1572 N N . SER F 2 59 ? 49.570 27.770 18.942 1.00 14.82 ? 259 SER B N 1 ATOM 1573 C CA . SER F 2 59 ? 50.705 26.985 19.419 1.00 16.74 ? 259 SER B CA 1 ATOM 1574 C C . SER F 2 59 ? 51.625 27.838 20.307 1.00 15.35 ? 259 SER B C 1 ATOM 1575 O O . SER F 2 59 ? 52.827 27.512 20.489 1.00 17.82 ? 259 SER B O 1 ATOM 1576 C CB A SER F 2 59 ? 51.481 26.370 18.232 0.61 17.28 ? 259 SER B CB 1 ATOM 1577 C CB B SER F 2 59 ? 51.604 26.750 18.070 0.39 17.85 ? 259 SER B CB 1 ATOM 1578 O OG A SER F 2 59 ? 52.106 27.390 17.486 0.61 18.48 ? 259 SER B OG 1 ATOM 1579 O OG B SER F 2 59 ? 50.821 26.106 17.112 0.39 16.50 ? 259 SER B OG 1 ATOM 1580 N N . GLN F 2 60 ? 51.074 28.914 20.894 1.00 13.51 ? 260 GLN B N 1 ATOM 1581 C CA . GLN F 2 60 ? 51.836 29.813 21.787 1.00 14.22 ? 260 GLN B CA 1 ATOM 1582 C C . GLN F 2 60 ? 51.514 29.579 23.254 1.00 14.73 ? 260 GLN B C 1 ATOM 1583 O O . GLN F 2 60 ? 51.460 28.423 23.653 1.00 17.37 ? 260 GLN B O 1 ATOM 1584 C CB . GLN F 2 60 ? 51.713 31.277 21.334 1.00 14.01 ? 260 GLN B CB 1 ATOM 1585 C CG . GLN F 2 60 ? 52.387 31.368 19.957 1.00 12.93 ? 260 GLN B CG 1 ATOM 1586 C CD . GLN F 2 60 ? 52.325 32.739 19.261 1.00 14.35 ? 260 GLN B CD 1 ATOM 1587 O OE1 . GLN F 2 60 ? 52.000 33.773 19.873 1.00 15.22 ? 260 GLN B OE1 1 ATOM 1588 N NE2 . GLN F 2 60 ? 52.656 32.739 17.955 1.00 13.84 ? 260 GLN B NE2 1 ATOM 1589 N N . LYS F 2 61 ? 51.276 30.603 24.057 1.00 15.17 ? 261 LYS B N 1 ATOM 1590 C CA . LYS F 2 61 ? 51.076 30.334 25.498 1.00 16.17 ? 261 LYS B CA 1 ATOM 1591 C C . LYS F 2 61 ? 49.701 29.817 25.884 1.00 17.57 ? 261 LYS B C 1 ATOM 1592 O O . LYS F 2 61 ? 48.727 30.559 25.811 1.00 18.45 ? 261 LYS B O 1 ATOM 1593 C CB . LYS F 2 61 ? 51.379 31.622 26.270 1.00 17.15 ? 261 LYS B CB 1 ATOM 1594 C CG . LYS F 2 61 ? 51.378 31.432 27.821 1.00 18.93 ? 261 LYS B CG 1 ATOM 1595 C CD . LYS F 2 61 ? 51.545 32.762 28.520 1.00 24.86 ? 261 LYS B CD 1 ATOM 1596 C CE . LYS F 2 61 ? 51.737 32.558 30.044 1.00 29.35 ? 261 LYS B CE 1 ATOM 1597 N NZ . LYS F 2 61 ? 51.636 33.893 30.725 1.00 31.69 ? 261 LYS B NZ 1 ATOM 1598 N N . ASN F 2 62 ? 49.615 28.564 26.333 1.00 15.53 ? 262 ASN B N 1 ATOM 1599 C CA . ASN F 2 62 ? 48.332 27.997 26.725 1.00 15.84 ? 262 ASN B CA 1 ATOM 1600 C C . ASN F 2 62 ? 47.910 28.651 28.063 1.00 18.02 ? 262 ASN B C 1 ATOM 1601 O O . ASN F 2 62 ? 48.715 28.724 29.020 1.00 19.77 ? 262 ASN B O 1 ATOM 1602 C CB . ASN F 2 62 ? 48.469 26.453 26.886 1.00 16.93 ? 262 ASN B CB 1 ATOM 1603 C CG . ASN F 2 62 ? 47.193 25.780 27.268 1.00 23.75 ? 262 ASN B CG 1 ATOM 1604 O OD1 . ASN F 2 62 ? 47.213 24.791 28.001 1.00 28.17 ? 262 ASN B OD1 1 ATOM 1605 N ND2 . ASN F 2 62 ? 46.073 26.247 26.753 1.00 17.56 ? 262 ASN B ND2 1 ATOM 1606 N N . VAL F 2 63 ? 46.686 29.178 28.095 1.00 15.56 ? 263 VAL B N 1 ATOM 1607 C CA . VAL F 2 63 ? 46.147 29.850 29.290 1.00 17.02 ? 263 VAL B CA 1 ATOM 1608 C C . VAL F 2 63 ? 44.710 29.426 29.477 1.00 19.19 ? 263 VAL B C 1 ATOM 1609 O O . VAL F 2 63 ? 44.096 28.864 28.562 1.00 20.15 ? 263 VAL B O 1 ATOM 1610 C CB . VAL F 2 63 ? 46.146 31.420 29.213 1.00 14.73 ? 263 VAL B CB 1 ATOM 1611 C CG1 . VAL F 2 63 ? 47.546 31.965 29.106 1.00 17.38 ? 263 VAL B CG1 1 ATOM 1612 C CG2 . VAL F 2 63 ? 45.237 31.932 28.034 1.00 15.60 ? 263 VAL B CG2 1 ATOM 1613 N N . ALA F 2 64 ? 44.144 29.695 30.663 1.00 18.15 ? 264 ALA B N 1 ATOM 1614 C CA . ALA F 2 64 ? 42.736 29.313 30.837 1.00 21.71 ? 264 ALA B CA 1 ATOM 1615 C C . ALA F 2 64 ? 41.886 30.361 30.128 1.00 20.23 ? 264 ALA B C 1 ATOM 1616 O O . ALA F 2 64 ? 42.239 31.521 30.075 1.00 21.49 ? 264 ALA B O 1 ATOM 1617 C CB . ALA F 2 64 ? 42.350 29.279 32.349 1.00 25.55 ? 264 ALA B CB 1 ATOM 1618 N N . CYS F 2 65 ? 40.763 29.922 29.612 1.00 18.62 ? 265 CYS B N 1 ATOM 1619 C CA . CYS F 2 65 ? 39.805 30.814 28.958 1.00 19.86 ? 265 CYS B CA 1 ATOM 1620 C C . CYS F 2 65 ? 39.058 31.479 30.091 1.00 18.51 ? 265 CYS B C 1 ATOM 1621 O O . CYS F 2 65 ? 38.975 30.914 31.203 1.00 19.34 ? 265 CYS B O 1 ATOM 1622 C CB . CYS F 2 65 ? 38.783 30.019 28.203 1.00 16.71 ? 265 CYS B CB 1 ATOM 1623 S SG . CYS F 2 65 ? 39.484 29.096 26.782 1.00 20.55 ? 265 CYS B SG 1 ATOM 1624 N N . LYS F 2 66 ? 38.446 32.602 29.789 1.00 17.36 ? 266 LYS B N 1 ATOM 1625 C CA . LYS F 2 66 ? 37.726 33.296 30.871 1.00 18.67 ? 266 LYS B CA 1 ATOM 1626 C C . LYS F 2 66 ? 36.478 32.523 31.363 1.00 23.81 ? 266 LYS B C 1 ATOM 1627 O O . LYS F 2 66 ? 35.989 32.795 32.472 1.00 22.55 ? 266 LYS B O 1 ATOM 1628 C CB . LYS F 2 66 ? 37.405 34.736 30.429 1.00 19.22 ? 266 LYS B CB 1 ATOM 1629 C CG . LYS F 2 66 ? 36.247 34.861 29.446 1.00 18.65 ? 266 LYS B CG 1 ATOM 1630 C CD . LYS F 2 66 ? 36.152 36.352 28.995 1.00 18.94 ? 266 LYS B CD 1 ATOM 1631 C CE . LYS F 2 66 ? 35.029 36.563 27.991 1.00 24.99 ? 266 LYS B CE 1 ATOM 1632 N NZ . LYS F 2 66 ? 35.333 36.097 26.568 1.00 18.33 ? 266 LYS B NZ 1 ATOM 1633 N N . ASN F 2 67 ? 35.973 31.562 30.584 1.00 19.50 ? 267 ASN B N 1 ATOM 1634 C CA . ASN F 2 67 ? 34.854 30.747 31.052 1.00 25.59 ? 267 ASN B CA 1 ATOM 1635 C C . ASN F 2 67 ? 35.358 29.480 31.768 1.00 25.75 ? 267 ASN B C 1 ATOM 1636 O O . ASN F 2 67 ? 34.567 28.589 32.107 1.00 27.86 ? 267 ASN B O 1 ATOM 1637 C CB . ASN F 2 67 ? 33.923 30.347 29.912 1.00 22.15 ? 267 ASN B CB 1 ATOM 1638 C CG . ASN F 2 67 ? 34.554 29.364 28.938 1.00 21.72 ? 267 ASN B CG 1 ATOM 1639 O OD1 . ASN F 2 67 ? 35.709 28.965 29.100 1.00 24.49 ? 267 ASN B OD1 1 ATOM 1640 N ND2 . ASN F 2 67 ? 33.781 28.967 27.915 1.00 25.68 ? 267 ASN B ND2 1 ATOM 1641 N N . GLY F 2 68 ? 36.662 29.393 31.993 1.00 22.91 ? 268 GLY B N 1 ATOM 1642 C CA . GLY F 2 68 ? 37.219 28.227 32.683 1.00 22.65 ? 268 GLY B CA 1 ATOM 1643 C C . GLY F 2 68 ? 37.742 27.091 31.804 1.00 26.73 ? 268 GLY B C 1 ATOM 1644 O O . GLY F 2 68 ? 38.505 26.237 32.272 1.00 27.96 ? 268 GLY B O 1 ATOM 1645 N N . GLN F 2 69 ? 37.344 27.058 30.536 1.00 25.01 ? 269 GLN B N 1 ATOM 1646 C CA . GLN F 2 69 ? 37.860 26.001 29.653 1.00 23.70 ? 269 GLN B CA 1 ATOM 1647 C C . GLN F 2 69 ? 39.365 26.119 29.525 1.00 25.08 ? 269 GLN B C 1 ATOM 1648 O O . GLN F 2 69 ? 39.935 27.135 29.880 1.00 24.24 ? 269 GLN B O 1 ATOM 1649 C CB . GLN F 2 69 ? 37.148 26.057 28.324 1.00 26.01 ? 269 GLN B CB 1 ATOM 1650 C CG . GLN F 2 69 ? 35.702 25.703 28.589 1.00 32.83 ? 269 GLN B CG 1 ATOM 1651 C CD . GLN F 2 69 ? 34.882 25.431 27.372 1.00 36.21 ? 269 GLN B CD 1 ATOM 1652 O OE1 . GLN F 2 69 ? 34.771 26.265 26.490 1.00 32.40 ? 269 GLN B OE1 1 ATOM 1653 N NE2 . GLN F 2 69 ? 34.275 24.245 27.323 1.00 41.38 ? 269 GLN B NE2 1 ATOM 1654 N N . THR F 2 70 ? 40.013 25.081 28.990 1.00 20.25 ? 270 THR B N 1 ATOM 1655 C CA . THR F 2 70 ? 41.453 25.069 28.928 1.00 19.43 ? 270 THR B CA 1 ATOM 1656 C C . THR F 2 70 ? 42.097 25.307 27.591 1.00 18.25 ? 270 THR B C 1 ATOM 1657 O O . THR F 2 70 ? 43.326 25.301 27.489 1.00 22.12 ? 270 THR B O 1 ATOM 1658 C CB . THR F 2 70 ? 41.982 23.695 29.425 1.00 25.38 ? 270 THR B CB 1 ATOM 1659 O OG1 . THR F 2 70 ? 41.453 22.647 28.580 1.00 28.52 ? 270 THR B OG1 1 ATOM 1660 C CG2 . THR F 2 70 ? 41.560 23.469 30.882 1.00 31.69 ? 270 THR B CG2 1 ATOM 1661 N N . ASN F 2 71 ? 41.282 25.543 26.582 1.00 18.62 ? 271 ASN B N 1 ATOM 1662 C CA . ASN F 2 71 ? 41.814 25.658 25.234 1.00 16.04 ? 271 ASN B CA 1 ATOM 1663 C C . ASN F 2 71 ? 42.091 27.049 24.690 1.00 15.47 ? 271 ASN B C 1 ATOM 1664 O O . ASN F 2 71 ? 41.949 27.286 23.485 1.00 15.99 ? 271 ASN B O 1 ATOM 1665 C CB . ASN F 2 71 ? 40.888 24.892 24.280 1.00 17.89 ? 271 ASN B CB 1 ATOM 1666 C CG . ASN F 2 71 ? 39.507 25.522 24.169 1.00 20.67 ? 271 ASN B CG 1 ATOM 1667 O OD1 . ASN F 2 71 ? 38.867 25.816 25.177 1.00 22.12 ? 271 ASN B OD1 1 ATOM 1668 N ND2 . ASN F 2 71 ? 39.035 25.723 22.937 1.00 17.94 ? 271 ASN B ND2 1 ATOM 1669 N N . CYS F 2 72 ? 42.543 27.941 25.553 1.00 16.72 ? 272 CYS B N 1 ATOM 1670 C CA . CYS F 2 72 ? 42.860 29.300 25.112 1.00 12.11 ? 272 CYS B CA 1 ATOM 1671 C C . CYS F 2 72 ? 44.339 29.465 25.018 1.00 15.65 ? 272 CYS B C 1 ATOM 1672 O O . CYS F 2 72 ? 45.103 28.777 25.699 1.00 16.30 ? 272 CYS B O 1 ATOM 1673 C CB . CYS F 2 72 ? 42.262 30.367 26.062 1.00 14.28 ? 272 CYS B CB 1 ATOM 1674 S SG . CYS F 2 72 ? 40.452 30.593 25.662 1.00 20.23 ? 272 CYS B SG 1 ATOM 1675 N N . TYR F 2 73 ? 44.765 30.398 24.163 1.00 10.81 ? 273 TYR B N 1 ATOM 1676 C CA . TYR F 2 73 ? 46.192 30.622 23.941 1.00 12.09 ? 273 TYR B CA 1 ATOM 1677 C C . TYR F 2 73 ? 46.419 32.097 23.864 1.00 12.58 ? 273 TYR B C 1 ATOM 1678 O O . TYR F 2 73 ? 45.646 32.844 23.240 1.00 12.16 ? 273 TYR B O 1 ATOM 1679 C CB . TYR F 2 73 ? 46.643 29.974 22.611 1.00 9.35 ? 273 TYR B CB 1 ATOM 1680 C CG . TYR F 2 73 ? 46.573 28.476 22.720 1.00 15.92 ? 273 TYR B CG 1 ATOM 1681 C CD1 . TYR F 2 73 ? 45.344 27.826 22.588 1.00 17.95 ? 273 TYR B CD1 1 ATOM 1682 C CD2 . TYR F 2 73 ? 47.696 27.734 23.062 1.00 20.19 ? 273 TYR B CD2 1 ATOM 1683 C CE1 . TYR F 2 73 ? 45.218 26.493 22.804 1.00 21.79 ? 273 TYR B CE1 1 ATOM 1684 C CE2 . TYR F 2 73 ? 47.578 26.356 23.285 1.00 21.36 ? 273 TYR B CE2 1 ATOM 1685 C CZ . TYR F 2 73 ? 46.317 25.764 23.145 1.00 19.33 ? 273 TYR B CZ 1 ATOM 1686 O OH . TYR F 2 73 ? 46.144 24.385 23.293 1.00 25.70 ? 273 TYR B OH 1 ATOM 1687 N N . GLN F 2 74 ? 47.520 32.531 24.477 1.00 11.98 ? 274 GLN B N 1 ATOM 1688 C CA . GLN F 2 74 ? 47.853 33.933 24.515 1.00 12.07 ? 274 GLN B CA 1 ATOM 1689 C C . GLN F 2 74 ? 49.090 34.217 23.633 1.00 12.17 ? 274 GLN B C 1 ATOM 1690 O O . GLN F 2 74 ? 50.069 33.465 23.666 1.00 14.96 ? 274 GLN B O 1 ATOM 1691 C CB . GLN F 2 74 ? 48.122 34.311 25.998 1.00 12.27 ? 274 GLN B CB 1 ATOM 1692 C CG . GLN F 2 74 ? 48.474 35.711 26.126 1.00 12.53 ? 274 GLN B CG 1 ATOM 1693 C CD . GLN F 2 74 ? 48.683 36.032 27.583 1.00 18.58 ? 274 GLN B CD 1 ATOM 1694 O OE1 . GLN F 2 74 ? 47.827 35.691 28.407 1.00 20.23 ? 274 GLN B OE1 1 ATOM 1695 N NE2 . GLN F 2 74 ? 49.802 36.666 27.915 1.00 19.95 ? 274 GLN B NE2 1 ATOM 1696 N N . SER F 2 75 ? 49.007 35.228 22.776 1.00 13.39 ? 275 SER B N 1 ATOM 1697 C CA . SER F 2 75 ? 50.100 35.510 21.863 1.00 13.27 ? 275 SER B CA 1 ATOM 1698 C C . SER F 2 75 ? 51.356 35.945 22.627 1.00 14.73 ? 275 SER B C 1 ATOM 1699 O O . SER F 2 75 ? 51.279 36.721 23.606 1.00 14.33 ? 275 SER B O 1 ATOM 1700 C CB . SER F 2 75 ? 49.715 36.638 20.859 1.00 13.02 ? 275 SER B CB 1 ATOM 1701 O OG . SER F 2 75 ? 49.381 37.928 21.478 1.00 11.70 ? 275 SER B OG 1 ATOM 1702 N N . TYR F 2 76 ? 52.506 35.428 22.186 1.00 12.42 ? 276 TYR B N 1 ATOM 1703 C CA . TYR F 2 76 ? 53.770 35.815 22.824 1.00 13.87 ? 276 TYR B CA 1 ATOM 1704 C C . TYR F 2 76 ? 54.099 37.292 22.624 1.00 15.44 ? 276 TYR B C 1 ATOM 1705 O O . TYR F 2 76 ? 54.671 37.937 23.520 1.00 16.13 ? 276 TYR B O 1 ATOM 1706 C CB . TYR F 2 76 ? 54.908 34.997 22.240 1.00 13.84 ? 276 TYR B CB 1 ATOM 1707 C CG . TYR F 2 76 ? 54.880 33.533 22.570 1.00 15.72 ? 276 TYR B CG 1 ATOM 1708 C CD1 . TYR F 2 76 ? 54.636 33.067 23.899 1.00 14.49 ? 276 TYR B CD1 1 ATOM 1709 C CD2 . TYR F 2 76 ? 55.198 32.586 21.581 1.00 19.62 ? 276 TYR B CD2 1 ATOM 1710 C CE1 . TYR F 2 76 ? 54.713 31.737 24.183 1.00 18.89 ? 276 TYR B CE1 1 ATOM 1711 C CE2 . TYR F 2 76 ? 55.275 31.223 21.875 1.00 19.78 ? 276 TYR B CE2 1 ATOM 1712 C CZ . TYR F 2 76 ? 55.028 30.817 23.176 1.00 20.41 ? 276 TYR B CZ 1 ATOM 1713 O OH . TYR F 2 76 ? 55.075 29.461 23.450 1.00 25.36 ? 276 TYR B OH 1 ATOM 1714 N N . SER F 2 77 ? 53.750 37.826 21.433 1.00 13.48 ? 277 SER B N 1 ATOM 1715 C CA . SER F 2 77 ? 53.966 39.236 21.126 1.00 16.12 ? 277 SER B CA 1 ATOM 1716 C C . SER F 2 77 ? 52.695 40.043 21.134 1.00 14.68 ? 277 SER B C 1 ATOM 1717 O O . SER F 2 77 ? 51.581 39.513 20.978 1.00 16.16 ? 277 SER B O 1 ATOM 1718 C CB . SER F 2 77 ? 54.582 39.416 19.730 1.00 17.59 ? 277 SER B CB 1 ATOM 1719 O OG . SER F 2 77 ? 55.857 38.795 19.688 1.00 17.29 ? 277 SER B OG 1 ATOM 1720 N N . THR F 2 78 ? 52.815 41.350 21.324 1.00 14.55 ? 278 THR B N 1 ATOM 1721 C CA . THR F 2 78 ? 51.566 42.113 21.199 1.00 16.98 ? 278 THR B CA 1 ATOM 1722 C C . THR F 2 78 ? 51.171 42.201 19.740 1.00 15.87 ? 278 THR B C 1 ATOM 1723 O O . THR F 2 78 ? 51.983 42.074 18.838 1.00 18.25 ? 278 THR B O 1 ATOM 1724 C CB . THR F 2 78 ? 51.695 43.558 21.692 1.00 20.22 ? 278 THR B CB 1 ATOM 1725 O OG1 . THR F 2 78 ? 52.724 44.240 20.956 1.00 21.02 ? 278 THR B OG1 1 ATOM 1726 C CG2 . THR F 2 78 ? 52.067 43.522 23.148 1.00 17.93 ? 278 THR B CG2 1 ATOM 1727 N N . MET F 2 79 ? 49.890 42.476 19.516 1.00 12.95 ? 279 MET B N 1 ATOM 1728 C CA . MET F 2 79 ? 49.370 42.615 18.182 1.00 12.16 ? 279 MET B CA 1 ATOM 1729 C C . MET F 2 79 ? 48.554 43.890 18.104 1.00 12.88 ? 279 MET B C 1 ATOM 1730 O O . MET F 2 79 ? 47.996 44.318 19.096 1.00 14.17 ? 279 MET B O 1 ATOM 1731 C CB . MET F 2 79 ? 48.440 41.435 17.834 1.00 13.18 ? 279 MET B CB 1 ATOM 1732 C CG . MET F 2 79 ? 49.219 40.131 17.774 1.00 14.49 ? 279 MET B CG 1 ATOM 1733 S SD . MET F 2 79 ? 48.128 38.839 17.176 1.00 15.26 ? 279 MET B SD 1 ATOM 1734 C CE . MET F 2 79 ? 49.417 37.522 16.831 1.00 15.93 ? 279 MET B CE 1 ATOM 1735 N N . SER F 2 80 ? 48.491 44.441 16.916 1.00 12.58 ? 280 SER B N 1 ATOM 1736 C CA . SER F 2 80 ? 47.644 45.612 16.668 1.00 12.89 ? 280 SER B CA 1 ATOM 1737 C C . SER F 2 80 ? 46.209 45.162 16.636 1.00 13.61 ? 280 SER B C 1 ATOM 1738 O O . SER F 2 80 ? 45.856 44.263 15.855 1.00 14.59 ? 280 SER B O 1 ATOM 1739 C CB . SER F 2 80 ? 47.996 46.245 15.315 1.00 15.76 ? 280 SER B CB 1 ATOM 1740 O OG . SER F 2 80 ? 47.101 47.321 15.066 1.00 17.27 ? 280 SER B OG 1 ATOM 1741 N N . ILE F 2 81 ? 45.366 45.749 17.487 1.00 12.10 ? 281 ILE B N 1 ATOM 1742 C CA . ILE F 2 81 ? 43.949 45.371 17.563 1.00 10.44 ? 281 ILE B CA 1 ATOM 1743 C C . ILE F 2 81 ? 43.047 46.596 17.724 1.00 13.42 ? 281 ILE B C 1 ATOM 1744 O O . ILE F 2 81 ? 43.521 47.706 18.042 1.00 15.42 ? 281 ILE B O 1 ATOM 1745 C CB . ILE F 2 81 ? 43.630 44.473 18.795 1.00 13.00 ? 281 ILE B CB 1 ATOM 1746 C CG1 . ILE F 2 81 ? 44.003 45.185 20.107 1.00 12.69 ? 281 ILE B CG1 1 ATOM 1747 C CG2 . ILE F 2 81 ? 44.459 43.164 18.689 1.00 14.03 ? 281 ILE B CG2 1 ATOM 1748 C CD1 . ILE F 2 81 ? 43.609 44.376 21.337 1.00 18.43 ? 281 ILE B CD1 1 ATOM 1749 N N . THR F 2 82 ? 41.763 46.388 17.442 1.00 13.46 ? 282 THR B N 1 ATOM 1750 C CA . THR F 2 82 ? 40.773 47.469 17.667 1.00 12.33 ? 282 THR B CA 1 ATOM 1751 C C . THR F 2 82 ? 39.683 46.932 18.542 1.00 14.46 ? 282 THR B C 1 ATOM 1752 O O . THR F 2 82 ? 39.083 45.869 18.271 1.00 15.36 ? 282 THR B O 1 ATOM 1753 C CB . THR F 2 82 ? 40.145 47.948 16.355 1.00 14.89 ? 282 THR B CB 1 ATOM 1754 O OG1 . THR F 2 82 ? 41.153 48.433 15.468 1.00 16.45 ? 282 THR B OG1 1 ATOM 1755 C CG2 . THR F 2 82 ? 39.143 49.056 16.677 1.00 15.81 ? 282 THR B CG2 1 ATOM 1756 N N . ASP F 2 83 ? 39.422 47.633 19.644 1.00 14.66 ? 283 ASP B N 1 ATOM 1757 C CA . ASP F 2 83 ? 38.354 47.243 20.555 1.00 14.57 ? 283 ASP B CA 1 ATOM 1758 C C . ASP F 2 83 ? 37.074 47.998 20.163 1.00 15.53 ? 283 ASP B C 1 ATOM 1759 O O . ASP F 2 83 ? 37.119 49.242 20.096 1.00 19.48 ? 283 ASP B O 1 ATOM 1760 C CB . ASP F 2 83 ? 38.700 47.625 22.014 1.00 17.89 ? 283 ASP B CB 1 ATOM 1761 C CG . ASP F 2 83 ? 39.775 46.701 22.646 1.00 26.60 ? 283 ASP B CG 1 ATOM 1762 O OD1 . ASP F 2 83 ? 39.883 45.532 22.226 1.00 27.48 ? 283 ASP B OD1 1 ATOM 1763 O OD2 . ASP F 2 83 ? 40.485 47.129 23.582 1.00 26.79 ? 283 ASP B OD2 1 ATOM 1764 N N . CYS F 2 84 ? 35.999 47.280 19.889 1.00 13.47 ? 284 CYS B N 1 ATOM 1765 C CA . CYS F 2 84 ? 34.687 47.865 19.532 1.00 15.31 ? 284 CYS B CA 1 ATOM 1766 C C . CYS F 2 84 ? 33.740 47.683 20.674 1.00 17.48 ? 284 CYS B C 1 ATOM 1767 O O . CYS F 2 84 ? 33.554 46.565 21.170 1.00 15.67 ? 284 CYS B O 1 ATOM 1768 C CB . CYS F 2 84 ? 34.111 47.200 18.279 1.00 19.98 ? 284 CYS B CB 1 ATOM 1769 S SG . CYS F 2 84 ? 35.147 47.466 16.783 1.00 22.19 ? 284 CYS B SG 1 ATOM 1770 N N . ARG F 2 85 ? 33.154 48.782 21.150 1.00 16.16 ? 285 ARG B N 1 ATOM 1771 C CA . ARG F 2 85 ? 32.226 48.672 22.303 1.00 14.82 ? 285 ARG B CA 1 ATOM 1772 C C . ARG F 2 85 ? 30.968 49.486 21.971 1.00 16.81 ? 285 ARG B C 1 ATOM 1773 O O . ARG F 2 85 ? 31.081 50.628 21.485 1.00 16.50 ? 285 ARG B O 1 ATOM 1774 C CB . ARG F 2 85 ? 32.843 49.268 23.583 1.00 21.28 ? 285 ARG B CB 1 ATOM 1775 C CG . ARG F 2 85 ? 34.094 48.558 24.102 1.00 24.21 ? 285 ARG B CG 1 ATOM 1776 C CD . ARG F 2 85 ? 33.638 47.308 24.825 1.00 29.89 ? 285 ARG B CD 1 ATOM 1777 N NE . ARG F 2 85 ? 34.679 46.277 24.907 1.00 37.99 ? 285 ARG B NE 1 ATOM 1778 C CZ . ARG F 2 85 ? 35.901 46.464 25.384 1.00 38.96 ? 285 ARG B CZ 1 ATOM 1779 N NH1 . ARG F 2 85 ? 36.254 47.671 25.836 1.00 44.19 ? 285 ARG B NH1 1 ATOM 1780 N NH2 . ARG F 2 85 ? 36.775 45.448 25.392 1.00 24.01 ? 285 ARG B NH2 1 ATOM 1781 N N . GLU F 2 86 ? 29.803 48.897 22.217 1.00 15.53 ? 286 GLU B N 1 ATOM 1782 C CA . GLU F 2 86 ? 28.527 49.615 21.983 1.00 15.27 ? 286 GLU B CA 1 ATOM 1783 C C . GLU F 2 86 ? 28.498 50.805 22.966 1.00 18.27 ? 286 GLU B C 1 ATOM 1784 O O . GLU F 2 86 ? 28.839 50.690 24.129 1.00 17.90 ? 286 GLU B O 1 ATOM 1785 C CB . GLU F 2 86 ? 27.348 48.669 22.195 1.00 16.39 ? 286 GLU B CB 1 ATOM 1786 C CG . GLU F 2 86 ? 25.969 49.370 22.087 1.00 21.10 ? 286 GLU B CG 1 ATOM 1787 C CD . GLU F 2 86 ? 24.808 48.403 22.038 1.00 22.54 ? 286 GLU B CD 1 ATOM 1788 O OE1 . GLU F 2 86 ? 24.850 47.401 22.782 1.00 25.12 ? 286 GLU B OE1 1 ATOM 1789 O OE2 . GLU F 2 86 ? 23.848 48.656 21.262 1.00 22.75 ? 286 GLU B OE2 1 ATOM 1790 N N . THR F 2 87 ? 28.086 51.965 22.469 1.00 15.71 ? 287 THR B N 1 ATOM 1791 C CA . THR F 2 87 ? 28.031 53.171 23.306 1.00 15.13 ? 287 THR B CA 1 ATOM 1792 C C . THR F 2 87 ? 26.673 53.308 23.991 1.00 16.64 ? 287 THR B C 1 ATOM 1793 O O . THR F 2 87 ? 25.729 52.587 23.694 1.00 17.43 ? 287 THR B O 1 ATOM 1794 C CB . THR F 2 87 ? 28.195 54.439 22.470 1.00 17.00 ? 287 THR B CB 1 ATOM 1795 O OG1 . THR F 2 87 ? 26.994 54.641 21.714 1.00 19.60 ? 287 THR B OG1 1 ATOM 1796 C CG2 . THR F 2 87 ? 29.400 54.340 21.521 1.00 20.37 ? 287 THR B CG2 1 ATOM 1797 N N . GLY F 2 88 ? 26.615 54.307 24.878 1.00 18.18 ? 288 GLY B N 1 ATOM 1798 C CA . GLY F 2 88 ? 25.403 54.597 25.622 1.00 22.19 ? 288 GLY B CA 1 ATOM 1799 C C . GLY F 2 88 ? 24.326 55.211 24.755 1.00 25.63 ? 288 GLY B C 1 ATOM 1800 O O . GLY F 2 88 ? 23.215 55.448 25.245 1.00 27.89 ? 288 GLY B O 1 ATOM 1801 N N . SER F 2 89 ? 24.646 55.494 23.493 1.00 20.86 ? 289 SER B N 1 ATOM 1802 C CA . SER F 2 89 ? 23.609 56.051 22.585 1.00 25.25 ? 289 SER B CA 1 ATOM 1803 C C . SER F 2 89 ? 23.102 55.017 21.581 1.00 24.87 ? 289 SER B C 1 ATOM 1804 O O . SER F 2 89 ? 22.196 55.281 20.777 1.00 29.52 ? 289 SER B O 1 ATOM 1805 C CB A SER F 2 89 ? 24.114 57.292 21.830 0.52 27.02 ? 289 SER B CB 1 ATOM 1806 C CB B SER F 2 89 ? 24.222 57.249 21.831 0.48 24.87 ? 289 SER B CB 1 ATOM 1807 O OG A SER F 2 89 ? 25.174 56.985 20.947 0.52 30.94 ? 289 SER B OG 1 ATOM 1808 O OG B SER F 2 89 ? 24.750 58.205 22.735 0.48 21.64 ? 289 SER B OG 1 ATOM 1809 N N . SER F 2 90 ? 23.665 53.820 21.634 1.00 22.20 ? 290 SER B N 1 ATOM 1810 C CA . SER F 2 90 ? 23.274 52.770 20.722 1.00 22.40 ? 290 SER B CA 1 ATOM 1811 C C . SER F 2 90 ? 21.972 52.067 21.054 1.00 26.30 ? 290 SER B C 1 ATOM 1812 O O . SER F 2 90 ? 21.688 51.763 22.210 1.00 31.05 ? 290 SER B O 1 ATOM 1813 C CB . SER F 2 90 ? 24.401 51.746 20.680 1.00 21.28 ? 290 SER B CB 1 ATOM 1814 O OG . SER F 2 90 ? 24.174 50.672 19.768 1.00 20.76 ? 290 SER B OG 1 ATOM 1815 N N . LYS F 2 91 ? 21.189 51.778 20.023 1.00 28.32 ? 291 LYS B N 1 ATOM 1816 C CA . LYS F 2 91 ? 19.952 51.044 20.230 1.00 31.87 ? 291 LYS B CA 1 ATOM 1817 C C . LYS F 2 91 ? 19.543 50.417 18.923 1.00 28.76 ? 291 LYS B C 1 ATOM 1818 O O . LYS F 2 91 ? 19.248 51.133 17.959 1.00 30.62 ? 291 LYS B O 1 ATOM 1819 C CB . LYS F 2 91 ? 18.829 51.945 20.740 1.00 38.02 ? 291 LYS B CB 1 ATOM 1820 C CG . LYS F 2 91 ? 17.525 51.176 20.874 1.00 38.75 ? 291 LYS B CG 1 ATOM 1821 C CD . LYS F 2 91 ? 16.440 51.986 21.562 1.00 44.53 ? 291 LYS B CD 1 ATOM 1822 C CE . LYS F 2 91 ? 15.113 51.208 21.516 1.00 48.06 ? 291 LYS B CE 1 ATOM 1823 N NZ . LYS F 2 91 ? 14.131 51.714 22.523 1.00 53.42 ? 291 LYS B NZ 1 ATOM 1824 N N . TYR F 2 92 ? 19.578 49.080 18.883 1.00 29.82 ? 292 TYR B N 1 ATOM 1825 C CA . TYR F 2 92 ? 19.229 48.313 17.683 1.00 27.14 ? 292 TYR B CA 1 ATOM 1826 C C . TYR F 2 92 ? 17.811 48.763 17.267 1.00 30.03 ? 292 TYR B C 1 ATOM 1827 O O . TYR F 2 92 ? 16.944 48.852 18.121 1.00 33.64 ? 292 TYR B O 1 ATOM 1828 C CB . TYR F 2 92 ? 19.205 46.813 18.016 1.00 31.46 ? 292 TYR B CB 1 ATOM 1829 C CG . TYR F 2 92 ? 18.797 45.929 16.852 1.00 29.98 ? 292 TYR B CG 1 ATOM 1830 C CD1 . TYR F 2 92 ? 19.723 45.567 15.875 1.00 31.91 ? 292 TYR B CD1 1 ATOM 1831 C CD2 . TYR F 2 92 ? 17.457 45.511 16.683 1.00 36.50 ? 292 TYR B CD2 1 ATOM 1832 C CE1 . TYR F 2 92 ? 19.341 44.818 14.744 1.00 29.73 ? 292 TYR B CE1 1 ATOM 1833 C CE2 . TYR F 2 92 ? 17.060 44.754 15.553 1.00 33.70 ? 292 TYR B CE2 1 ATOM 1834 C CZ . TYR F 2 92 ? 18.010 44.422 14.587 1.00 34.35 ? 292 TYR B CZ 1 ATOM 1835 O OH . TYR F 2 92 ? 17.645 43.757 13.442 1.00 33.22 ? 292 TYR B OH 1 ATOM 1836 N N . PRO F 2 93 ? 17.561 48.940 15.963 1.00 32.15 ? 293 PRO B N 1 ATOM 1837 C CA . PRO F 2 93 ? 18.467 48.742 14.821 1.00 31.98 ? 293 PRO B CA 1 ATOM 1838 C C . PRO F 2 93 ? 19.430 49.857 14.476 1.00 27.91 ? 293 PRO B C 1 ATOM 1839 O O . PRO F 2 93 ? 19.973 49.891 13.372 1.00 33.58 ? 293 PRO B O 1 ATOM 1840 C CB . PRO F 2 93 ? 17.509 48.460 13.668 1.00 34.13 ? 293 PRO B CB 1 ATOM 1841 C CG . PRO F 2 93 ? 16.390 49.453 13.955 1.00 32.54 ? 293 PRO B CG 1 ATOM 1842 C CD . PRO F 2 93 ? 16.209 49.328 15.489 1.00 35.07 ? 293 PRO B CD 1 ATOM 1843 N N . ASN F 2 94 ? 19.654 50.778 15.401 1.00 28.22 ? 294 ASN B N 1 ATOM 1844 C CA . ASN F 2 94 ? 20.595 51.855 15.137 1.00 26.80 ? 294 ASN B CA 1 ATOM 1845 C C . ASN F 2 94 ? 21.798 51.719 16.103 1.00 26.48 ? 294 ASN B C 1 ATOM 1846 O O . ASN F 2 94 ? 21.905 52.415 17.117 1.00 29.07 ? 294 ASN B O 1 ATOM 1847 C CB . ASN F 2 94 ? 19.879 53.187 15.292 1.00 29.49 ? 294 ASN B CB 1 ATOM 1848 C CG . ASN F 2 94 ? 18.815 53.379 14.205 1.00 30.61 ? 294 ASN B CG 1 ATOM 1849 O OD1 . ASN F 2 94 ? 19.139 53.588 13.043 1.00 37.25 ? 294 ASN B OD1 1 ATOM 1850 N ND2 . ASN F 2 94 ? 17.557 53.251 14.579 1.00 35.27 ? 294 ASN B ND2 1 ATOM 1851 N N . CYS F 2 95 ? 22.668 50.769 15.771 1.00 25.15 ? 295 CYS B N 1 ATOM 1852 C CA . CYS F 2 95 ? 23.841 50.472 16.602 1.00 23.18 ? 295 CYS B CA 1 ATOM 1853 C C . CYS F 2 95 ? 24.894 51.560 16.528 1.00 23.85 ? 295 CYS B C 1 ATOM 1854 O O . CYS F 2 95 ? 25.067 52.212 15.500 1.00 29.32 ? 295 CYS B O 1 ATOM 1855 C CB . CYS F 2 95 ? 24.425 49.152 16.140 1.00 25.06 ? 295 CYS B CB 1 ATOM 1856 S SG . CYS F 2 95 ? 23.259 47.752 16.208 1.00 26.42 ? 295 CYS B SG 1 ATOM 1857 N N . ALA F 2 96 ? 25.623 51.788 17.618 1.00 19.38 ? 296 ALA B N 1 ATOM 1858 C CA . ALA F 2 96 ? 26.666 52.810 17.603 1.00 17.45 ? 296 ALA B CA 1 ATOM 1859 C C . ALA F 2 96 ? 27.780 52.252 18.459 1.00 16.16 ? 296 ALA B C 1 ATOM 1860 O O . ALA F 2 96 ? 27.518 51.683 19.502 1.00 19.14 ? 296 ALA B O 1 ATOM 1861 C CB . ALA F 2 96 ? 26.160 54.130 18.198 1.00 19.83 ? 296 ALA B CB 1 ATOM 1862 N N . TYR F 2 97 ? 28.991 52.435 17.999 1.00 17.37 ? 297 TYR B N 1 ATOM 1863 C CA . TYR F 2 97 ? 30.175 51.886 18.669 1.00 16.63 ? 297 TYR B CA 1 ATOM 1864 C C . TYR F 2 97 ? 31.283 52.906 18.865 1.00 15.61 ? 297 TYR B C 1 ATOM 1865 O O . TYR F 2 97 ? 31.488 53.848 18.048 1.00 19.50 ? 297 TYR B O 1 ATOM 1866 C CB . TYR F 2 97 ? 30.775 50.757 17.765 1.00 15.19 ? 297 TYR B CB 1 ATOM 1867 C CG . TYR F 2 97 ? 29.976 49.525 17.723 1.00 16.24 ? 297 TYR B CG 1 ATOM 1868 C CD1 . TYR F 2 97 ? 30.112 48.547 18.726 1.00 14.24 ? 297 TYR B CD1 1 ATOM 1869 C CD2 . TYR F 2 97 ? 29.027 49.328 16.744 1.00 18.23 ? 297 TYR B CD2 1 ATOM 1870 C CE1 . TYR F 2 97 ? 29.310 47.416 18.727 1.00 13.28 ? 297 TYR B CE1 1 ATOM 1871 C CE2 . TYR F 2 97 ? 28.240 48.210 16.737 1.00 20.27 ? 297 TYR B CE2 1 ATOM 1872 C CZ . TYR F 2 97 ? 28.377 47.258 17.728 1.00 17.23 ? 297 TYR B CZ 1 ATOM 1873 O OH . TYR F 2 97 ? 27.545 46.191 17.763 1.00 17.67 ? 297 TYR B OH 1 ATOM 1874 N N . LYS F 2 98 ? 32.053 52.693 19.937 1.00 14.57 ? 298 LYS B N 1 ATOM 1875 C CA . LYS F 2 98 ? 33.247 53.464 20.247 1.00 15.59 ? 298 LYS B CA 1 ATOM 1876 C C . LYS F 2 98 ? 34.381 52.561 19.710 1.00 16.51 ? 298 LYS B C 1 ATOM 1877 O O . LYS F 2 98 ? 34.353 51.353 19.968 1.00 18.94 ? 298 LYS B O 1 ATOM 1878 C CB . LYS F 2 98 ? 33.416 53.595 21.753 1.00 16.97 ? 298 LYS B CB 1 ATOM 1879 C CG . LYS F 2 98 ? 34.776 54.099 22.218 1.00 21.49 ? 298 LYS B CG 1 ATOM 1880 C CD . LYS F 2 98 ? 34.818 54.298 23.747 1.00 31.60 ? 298 LYS B CD 1 ATOM 1881 C CE . LYS F 2 98 ? 34.452 53.034 24.563 1.00 32.29 ? 298 LYS B CE 1 ATOM 1882 N NZ . LYS F 2 98 ? 34.787 53.250 26.034 1.00 35.00 ? 298 LYS B NZ 1 ATOM 1883 N N . THR F 2 99 ? 35.333 53.162 19.012 1.00 17.92 ? 299 THR B N 1 ATOM 1884 C CA . THR F 2 99 ? 36.527 52.502 18.441 1.00 17.37 ? 299 THR B CA 1 ATOM 1885 C C . THR F 2 99 ? 37.747 52.879 19.257 1.00 17.58 ? 299 THR B C 1 ATOM 1886 O O . THR F 2 99 ? 38.003 54.052 19.465 1.00 17.29 ? 299 THR B O 1 ATOM 1887 C CB . THR F 2 99 ? 36.751 53.013 16.991 1.00 16.96 ? 299 THR B CB 1 ATOM 1888 O OG1 . THR F 2 99 ? 35.644 52.602 16.186 1.00 14.93 ? 299 THR B OG1 1 ATOM 1889 C CG2 . THR F 2 99 ? 38.073 52.498 16.416 1.00 19.94 ? 299 THR B CG2 1 ATOM 1890 N N . THR F 2 100 ? 38.497 51.883 19.749 1.00 16.69 ? 300 THR B N 1 ATOM 1891 C CA . THR F 2 100 ? 39.718 52.193 20.507 1.00 14.55 ? 300 THR B CA 1 ATOM 1892 C C . THR F 2 100 ? 40.827 51.343 19.964 1.00 18.18 ? 300 THR B C 1 ATOM 1893 O O . THR F 2 100 ? 40.678 50.134 19.913 1.00 20.18 ? 300 THR B O 1 ATOM 1894 C CB . THR F 2 100 ? 39.538 51.864 21.983 1.00 20.59 ? 300 THR B CB 1 ATOM 1895 O OG1 . THR F 2 100 ? 38.377 52.550 22.472 1.00 20.72 ? 300 THR B OG1 1 ATOM 1896 C CG2 . THR F 2 100 ? 40.775 52.290 22.777 1.00 21.26 ? 300 THR B CG2 1 ATOM 1897 N N . GLN F 2 101 ? 41.922 51.971 19.538 1.00 17.68 ? 301 GLN B N 1 ATOM 1898 C CA . GLN F 2 101 ? 43.075 51.226 19.016 1.00 19.29 ? 301 GLN B CA 1 ATOM 1899 C C . GLN F 2 101 ? 43.901 50.759 20.202 1.00 21.62 ? 301 GLN B C 1 ATOM 1900 O O . GLN F 2 101 ? 43.982 51.462 21.234 1.00 20.95 ? 301 GLN B O 1 ATOM 1901 C CB . GLN F 2 101 ? 43.988 52.153 18.224 1.00 21.07 ? 301 GLN B CB 1 ATOM 1902 C CG . GLN F 2 101 ? 43.344 52.847 17.055 1.00 27.69 ? 301 GLN B CG 1 ATOM 1903 C CD . GLN F 2 101 ? 44.379 53.697 16.299 1.00 34.20 ? 301 GLN B CD 1 ATOM 1904 O OE1 . GLN F 2 101 ? 45.345 54.166 16.886 1.00 39.30 ? 301 GLN B OE1 1 ATOM 1905 N NE2 . GLN F 2 101 ? 44.170 53.892 15.010 1.00 35.79 ? 301 GLN B NE2 1 ATOM 1906 N N . ALA F 2 102 ? 44.547 49.596 20.063 1.00 18.56 ? 302 ALA B N 1 ATOM 1907 C CA . ALA F 2 102 ? 45.413 49.075 21.109 1.00 21.39 ? 302 ALA B CA 1 ATOM 1908 C C . ALA F 2 102 ? 46.486 48.165 20.519 1.00 19.00 ? 302 ALA B C 1 ATOM 1909 O O . ALA F 2 102 ? 46.461 47.840 19.335 1.00 15.92 ? 302 ALA B O 1 ATOM 1910 C CB . ALA F 2 102 ? 44.622 48.309 22.130 1.00 20.59 ? 302 ALA B CB 1 ATOM 1911 N N . ASN F 2 103 ? 47.459 47.808 21.352 1.00 20.87 ? 303 ASN B N 1 ATOM 1912 C CA . ASN F 2 103 ? 48.536 46.870 20.933 1.00 18.90 ? 303 ASN B CA 1 ATOM 1913 C C . ASN F 2 103 ? 48.669 46.039 22.167 1.00 17.47 ? 303 ASN B C 1 ATOM 1914 O O . ASN F 2 103 ? 49.200 46.511 23.201 1.00 20.54 ? 303 ASN B O 1 ATOM 1915 C CB . ASN F 2 103 ? 49.862 47.583 20.640 1.00 23.76 ? 303 ASN B CB 1 ATOM 1916 C CG . ASN F 2 103 ? 49.829 48.339 19.341 1.00 31.04 ? 303 ASN B CG 1 ATOM 1917 O OD1 . ASN F 2 103 ? 49.477 49.537 19.309 1.00 32.10 ? 303 ASN B OD1 1 ATOM 1918 N ND2 . ASN F 2 103 ? 50.169 47.658 18.252 1.00 21.54 ? 303 ASN B ND2 1 ATOM 1919 N N . LYS F 2 104 ? 48.132 44.834 22.112 1.00 14.01 ? 304 LYS B N 1 ATOM 1920 C CA . LYS F 2 104 ? 48.079 43.958 23.263 1.00 13.77 ? 304 LYS B CA 1 ATOM 1921 C C . LYS F 2 104 ? 48.254 42.518 22.875 1.00 14.43 ? 304 LYS B C 1 ATOM 1922 O O . LYS F 2 104 ? 48.150 42.173 21.695 1.00 14.52 ? 304 LYS B O 1 ATOM 1923 C CB . LYS F 2 104 ? 46.723 44.085 23.949 1.00 17.64 ? 304 LYS B CB 1 ATOM 1924 C CG . LYS F 2 104 ? 46.433 45.528 24.505 1.00 20.99 ? 304 LYS B CG 1 ATOM 1925 C CD . LYS F 2 104 ? 45.049 45.671 25.079 1.00 24.80 ? 304 LYS B CD 1 ATOM 1926 C CE . LYS F 2 104 ? 44.808 44.840 26.313 1.00 31.42 ? 304 LYS B CE 1 ATOM 1927 N NZ . LYS F 2 104 ? 43.530 45.260 27.031 1.00 34.11 ? 304 LYS B NZ 1 ATOM 1928 N N . HIS F 2 105 ? 48.536 41.674 23.847 1.00 14.27 ? 305 HIS B N 1 ATOM 1929 C CA . HIS F 2 105 ? 48.609 40.248 23.546 1.00 14.50 ? 305 HIS B CA 1 ATOM 1930 C C . HIS F 2 105 ? 47.166 39.738 23.407 1.00 17.19 ? 305 HIS B C 1 ATOM 1931 O O . HIS F 2 105 ? 46.351 40.006 24.287 1.00 19.85 ? 305 HIS B O 1 ATOM 1932 C CB . HIS F 2 105 ? 49.266 39.520 24.704 1.00 16.40 ? 305 HIS B CB 1 ATOM 1933 C CG . HIS F 2 105 ? 50.647 40.013 24.970 1.00 15.57 ? 305 HIS B CG 1 ATOM 1934 N ND1 . HIS F 2 105 ? 50.895 41.130 25.743 1.00 23.34 ? 305 HIS B ND1 1 ATOM 1935 C CD2 . HIS F 2 105 ? 51.861 39.567 24.548 1.00 16.26 ? 305 HIS B CD2 1 ATOM 1936 C CE1 . HIS F 2 105 ? 52.199 41.347 25.802 1.00 21.47 ? 305 HIS B CE1 1 ATOM 1937 N NE2 . HIS F 2 105 ? 52.812 40.414 25.089 1.00 18.76 ? 305 HIS B NE2 1 ATOM 1938 N N . ILE F 2 106 ? 46.846 38.986 22.349 1.00 12.50 ? 306 ILE B N 1 ATOM 1939 C CA . ILE F 2 106 ? 45.478 38.441 22.243 1.00 11.19 ? 306 ILE B CA 1 ATOM 1940 C C . ILE F 2 106 ? 45.340 37.055 22.884 1.00 12.07 ? 306 ILE B C 1 ATOM 1941 O O . ILE F 2 106 ? 46.319 36.330 23.006 1.00 13.59 ? 306 ILE B O 1 ATOM 1942 C CB . ILE F 2 106 ? 45.015 38.369 20.763 1.00 9.01 ? 306 ILE B CB 1 ATOM 1943 C CG1 . ILE F 2 106 ? 45.833 37.389 19.973 1.00 15.07 ? 306 ILE B CG1 1 ATOM 1944 C CG2 . ILE F 2 106 ? 45.076 39.775 20.163 1.00 12.57 ? 306 ILE B CG2 1 ATOM 1945 C CD1 . ILE F 2 106 ? 45.198 37.091 18.552 1.00 14.70 ? 306 ILE B CD1 1 ATOM 1946 N N . ILE F 2 107 ? 44.132 36.702 23.309 1.00 9.82 ? 307 ILE B N 1 ATOM 1947 C CA . ILE F 2 107 ? 43.878 35.395 23.912 1.00 10.36 ? 307 ILE B CA 1 ATOM 1948 C C . ILE F 2 107 ? 42.691 34.839 23.107 1.00 11.58 ? 307 ILE B C 1 ATOM 1949 O O . ILE F 2 107 ? 41.622 35.483 23.015 1.00 11.17 ? 307 ILE B O 1 ATOM 1950 C CB . ILE F 2 107 ? 43.472 35.524 25.374 1.00 12.50 ? 307 ILE B CB 1 ATOM 1951 C CG1 . ILE F 2 107 ? 44.616 36.242 26.116 1.00 15.20 ? 307 ILE B CG1 1 ATOM 1952 C CG2 . ILE F 2 107 ? 43.087 34.181 25.896 1.00 13.90 ? 307 ILE B CG2 1 ATOM 1953 C CD1 . ILE F 2 107 ? 44.237 36.664 27.561 1.00 17.98 ? 307 ILE B CD1 1 ATOM 1954 N N . VAL F 2 108 ? 42.938 33.716 22.428 1.00 12.29 ? 308 VAL B N 1 ATOM 1955 C CA . VAL F 2 108 ? 41.900 33.100 21.584 1.00 13.64 ? 308 VAL B CA 1 ATOM 1956 C C . VAL F 2 108 ? 41.669 31.664 21.989 1.00 14.81 ? 308 VAL B C 1 ATOM 1957 O O . VAL F 2 108 ? 42.584 31.034 22.514 1.00 16.74 ? 308 VAL B O 1 ATOM 1958 C CB . VAL F 2 108 ? 42.300 33.138 20.049 1.00 14.55 ? 308 VAL B CB 1 ATOM 1959 C CG1 . VAL F 2 108 ? 42.404 34.641 19.595 1.00 12.95 ? 308 VAL B CG1 1 ATOM 1960 C CG2 . VAL F 2 108 ? 43.736 32.487 19.799 1.00 13.08 ? 308 VAL B CG2 1 ATOM 1961 N N . ALA F 2 109 ? 40.443 31.169 21.756 1.00 11.50 ? 309 ALA B N 1 ATOM 1962 C CA . ALA F 2 109 ? 40.071 29.782 22.036 1.00 10.35 ? 309 ALA B CA 1 ATOM 1963 C C . ALA F 2 109 ? 40.327 29.054 20.725 1.00 14.44 ? 309 ALA B C 1 ATOM 1964 O O . ALA F 2 109 ? 39.914 29.534 19.701 1.00 14.24 ? 309 ALA B O 1 ATOM 1965 C CB . ALA F 2 109 ? 38.574 29.660 22.393 1.00 14.59 ? 309 ALA B CB 1 ATOM 1966 N N . CYS F 2 110 ? 40.998 27.900 20.781 1.00 13.18 ? 310 CYS B N 1 ATOM 1967 C CA . CYS F 2 110 ? 41.340 27.140 19.538 1.00 12.73 ? 310 CYS B CA 1 ATOM 1968 C C . CYS F 2 110 ? 40.719 25.774 19.534 1.00 13.14 ? 310 CYS B C 1 ATOM 1969 O O . CYS F 2 110 ? 40.605 25.141 20.567 1.00 15.50 ? 310 CYS B O 1 ATOM 1970 C CB . CYS F 2 110 ? 42.848 26.979 19.422 1.00 15.15 ? 310 CYS B CB 1 ATOM 1971 S SG . CYS F 2 110 ? 43.736 28.630 19.351 1.00 17.72 ? 310 CYS B SG 1 ATOM 1972 N N . GLU F 2 111 ? 40.306 25.325 18.335 1.00 13.11 ? 311 GLU B N 1 ATOM 1973 C CA . GLU F 2 111 ? 39.709 23.999 18.206 1.00 14.60 ? 311 GLU B CA 1 ATOM 1974 C C . GLU F 2 111 ? 40.174 23.432 16.884 1.00 15.88 ? 311 GLU B C 1 ATOM 1975 O O . GLU F 2 111 ? 40.447 24.167 15.931 1.00 14.86 ? 311 GLU B O 1 ATOM 1976 C CB . GLU F 2 111 ? 38.168 24.045 18.213 1.00 17.37 ? 311 GLU B CB 1 ATOM 1977 C CG . GLU F 2 111 ? 37.618 24.354 19.614 1.00 18.35 ? 311 GLU B CG 1 ATOM 1978 C CD . GLU F 2 111 ? 36.100 24.300 19.695 1.00 26.76 ? 311 GLU B CD 1 ATOM 1979 O OE1 . GLU F 2 111 ? 35.471 23.782 18.774 1.00 30.77 ? 311 GLU B OE1 1 ATOM 1980 O OE2 . GLU F 2 111 ? 35.529 24.755 20.688 1.00 26.59 ? 311 GLU B OE2 1 ATOM 1981 N N . GLY F 2 112 ? 40.205 22.102 16.856 1.00 14.70 ? 312 GLY B N 1 ATOM 1982 C CA . GLY F 2 112 ? 40.585 21.413 15.636 1.00 15.11 ? 312 GLY B CA 1 ATOM 1983 C C . GLY F 2 112 ? 40.007 20.005 15.715 1.00 18.40 ? 312 GLY B C 1 ATOM 1984 O O . GLY F 2 112 ? 39.287 19.666 16.655 1.00 19.12 ? 312 GLY B O 1 ATOM 1985 N N . ASN F 2 113 ? 40.242 19.209 14.672 1.00 15.47 ? 313 ASN B N 1 ATOM 1986 C CA . ASN F 2 113 ? 39.811 17.773 14.705 1.00 16.48 ? 313 ASN B CA 1 ATOM 1987 C C . ASN F 2 113 ? 41.057 16.990 14.334 1.00 16.31 ? 313 ASN B C 1 ATOM 1988 O O . ASN F 2 113 ? 41.460 17.031 13.183 1.00 18.08 ? 313 ASN B O 1 ATOM 1989 C CB . ASN F 2 113 ? 38.710 17.515 13.665 1.00 19.00 ? 313 ASN B CB 1 ATOM 1990 C CG . ASN F 2 113 ? 37.428 18.239 14.023 1.00 25.74 ? 313 ASN B CG 1 ATOM 1991 O OD1 . ASN F 2 113 ? 37.118 19.280 13.451 1.00 25.56 ? 313 ASN B OD1 1 ATOM 1992 N ND2 . ASN F 2 113 ? 36.703 17.720 15.018 1.00 23.11 ? 313 ASN B ND2 1 ATOM 1993 N N . PRO F 2 114 ? 41.676 16.268 15.285 1.00 15.15 ? 314 PRO B N 1 ATOM 1994 C CA . PRO F 2 114 ? 42.889 15.499 14.992 1.00 15.12 ? 314 PRO B CA 1 ATOM 1995 C C . PRO F 2 114 ? 42.711 14.615 13.771 1.00 16.33 ? 314 PRO B C 1 ATOM 1996 O O . PRO F 2 114 ? 41.610 14.041 13.557 1.00 16.16 ? 314 PRO B O 1 ATOM 1997 C CB . PRO F 2 114 ? 43.104 14.675 16.253 1.00 17.59 ? 314 PRO B CB 1 ATOM 1998 C CG . PRO F 2 114 ? 42.569 15.627 17.311 1.00 19.18 ? 314 PRO B CG 1 ATOM 1999 C CD . PRO F 2 114 ? 41.282 16.104 16.695 1.00 19.69 ? 314 PRO B CD 1 ATOM 2000 N N . TYR F 2 115 ? 43.774 14.554 12.978 1.00 14.95 ? 315 TYR B N 1 ATOM 2001 C CA . TYR F 2 115 ? 43.726 13.785 11.732 1.00 12.88 ? 315 TYR B CA 1 ATOM 2002 C C . TYR F 2 115 ? 43.717 12.303 12.061 1.00 14.20 ? 315 TYR B C 1 ATOM 2003 O O . TYR F 2 115 ? 44.561 11.840 12.828 1.00 16.25 ? 315 TYR B O 1 ATOM 2004 C CB . TYR F 2 115 ? 44.916 14.156 10.853 1.00 13.32 ? 315 TYR B CB 1 ATOM 2005 C CG . TYR F 2 115 ? 44.661 15.518 10.246 1.00 13.25 ? 315 TYR B CG 1 ATOM 2006 C CD1 . TYR F 2 115 ? 44.773 16.687 11.022 1.00 17.74 ? 315 TYR B CD1 1 ATOM 2007 C CD2 . TYR F 2 115 ? 44.231 15.635 8.914 1.00 15.95 ? 315 TYR B CD2 1 ATOM 2008 C CE1 . TYR F 2 115 ? 44.463 17.959 10.487 1.00 20.07 ? 315 TYR B CE1 1 ATOM 2009 C CE2 . TYR F 2 115 ? 43.922 16.928 8.366 1.00 19.32 ? 315 TYR B CE2 1 ATOM 2010 C CZ . TYR F 2 115 ? 44.051 18.060 9.185 1.00 18.09 ? 315 TYR B CZ 1 ATOM 2011 O OH . TYR F 2 115 ? 43.746 19.313 8.668 1.00 21.02 ? 315 TYR B OH 1 ATOM 2012 N N . VAL F 2 116 ? 42.745 11.592 11.477 1.00 12.55 ? 316 VAL B N 1 ATOM 2013 C CA . VAL F 2 116 ? 42.647 10.139 11.756 1.00 12.55 ? 316 VAL B CA 1 ATOM 2014 C C . VAL F 2 116 ? 42.410 9.459 10.416 1.00 13.07 ? 316 VAL B C 1 ATOM 2015 O O . VAL F 2 116 ? 42.025 10.079 9.443 1.00 12.86 ? 316 VAL B O 1 ATOM 2016 C CB . VAL F 2 116 ? 41.500 9.818 12.729 1.00 16.54 ? 316 VAL B CB 1 ATOM 2017 C CG1 . VAL F 2 116 ? 41.749 10.419 14.117 1.00 16.35 ? 316 VAL B CG1 1 ATOM 2018 C CG2 . VAL F 2 116 ? 40.214 10.360 12.170 1.00 16.80 ? 316 VAL B CG2 1 ATOM 2019 N N . PRO F 2 117 ? 42.695 8.162 10.314 1.00 12.93 ? 317 PRO B N 1 ATOM 2020 C CA . PRO F 2 117 ? 42.495 7.493 9.013 1.00 11.48 ? 317 PRO B CA 1 ATOM 2021 C C . PRO F 2 117 ? 41.022 7.332 8.660 1.00 12.17 ? 317 PRO B C 1 ATOM 2022 O O . PRO F 2 117 ? 40.188 7.057 9.556 1.00 15.00 ? 317 PRO B O 1 ATOM 2023 C CB . PRO F 2 117 ? 43.147 6.103 9.218 1.00 12.90 ? 317 PRO B CB 1 ATOM 2024 C CG . PRO F 2 117 ? 44.079 6.281 10.371 1.00 15.08 ? 317 PRO B CG 1 ATOM 2025 C CD . PRO F 2 117 ? 43.332 7.270 11.301 1.00 15.03 ? 317 PRO B CD 1 ATOM 2026 N N . VAL F 2 118 ? 40.718 7.487 7.374 1.00 10.81 ? 318 VAL B N 1 ATOM 2027 C CA . VAL F 2 118 ? 39.358 7.288 6.899 1.00 10.96 ? 318 VAL B CA 1 ATOM 2028 C C . VAL F 2 118 ? 39.265 6.307 5.733 1.00 14.69 ? 318 VAL B C 1 ATOM 2029 O O . VAL F 2 118 ? 38.172 5.940 5.347 1.00 16.52 ? 318 VAL B O 1 ATOM 2030 C CB . VAL F 2 118 ? 38.673 8.608 6.501 1.00 13.45 ? 318 VAL B CB 1 ATOM 2031 C CG1 . VAL F 2 118 ? 38.559 9.493 7.749 1.00 15.22 ? 318 VAL B CG1 1 ATOM 2032 C CG2 . VAL F 2 118 ? 39.443 9.325 5.375 1.00 22.22 ? 318 VAL B CG2 1 ATOM 2033 N N . HIS F 2 119 ? 40.394 5.904 5.155 1.00 13.68 ? 319 HIS B N 1 ATOM 2034 C CA . HIS F 2 119 ? 40.345 4.936 4.057 1.00 10.98 ? 319 HIS B CA 1 ATOM 2035 C C . HIS F 2 119 ? 41.683 4.186 4.084 1.00 12.46 ? 319 HIS B C 1 ATOM 2036 O O . HIS F 2 119 ? 42.751 4.752 4.364 1.00 12.92 ? 319 HIS B O 1 ATOM 2037 C CB A HIS F 2 119 ? 40.122 5.661 2.681 0.66 14.28 ? 319 HIS B CB 1 ATOM 2038 C CB B HIS F 2 119 ? 40.408 5.746 2.662 0.34 15.50 ? 319 HIS B CB 1 ATOM 2039 C CG A HIS F 2 119 ? 40.795 5.029 1.490 0.66 16.30 ? 319 HIS B CG 1 ATOM 2040 C CG B HIS F 2 119 ? 39.277 6.714 2.499 0.34 14.86 ? 319 HIS B CG 1 ATOM 2041 N ND1 A HIS F 2 119 ? 40.254 3.965 0.797 0.66 16.15 ? 319 HIS B ND1 1 ATOM 2042 N ND1 B HIS F 2 119 ? 37.962 6.351 2.680 0.34 13.19 ? 319 HIS B ND1 1 ATOM 2043 C CD2 A HIS F 2 119 ? 41.934 5.370 0.824 0.66 13.36 ? 319 HIS B CD2 1 ATOM 2044 C CD2 B HIS F 2 119 ? 39.264 8.028 2.159 0.34 12.81 ? 319 HIS B CD2 1 ATOM 2045 C CE1 A HIS F 2 119 ? 41.029 3.680 -0.241 0.66 16.70 ? 319 HIS B CE1 1 ATOM 2046 C CE1 B HIS F 2 119 ? 37.186 7.398 2.463 0.34 13.21 ? 319 HIS B CE1 1 ATOM 2047 N NE2 A HIS F 2 119 ? 42.051 4.518 -0.243 0.66 16.71 ? 319 HIS B NE2 1 ATOM 2048 N NE2 B HIS F 2 119 ? 37.950 8.426 2.145 0.34 15.43 ? 319 HIS B NE2 1 ATOM 2049 N N . PHE F 2 120 ? 41.607 2.893 3.777 1.00 12.54 ? 320 PHE B N 1 ATOM 2050 C CA . PHE F 2 120 ? 42.839 2.077 3.740 1.00 12.72 ? 320 PHE B CA 1 ATOM 2051 C C . PHE F 2 120 ? 43.209 2.023 2.246 1.00 15.92 ? 320 PHE B C 1 ATOM 2052 O O . PHE F 2 120 ? 42.418 1.542 1.409 1.00 14.96 ? 320 PHE B O 1 ATOM 2053 C CB . PHE F 2 120 ? 42.596 0.655 4.303 1.00 10.61 ? 320 PHE B CB 1 ATOM 2054 C CG . PHE F 2 120 ? 43.883 -0.132 4.414 1.00 11.65 ? 320 PHE B CG 1 ATOM 2055 C CD1 . PHE F 2 120 ? 44.465 -0.740 3.245 1.00 12.87 ? 320 PHE B CD1 1 ATOM 2056 C CD2 . PHE F 2 120 ? 44.563 -0.176 5.621 1.00 15.29 ? 320 PHE B CD2 1 ATOM 2057 C CE1 . PHE F 2 120 ? 45.740 -1.373 3.360 1.00 12.25 ? 320 PHE B CE1 1 ATOM 2058 C CE2 . PHE F 2 120 ? 45.833 -0.811 5.725 1.00 13.82 ? 320 PHE B CE2 1 ATOM 2059 C CZ . PHE F 2 120 ? 46.396 -1.396 4.609 1.00 12.80 ? 320 PHE B CZ 1 ATOM 2060 N N . ASP F 2 121 ? 44.373 2.582 1.903 1.00 15.03 ? 321 ASP B N 1 ATOM 2061 C CA . ASP F 2 121 ? 44.781 2.675 0.500 1.00 14.28 ? 321 ASP B CA 1 ATOM 2062 C C . ASP F 2 121 ? 45.559 1.485 -0.004 1.00 16.36 ? 321 ASP B C 1 ATOM 2063 O O . ASP F 2 121 ? 45.221 0.981 -1.054 1.00 15.08 ? 321 ASP B O 1 ATOM 2064 C CB . ASP F 2 121 ? 45.645 3.930 0.268 1.00 16.20 ? 321 ASP B CB 1 ATOM 2065 C CG . ASP F 2 121 ? 45.458 4.537 -1.134 1.00 20.16 ? 321 ASP B CG 1 ATOM 2066 O OD1 . ASP F 2 121 ? 44.295 4.635 -1.611 1.00 19.51 ? 321 ASP B OD1 1 ATOM 2067 O OD2 . ASP F 2 121 ? 46.483 4.914 -1.746 1.00 18.59 ? 321 ASP B OD2 1 ATOM 2068 N N . ALA F 2 122 ? 46.592 1.060 0.733 1.00 16.51 ? 322 ALA B N 1 ATOM 2069 C CA . ALA F 2 122 ? 47.436 -0.035 0.248 1.00 13.76 ? 322 ALA B CA 1 ATOM 2070 C C . ALA F 2 122 ? 48.450 -0.359 1.298 1.00 14.79 ? 322 ALA B C 1 ATOM 2071 O O . ALA F 2 122 ? 48.501 0.285 2.313 1.00 14.57 ? 322 ALA B O 1 ATOM 2072 C CB . ALA F 2 122 ? 48.169 0.443 -0.993 1.00 16.84 ? 322 ALA B CB 1 ATOM 2073 N N . SER F 2 123 ? 49.213 -1.437 1.059 1.00 16.15 ? 323 SER B N 1 ATOM 2074 C CA . SER F 2 123 ? 50.317 -1.763 1.970 1.00 15.80 ? 323 SER B CA 1 ATOM 2075 C C . SER F 2 123 ? 51.550 -1.941 1.094 1.00 17.00 ? 323 SER B C 1 ATOM 2076 O O . SER F 2 123 ? 51.421 -2.218 -0.099 1.00 19.25 ? 323 SER B O 1 ATOM 2077 C CB A SER F 2 123 ? 50.059 -3.047 2.752 0.51 14.43 ? 323 SER B CB 1 ATOM 2078 C CB B SER F 2 123 ? 50.058 -2.998 2.733 0.49 19.17 ? 323 SER B CB 1 ATOM 2079 O OG A SER F 2 123 ? 49.678 -4.120 1.915 0.51 10.85 ? 323 SER B OG 1 ATOM 2080 O OG B SER F 2 123 ? 49.024 -2.821 3.702 0.49 25.13 ? 323 SER B OG 1 ATOM 2081 N N . VAL F 2 124 ? 52.737 -1.730 1.666 1.00 17.38 ? 324 VAL B N 1 ATOM 2082 C CA . VAL F 2 124 ? 53.970 -1.869 0.859 1.00 17.23 ? 324 VAL B CA 1 ATOM 2083 C C . VAL F 2 124 ? 55.136 -2.311 1.745 1.00 22.18 ? 324 VAL B C 1 ATOM 2084 O O . VAL F 2 124 ? 56.085 -2.941 1.216 1.00 25.68 ? 324 VAL B O 1 ATOM 2085 C CB A VAL F 2 124 ? 54.349 -0.532 0.130 0.59 17.27 ? 324 VAL B CB 1 ATOM 2086 C CB B VAL F 2 124 ? 54.411 -0.336 0.373 0.41 16.37 ? 324 VAL B CB 1 ATOM 2087 C CG1 A VAL F 2 124 ? 55.562 -0.785 -0.789 0.59 16.83 ? 324 VAL B CG1 1 ATOM 2088 C CG1 B VAL F 2 124 ? 53.424 0.114 -0.691 0.41 23.02 ? 324 VAL B CG1 1 ATOM 2089 C CG2 A VAL F 2 124 ? 53.184 0.007 -0.724 0.59 25.61 ? 324 VAL B CG2 1 ATOM 2090 C CG2 B VAL F 2 124 ? 54.512 0.689 1.478 0.41 11.47 ? 324 VAL B CG2 1 ATOM 2091 O OXT . VAL F 2 124 ? 55.130 -2.009 2.961 1.00 20.63 ? 324 VAL B OXT 1 ATOM 2092 N N . LYS G 2 1 ? 10.740 8.325 11.351 1.00 43.54 ? 401 LYS C N 1 ATOM 2093 C CA . LYS G 2 1 ? 9.900 8.328 12.576 1.00 42.01 ? 401 LYS C CA 1 ATOM 2094 C C . LYS G 2 1 ? 8.433 8.125 12.144 1.00 38.64 ? 401 LYS C C 1 ATOM 2095 O O . LYS G 2 1 ? 7.859 8.918 11.382 1.00 36.33 ? 401 LYS C O 1 ATOM 2096 C CB . LYS G 2 1 ? 10.080 9.659 13.307 1.00 43.78 ? 401 LYS C CB 1 ATOM 2097 C CG . LYS G 2 1 ? 9.389 9.804 14.662 1.00 47.92 ? 401 LYS C CG 1 ATOM 2098 C CD . LYS G 2 1 ? 9.381 11.298 15.037 1.00 51.75 ? 401 LYS C CD 1 ATOM 2099 C CE . LYS G 2 1 ? 8.726 11.611 16.391 1.00 54.95 ? 401 LYS C CE 1 ATOM 2100 N NZ . LYS G 2 1 ? 9.489 11.048 17.552 1.00 59.81 ? 401 LYS C NZ 1 ATOM 2101 N N . GLU G 2 2 ? 7.847 7.024 12.595 1.00 31.30 ? 402 GLU C N 1 ATOM 2102 C CA . GLU G 2 2 ? 6.452 6.728 12.248 1.00 26.77 ? 402 GLU C CA 1 ATOM 2103 C C . GLU G 2 2 ? 5.503 7.813 12.809 1.00 20.96 ? 402 GLU C C 1 ATOM 2104 O O . GLU G 2 2 ? 5.628 8.220 13.986 1.00 23.37 ? 402 GLU C O 1 ATOM 2105 C CB . GLU G 2 2 ? 6.085 5.345 12.815 1.00 25.13 ? 402 GLU C CB 1 ATOM 2106 C CG . GLU G 2 2 ? 4.652 4.885 12.517 1.00 24.36 ? 402 GLU C CG 1 ATOM 2107 C CD . GLU G 2 2 ? 4.416 3.461 13.095 1.00 23.64 ? 402 GLU C CD 1 ATOM 2108 O OE1 . GLU G 2 2 ? 4.820 3.259 14.244 1.00 21.09 ? 402 GLU C OE1 1 ATOM 2109 O OE2 . GLU G 2 2 ? 3.866 2.587 12.400 1.00 21.17 ? 402 GLU C OE2 1 ATOM 2110 N N . THR G 2 3 ? 4.563 8.297 11.980 1.00 21.29 ? 403 THR C N 1 ATOM 2111 C CA . THR G 2 3 ? 3.604 9.304 12.463 1.00 23.25 ? 403 THR C CA 1 ATOM 2112 C C . THR G 2 3 ? 2.517 8.633 13.315 1.00 23.50 ? 403 THR C C 1 ATOM 2113 O O . THR G 2 3 ? 2.340 7.408 13.222 1.00 19.84 ? 403 THR C O 1 ATOM 2114 C CB . THR G 2 3 ? 2.911 10.025 11.294 1.00 24.60 ? 403 THR C CB 1 ATOM 2115 O OG1 . THR G 2 3 ? 2.016 9.127 10.634 1.00 24.12 ? 403 THR C OG1 1 ATOM 2116 C CG2 . THR G 2 3 ? 3.955 10.470 10.262 1.00 24.95 ? 403 THR C CG2 1 ATOM 2117 N N . ALA G 2 4 ? 1.834 9.415 14.160 1.00 22.27 ? 404 ALA C N 1 ATOM 2118 C CA . ALA G 2 4 ? 0.759 8.855 15.011 1.00 20.88 ? 404 ALA C CA 1 ATOM 2119 C C . ALA G 2 4 ? -0.320 8.260 14.129 1.00 18.95 ? 404 ALA C C 1 ATOM 2120 O O . ALA G 2 4 ? -0.905 7.203 14.442 1.00 16.77 ? 404 ALA C O 1 ATOM 2121 C CB . ALA G 2 4 ? 0.145 9.943 15.895 1.00 22.83 ? 404 ALA C CB 1 ATOM 2122 N N . ALA G 2 5 ? -0.626 8.936 13.024 1.00 20.00 ? 405 ALA C N 1 ATOM 2123 C CA . ALA G 2 5 ? -1.649 8.401 12.139 1.00 17.11 ? 405 ALA C CA 1 ATOM 2124 C C . ALA G 2 5 ? -1.212 7.088 11.510 1.00 21.18 ? 405 ALA C C 1 ATOM 2125 O O . ALA G 2 5 ? -2.015 6.168 11.376 1.00 15.47 ? 405 ALA C O 1 ATOM 2126 C CB . ALA G 2 5 ? -2.002 9.416 11.007 1.00 21.79 ? 405 ALA C CB 1 ATOM 2127 N N . ALA G 2 6 ? 0.052 7.003 11.085 1.00 17.15 ? 406 ALA C N 1 ATOM 2128 C CA . ALA G 2 6 ? 0.507 5.749 10.479 1.00 16.05 ? 406 ALA C CA 1 ATOM 2129 C C . ALA G 2 6 ? 0.519 4.631 11.535 1.00 14.89 ? 406 ALA C C 1 ATOM 2130 O O . ALA G 2 6 ? 0.250 3.470 11.211 1.00 15.67 ? 406 ALA C O 1 ATOM 2131 C CB . ALA G 2 6 ? 1.940 5.918 9.887 1.00 16.30 ? 406 ALA C CB 1 ATOM 2132 N N . LYS G 2 7 ? 0.851 4.978 12.769 1.00 14.10 ? 407 LYS C N 1 ATOM 2133 C CA . LYS G 2 7 ? 0.901 3.955 13.816 1.00 13.29 ? 407 LYS C CA 1 ATOM 2134 C C . LYS G 2 7 ? -0.537 3.442 14.004 1.00 14.57 ? 407 LYS C C 1 ATOM 2135 O O . LYS G 2 7 ? -0.764 2.219 14.201 1.00 12.98 ? 407 LYS C O 1 ATOM 2136 C CB . LYS G 2 7 ? 1.438 4.533 15.107 1.00 15.41 ? 407 LYS C CB 1 ATOM 2137 C CG . LYS G 2 7 ? 1.488 3.537 16.248 1.00 18.28 ? 407 LYS C CG 1 ATOM 2138 C CD . LYS G 2 7 ? 2.011 4.185 17.551 1.00 21.70 ? 407 LYS C CD 1 ATOM 2139 C CE . LYS G 2 7 ? 2.207 3.111 18.618 1.00 25.23 ? 407 LYS C CE 1 ATOM 2140 N NZ . LYS G 2 7 ? 2.891 3.656 19.841 1.00 23.93 ? 407 LYS C NZ 1 ATOM 2141 N N . PHE G 2 8 ? -1.524 4.337 13.957 1.00 14.25 ? 408 PHE C N 1 ATOM 2142 C CA . PHE G 2 8 ? -2.904 3.828 14.154 1.00 16.09 ? 408 PHE C CA 1 ATOM 2143 C C . PHE G 2 8 ? -3.270 2.820 13.054 1.00 14.49 ? 408 PHE C C 1 ATOM 2144 O O . PHE G 2 8 ? -3.874 1.766 13.309 1.00 13.99 ? 408 PHE C O 1 ATOM 2145 C CB . PHE G 2 8 ? -3.907 5.002 14.198 1.00 14.78 ? 408 PHE C CB 1 ATOM 2146 C CG . PHE G 2 8 ? -5.336 4.549 14.218 1.00 14.14 ? 408 PHE C CG 1 ATOM 2147 C CD1 . PHE G 2 8 ? -6.002 4.192 13.028 1.00 13.53 ? 408 PHE C CD1 1 ATOM 2148 C CD2 . PHE G 2 8 ? -6.004 4.422 15.457 1.00 13.32 ? 408 PHE C CD2 1 ATOM 2149 C CE1 . PHE G 2 8 ? -7.300 3.710 13.038 1.00 12.88 ? 408 PHE C CE1 1 ATOM 2150 C CE2 . PHE G 2 8 ? -7.359 3.923 15.471 1.00 12.38 ? 408 PHE C CE2 1 ATOM 2151 C CZ . PHE G 2 8 ? -7.987 3.567 14.256 1.00 11.72 ? 408 PHE C CZ 1 ATOM 2152 N N . GLU G 2 9 ? -2.860 3.104 11.810 1.00 12.80 ? 409 GLU C N 1 ATOM 2153 C CA . GLU G 2 9 ? -3.200 2.193 10.715 1.00 12.71 ? 409 GLU C CA 1 ATOM 2154 C C . GLU G 2 9 ? -2.467 0.883 10.940 1.00 13.14 ? 409 GLU C C 1 ATOM 2155 O O . GLU G 2 9 ? -3.014 -0.185 10.749 1.00 14.35 ? 409 GLU C O 1 ATOM 2156 C CB . GLU G 2 9 ? -2.789 2.753 9.346 1.00 14.17 ? 409 GLU C CB 1 ATOM 2157 C CG . GLU G 2 9 ? -3.448 4.082 8.965 1.00 15.65 ? 409 GLU C CG 1 ATOM 2158 C CD . GLU G 2 9 ? -3.044 4.602 7.572 1.00 21.48 ? 409 GLU C CD 1 ATOM 2159 O OE1 . GLU G 2 9 ? -2.301 3.900 6.840 1.00 21.18 ? 409 GLU C OE1 1 ATOM 2160 O OE2 . GLU G 2 9 ? -3.478 5.711 7.182 1.00 15.92 ? 409 GLU C OE2 1 ATOM 2161 N N . ARG G 2 10 ? -1.202 0.958 11.311 1.00 11.93 ? 410 ARG C N 1 ATOM 2162 C CA . ARG G 2 10 ? -0.453 -0.274 11.535 1.00 11.93 ? 410 ARG C CA 1 ATOM 2163 C C . ARG G 2 10 ? -1.052 -1.129 12.654 1.00 12.46 ? 410 ARG C C 1 ATOM 2164 O O . ARG G 2 10 ? -1.146 -2.356 12.513 1.00 13.88 ? 410 ARG C O 1 ATOM 2165 C CB . ARG G 2 10 ? 1.006 0.060 11.886 1.00 12.13 ? 410 ARG C CB 1 ATOM 2166 C CG . ARG G 2 10 ? 1.798 -1.199 12.321 1.00 16.30 ? 410 ARG C CG 1 ATOM 2167 C CD . ARG G 2 10 ? 3.273 -0.933 12.492 1.00 17.04 ? 410 ARG C CD 1 ATOM 2168 N NE . ARG G 2 10 ? 3.562 0.068 13.523 1.00 14.68 ? 410 ARG C NE 1 ATOM 2169 C CZ . ARG G 2 10 ? 3.672 -0.174 14.841 1.00 18.05 ? 410 ARG C CZ 1 ATOM 2170 N NH1 . ARG G 2 10 ? 3.508 -1.430 15.324 1.00 18.69 ? 410 ARG C NH1 1 ATOM 2171 N NH2 . ARG G 2 10 ? 3.951 0.839 15.686 1.00 16.76 ? 410 ARG C NH2 1 ATOM 2172 N N . GLN G 2 11 ? -1.527 -0.499 13.721 1.00 11.78 ? 411 GLN C N 1 ATOM 2173 C CA . GLN G 2 11 ? -2.064 -1.312 14.805 1.00 12.89 ? 411 GLN C CA 1 ATOM 2174 C C . GLN G 2 11 ? -3.480 -1.721 14.658 1.00 15.41 ? 411 GLN C C 1 ATOM 2175 O O . GLN G 2 11 ? -3.864 -2.734 15.197 1.00 13.81 ? 411 GLN C O 1 ATOM 2176 C CB . GLN G 2 11 ? -2.003 -0.557 16.139 1.00 10.32 ? 411 GLN C CB 1 ATOM 2177 C CG . GLN G 2 11 ? -0.557 -0.114 16.508 1.00 12.87 ? 411 GLN C CG 1 ATOM 2178 C CD . GLN G 2 11 ? -0.524 0.334 17.914 1.00 14.63 ? 411 GLN C CD 1 ATOM 2179 O OE1 . GLN G 2 11 ? -0.051 -0.396 18.815 1.00 17.67 ? 411 GLN C OE1 1 ATOM 2180 N NE2 . GLN G 2 11 ? -1.062 1.527 18.161 1.00 16.28 ? 411 GLN C NE2 1 ATOM 2181 N N . HIS G 2 12 ? -4.242 -0.966 13.868 1.00 11.31 ? 412 HIS C N 1 ATOM 2182 C CA . HIS G 2 12 ? -5.684 -1.195 13.866 1.00 9.25 ? 412 HIS C CA 1 ATOM 2183 C C . HIS G 2 12 ? -6.397 -1.357 12.570 1.00 10.62 ? 412 HIS C C 1 ATOM 2184 O O . HIS G 2 12 ? -7.557 -1.741 12.604 1.00 13.98 ? 412 HIS C O 1 ATOM 2185 C CB . HIS G 2 12 ? -6.368 -0.017 14.623 1.00 12.14 ? 412 HIS C CB 1 ATOM 2186 C CG . HIS G 2 12 ? -5.835 0.209 15.985 1.00 10.81 ? 412 HIS C CG 1 ATOM 2187 N ND1 . HIS G 2 12 ? -5.994 -0.724 16.999 1.00 10.70 ? 412 HIS C ND1 1 ATOM 2188 C CD2 . HIS G 2 12 ? -5.137 1.247 16.520 1.00 12.01 ? 412 HIS C CD2 1 ATOM 2189 C CE1 . HIS G 2 12 ? -5.424 -0.266 18.100 1.00 11.53 ? 412 HIS C CE1 1 ATOM 2190 N NE2 . HIS G 2 12 ? -4.898 0.936 17.837 1.00 12.67 ? 412 HIS C NE2 1 ATOM 2191 N N . MET G 2 13 ? -5.733 -1.079 11.435 1.00 10.14 ? 413 MET C N 1 ATOM 2192 C CA . MET G 2 13 ? -6.462 -1.191 10.186 1.00 14.31 ? 413 MET C CA 1 ATOM 2193 C C . MET G 2 13 ? -6.229 -2.491 9.474 1.00 13.53 ? 413 MET C C 1 ATOM 2194 O O . MET G 2 13 ? -5.057 -2.873 9.285 1.00 14.74 ? 413 MET C O 1 ATOM 2195 C CB . MET G 2 13 ? -6.021 -0.038 9.225 1.00 13.95 ? 413 MET C CB 1 ATOM 2196 C CG . MET G 2 13 ? -6.580 1.327 9.637 1.00 11.78 ? 413 MET C CG 1 ATOM 2197 S SD . MET G 2 13 ? -8.418 1.393 9.551 1.00 15.22 ? 413 MET C SD 1 ATOM 2198 C CE . MET G 2 13 ? -8.739 0.789 7.979 1.00 15.16 ? 413 MET C CE 1 ATOM 2199 N N . ASP G 2 14 ? -7.312 -3.175 9.119 1.00 14.52 ? 414 ASP C N 1 ATOM 2200 C CA . ASP G 2 14 ? -7.186 -4.345 8.260 1.00 10.92 ? 414 ASP C CA 1 ATOM 2201 C C . ASP G 2 14 ? -8.351 -4.356 7.234 1.00 13.74 ? 414 ASP C C 1 ATOM 2202 O O . ASP G 2 14 ? -9.236 -5.202 7.292 1.00 16.20 ? 414 ASP C O 1 ATOM 2203 C CB . ASP G 2 14 ? -7.123 -5.666 9.024 1.00 12.50 ? 414 ASP C CB 1 ATOM 2204 C CG . ASP G 2 14 ? -6.774 -6.809 8.122 1.00 18.54 ? 414 ASP C CG 1 ATOM 2205 O OD1 . ASP G 2 14 ? -6.263 -6.531 7.001 1.00 17.72 ? 414 ASP C OD1 1 ATOM 2206 O OD2 . ASP G 2 14 ? -7.019 -7.973 8.516 1.00 20.69 ? 414 ASP C OD2 1 ATOM 2207 N N . SER G 2 15 ? -8.294 -3.401 6.305 1.00 15.10 ? 415 SER C N 1 ATOM 2208 C CA . SER G 2 15 ? -9.332 -3.303 5.301 1.00 17.34 ? 415 SER C CA 1 ATOM 2209 C C . SER G 2 15 ? -9.252 -4.451 4.336 1.00 19.18 ? 415 SER C C 1 ATOM 2210 O O . SER G 2 15 ? -10.189 -4.621 3.529 1.00 19.55 ? 415 SER C O 1 ATOM 2211 C CB A SER G 2 15 ? -9.157 -2.017 4.478 0.60 21.12 ? 415 SER C CB 1 ATOM 2212 C CB B SER G 2 15 ? -9.356 -1.948 4.556 0.40 14.55 ? 415 SER C CB 1 ATOM 2213 O OG A SER G 2 15 ? -9.046 -0.905 5.324 0.60 27.31 ? 415 SER C OG 1 ATOM 2214 O OG B SER G 2 15 ? -8.185 -1.791 3.777 0.40 8.12 ? 415 SER C OG 1 ATOM 2215 N N . SER G 2 16 ? -8.153 -5.198 4.380 1.00 18.93 ? 416 SER C N 1 ATOM 2216 C CA . SER G 2 16 ? -7.954 -6.296 3.447 1.00 18.90 ? 416 SER C CA 1 ATOM 2217 C C . SER G 2 16 ? -8.850 -7.494 3.626 1.00 22.88 ? 416 SER C C 1 ATOM 2218 O O . SER G 2 16 ? -9.006 -8.297 2.705 1.00 25.81 ? 416 SER C O 1 ATOM 2219 C CB . SER G 2 16 ? -6.511 -6.746 3.470 1.00 20.63 ? 416 SER C CB 1 ATOM 2220 O OG . SER G 2 16 ? -5.740 -5.738 2.847 1.00 28.48 ? 416 SER C OG 1 ATOM 2221 N N . THR G 2 17 ? -9.443 -7.616 4.802 1.00 21.06 ? 417 THR C N 1 ATOM 2222 C CA . THR G 2 17 ? -10.306 -8.750 5.120 1.00 23.09 ? 417 THR C CA 1 ATOM 2223 C C . THR G 2 17 ? -11.606 -8.243 5.711 1.00 23.67 ? 417 THR C C 1 ATOM 2224 O O . THR G 2 17 ? -11.640 -7.158 6.301 1.00 19.66 ? 417 THR C O 1 ATOM 2225 C CB . THR G 2 17 ? -9.604 -9.714 6.133 1.00 19.29 ? 417 THR C CB 1 ATOM 2226 O OG1 . THR G 2 17 ? -9.462 -9.050 7.398 1.00 20.34 ? 417 THR C OG1 1 ATOM 2227 C CG2 . THR G 2 17 ? -8.242 -10.076 5.615 1.00 21.64 ? 417 THR C CG2 1 ATOM 2228 N N . SER G 2 18 ? -12.685 -9.013 5.554 1.00 21.76 ? 418 SER C N 1 ATOM 2229 C CA . SER G 2 18 ? -13.986 -8.591 6.055 1.00 22.45 ? 418 SER C CA 1 ATOM 2230 C C . SER G 2 18 ? -14.246 -8.982 7.505 1.00 19.22 ? 418 SER C C 1 ATOM 2231 O O . SER G 2 18 ? -15.138 -8.423 8.150 1.00 19.78 ? 418 SER C O 1 ATOM 2232 C CB . SER G 2 18 ? -15.131 -9.151 5.177 1.00 23.54 ? 418 SER C CB 1 ATOM 2233 O OG . SER G 2 18 ? -15.123 -10.574 5.213 1.00 27.28 ? 418 SER C OG 1 ATOM 2234 N N . ALA G 2 19 ? -13.414 -9.900 7.999 1.00 19.89 ? 419 ALA C N 1 ATOM 2235 C CA . ALA G 2 19 ? -13.523 -10.429 9.359 1.00 21.27 ? 419 ALA C CA 1 ATOM 2236 C C . ALA G 2 19 ? -12.318 -11.357 9.623 1.00 19.74 ? 419 ALA C C 1 ATOM 2237 O O . ALA G 2 19 ? -11.590 -11.733 8.687 1.00 20.70 ? 419 ALA C O 1 ATOM 2238 C CB . ALA G 2 19 ? -14.831 -11.244 9.475 1.00 21.34 ? 419 ALA C CB 1 ATOM 2239 N N . ALA G 2 20 ? -12.106 -11.717 10.890 1.00 17.56 ? 420 ALA C N 1 ATOM 2240 C CA . ALA G 2 20 ? -11.010 -12.639 11.235 1.00 17.41 ? 420 ALA C CA 1 ATOM 2241 C C . ALA G 2 20 ? -11.352 -14.008 10.585 1.00 19.27 ? 420 ALA C C 1 ATOM 2242 O O . ALA G 2 20 ? -12.423 -14.526 10.842 1.00 22.15 ? 420 ALA C O 1 ATOM 2243 C CB . ALA G 2 20 ? -10.965 -12.808 12.772 1.00 16.42 ? 420 ALA C CB 1 ATOM 2244 N N . SER G 2 21 ? -10.451 -14.617 9.834 1.00 22.76 ? 421 SER C N 1 ATOM 2245 C CA . SER G 2 21 ? -10.856 -15.871 9.184 1.00 26.55 ? 421 SER C CA 1 ATOM 2246 C C . SER G 2 21 ? -10.632 -17.109 9.966 1.00 27.02 ? 421 SER C C 1 ATOM 2247 O O . SER G 2 21 ? -11.167 -18.176 9.611 1.00 28.73 ? 421 SER C O 1 ATOM 2248 C CB . SER G 2 21 ? -10.164 -16.052 7.835 1.00 26.42 ? 421 SER C CB 1 ATOM 2249 O OG . SER G 2 21 ? -8.743 -16.105 7.941 1.00 31.10 ? 421 SER C OG 1 ATOM 2250 N N . SER G 2 22 ? -9.854 -16.989 11.043 1.00 23.73 ? 422 SER C N 1 ATOM 2251 C CA . SER G 2 22 ? -9.564 -18.159 11.860 1.00 20.74 ? 422 SER C CA 1 ATOM 2252 C C . SER G 2 22 ? -9.240 -17.743 13.280 1.00 20.82 ? 422 SER C C 1 ATOM 2253 O O . SER G 2 22 ? -9.027 -16.551 13.558 1.00 17.99 ? 422 SER C O 1 ATOM 2254 C CB . SER G 2 22 ? -8.358 -18.929 11.308 1.00 20.98 ? 422 SER C CB 1 ATOM 2255 O OG . SER G 2 22 ? -7.097 -18.329 11.658 1.00 21.48 ? 422 SER C OG 1 ATOM 2256 N N . SER G 2 23 ? -9.177 -18.748 14.145 1.00 20.04 ? 423 SER C N 1 ATOM 2257 C CA . SER G 2 23 ? -8.896 -18.554 15.548 1.00 19.33 ? 423 SER C CA 1 ATOM 2258 C C . SER G 2 23 ? -7.451 -18.113 15.736 1.00 15.99 ? 423 SER C C 1 ATOM 2259 O O . SER G 2 23 ? -7.112 -17.591 16.803 1.00 19.02 ? 423 SER C O 1 ATOM 2260 C CB . SER G 2 23 ? -9.180 -19.839 16.339 1.00 22.51 ? 423 SER C CB 1 ATOM 2261 O OG . SER G 2 23 ? -8.366 -20.883 15.873 1.00 23.21 ? 423 SER C OG 1 ATOM 2262 N N . ASN G 2 24 ? -6.619 -18.253 14.705 1.00 17.91 ? 424 ASN C N 1 ATOM 2263 C CA . ASN G 2 24 ? -5.241 -17.796 14.804 1.00 15.94 ? 424 ASN C CA 1 ATOM 2264 C C . ASN G 2 24 ? -4.994 -16.406 14.165 1.00 12.53 ? 424 ASN C C 1 ATOM 2265 O O . ASN G 2 24 ? -3.849 -15.967 14.077 1.00 13.38 ? 424 ASN C O 1 ATOM 2266 C CB . ASN G 2 24 ? -4.277 -18.792 14.194 1.00 21.47 ? 424 ASN C CB 1 ATOM 2267 C CG . ASN G 2 24 ? -4.066 -19.968 15.090 1.00 26.71 ? 424 ASN C CG 1 ATOM 2268 O OD1 . ASN G 2 24 ? -3.983 -19.829 16.324 1.00 26.18 ? 424 ASN C OD1 1 ATOM 2269 N ND2 . ASN G 2 24 ? -3.965 -21.145 14.491 1.00 31.59 ? 424 ASN C ND2 1 ATOM 2270 N N . TYR G 2 25 ? -6.060 -15.718 13.786 1.00 13.33 ? 425 TYR C N 1 ATOM 2271 C CA . TYR G 2 25 ? -5.915 -14.378 13.153 1.00 14.72 ? 425 TYR C CA 1 ATOM 2272 C C . TYR G 2 25 ? -5.087 -13.447 14.045 1.00 14.27 ? 425 TYR C C 1 ATOM 2273 O O . TYR G 2 25 ? -4.158 -12.769 13.597 1.00 13.31 ? 425 TYR C O 1 ATOM 2274 C CB . TYR G 2 25 ? -7.332 -13.787 12.957 1.00 14.09 ? 425 TYR C CB 1 ATOM 2275 C CG . TYR G 2 25 ? -7.351 -12.371 12.445 1.00 14.99 ? 425 TYR C CG 1 ATOM 2276 C CD1 . TYR G 2 25 ? -7.310 -12.102 11.074 1.00 13.68 ? 425 TYR C CD1 1 ATOM 2277 C CD2 . TYR G 2 25 ? -7.378 -11.288 13.346 1.00 14.56 ? 425 TYR C CD2 1 ATOM 2278 C CE1 . TYR G 2 25 ? -7.296 -10.758 10.610 1.00 15.72 ? 425 TYR C CE1 1 ATOM 2279 C CE2 . TYR G 2 25 ? -7.367 -9.949 12.877 1.00 12.93 ? 425 TYR C CE2 1 ATOM 2280 C CZ . TYR G 2 25 ? -7.324 -9.713 11.513 1.00 15.22 ? 425 TYR C CZ 1 ATOM 2281 O OH . TYR G 2 25 ? -7.292 -8.399 11.060 1.00 15.04 ? 425 TYR C OH 1 ATOM 2282 N N . CYS G 2 26 ? -5.446 -13.391 15.331 1.00 14.07 ? 426 CYS C N 1 ATOM 2283 C CA . CYS G 2 26 ? -4.680 -12.487 16.196 1.00 14.56 ? 426 CYS C CA 1 ATOM 2284 C C . CYS G 2 26 ? -3.226 -12.860 16.370 1.00 12.28 ? 426 CYS C C 1 ATOM 2285 O O . CYS G 2 26 ? -2.318 -12.007 16.359 1.00 13.06 ? 426 CYS C O 1 ATOM 2286 C CB . CYS G 2 26 ? -5.364 -12.329 17.560 1.00 13.91 ? 426 CYS C CB 1 ATOM 2287 S SG . CYS G 2 26 ? -6.966 -11.457 17.430 1.00 15.90 ? 426 CYS C SG 1 ATOM 2288 N N . ASN G 2 27 ? -2.969 -14.144 16.557 1.00 12.61 ? 427 ASN C N 1 ATOM 2289 C CA . ASN G 2 27 ? -1.581 -14.548 16.691 1.00 11.96 ? 427 ASN C CA 1 ATOM 2290 C C . ASN G 2 27 ? -0.793 -14.101 15.466 1.00 14.82 ? 427 ASN C C 1 ATOM 2291 O O . ASN G 2 27 ? 0.350 -13.679 15.572 1.00 15.61 ? 427 ASN C O 1 ATOM 2292 C CB . ASN G 2 27 ? -1.489 -16.067 16.799 1.00 14.42 ? 427 ASN C CB 1 ATOM 2293 C CG . ASN G 2 27 ? -1.895 -16.550 18.161 1.00 18.42 ? 427 ASN C CG 1 ATOM 2294 O OD1 . ASN G 2 27 ? -1.767 -15.820 19.144 1.00 14.35 ? 427 ASN C OD1 1 ATOM 2295 N ND2 . ASN G 2 27 ? -2.372 -17.781 18.238 1.00 19.81 ? 427 ASN C ND2 1 ATOM 2296 N N . GLN G 2 28 ? -1.413 -14.227 14.299 1.00 13.58 ? 428 GLN C N 1 ATOM 2297 C CA . GLN G 2 28 ? -0.729 -13.847 13.088 1.00 12.87 ? 428 GLN C CA 1 ATOM 2298 C C . GLN G 2 28 ? -0.566 -12.342 12.928 1.00 11.84 ? 428 GLN C C 1 ATOM 2299 O O . GLN G 2 28 ? 0.526 -11.857 12.616 1.00 13.21 ? 428 GLN C O 1 ATOM 2300 C CB . GLN G 2 28 ? -1.481 -14.376 11.871 1.00 19.15 ? 428 GLN C CB 1 ATOM 2301 C CG . GLN G 2 28 ? -1.476 -15.884 11.840 1.00 18.77 ? 428 GLN C CG 1 ATOM 2302 C CD . GLN G 2 28 ? -2.557 -16.424 10.938 1.00 22.52 ? 428 GLN C CD 1 ATOM 2303 O OE1 . GLN G 2 28 ? -3.196 -15.681 10.223 1.00 24.51 ? 428 GLN C OE1 1 ATOM 2304 N NE2 . GLN G 2 28 ? -2.776 -17.748 10.986 1.00 26.29 ? 428 GLN C NE2 1 ATOM 2305 N N . MET G 2 29 ? -1.640 -11.609 13.174 1.00 12.23 ? 429 MET C N 1 ATOM 2306 C CA . MET G 2 29 ? -1.655 -10.155 12.962 1.00 12.88 ? 429 MET C CA 1 ATOM 2307 C C . MET G 2 29 ? -0.908 -9.404 14.039 1.00 13.06 ? 429 MET C C 1 ATOM 2308 O O . MET G 2 29 ? -0.258 -8.422 13.756 1.00 12.82 ? 429 MET C O 1 ATOM 2309 C CB . MET G 2 29 ? -3.099 -9.640 12.886 1.00 14.42 ? 429 MET C CB 1 ATOM 2310 C CG . MET G 2 29 ? -3.843 -10.180 11.697 1.00 15.91 ? 429 MET C CG 1 ATOM 2311 S SD . MET G 2 29 ? -3.279 -9.286 10.160 1.00 17.15 ? 429 MET C SD 1 ATOM 2312 C CE . MET G 2 29 ? -3.783 -7.716 10.507 1.00 18.36 ? 429 MET C CE 1 ATOM 2313 N N . MET G 2 30 ? -0.977 -9.854 15.284 1.00 11.26 ? 430 MET C N 1 ATOM 2314 C CA . MET G 2 30 ? -0.204 -9.140 16.287 1.00 9.90 ? 430 MET C CA 1 ATOM 2315 C C . MET G 2 30 ? 1.298 -9.243 15.957 1.00 9.33 ? 430 MET C C 1 ATOM 2316 O O . MET G 2 30 ? 2.089 -8.304 16.183 1.00 13.82 ? 430 MET C O 1 ATOM 2317 C CB . MET G 2 30 ? -0.503 -9.698 17.721 1.00 9.27 ? 430 MET C CB 1 ATOM 2318 C CG . MET G 2 30 ? -1.996 -9.503 18.109 1.00 8.98 ? 430 MET C CG 1 ATOM 2319 S SD . MET G 2 30 ? -2.432 -7.732 18.312 1.00 12.71 ? 430 MET C SD 1 ATOM 2320 C CE . MET G 2 30 ? -1.478 -7.279 19.807 1.00 15.49 ? 430 MET C CE 1 ATOM 2321 N N . LYS G 2 31 ? 1.714 -10.382 15.418 1.00 11.45 ? 431 LYS C N 1 ATOM 2322 C CA . LYS G 2 31 ? 3.126 -10.538 15.063 1.00 11.71 ? 431 LYS C CA 1 ATOM 2323 C C . LYS G 2 31 ? 3.443 -9.717 13.764 1.00 12.99 ? 431 LYS C C 1 ATOM 2324 O O . LYS G 2 31 ? 4.428 -8.972 13.726 1.00 15.31 ? 431 LYS C O 1 ATOM 2325 C CB . LYS G 2 31 ? 3.433 -12.039 14.820 1.00 12.95 ? 431 LYS C CB 1 ATOM 2326 C CG . LYS G 2 31 ? 4.906 -12.222 14.315 1.00 20.13 ? 431 LYS C CG 1 ATOM 2327 C CD . LYS G 2 31 ? 5.323 -13.697 14.236 1.00 27.95 ? 431 LYS C CD 1 ATOM 2328 C CE . LYS G 2 31 ? 6.846 -13.714 14.059 1.00 38.96 ? 431 LYS C CE 1 ATOM 2329 N NZ . LYS G 2 31 ? 7.522 -15.010 14.439 1.00 46.09 ? 431 LYS C NZ 1 ATOM 2330 N N . SER G 2 32 ? 2.605 -9.854 12.742 1.00 14.01 ? 432 SER C N 1 ATOM 2331 C CA . SER G 2 32 ? 2.934 -9.172 11.482 1.00 14.55 ? 432 SER C CA 1 ATOM 2332 C C . SER G 2 32 ? 2.839 -7.660 11.526 1.00 17.38 ? 432 SER C C 1 ATOM 2333 O O . SER G 2 32 ? 3.443 -6.966 10.652 1.00 18.43 ? 432 SER C O 1 ATOM 2334 C CB . SER G 2 32 ? 2.096 -9.746 10.320 1.00 16.83 ? 432 SER C CB 1 ATOM 2335 O OG . SER G 2 32 ? 0.712 -9.464 10.474 1.00 19.15 ? 432 SER C OG 1 ATOM 2336 N N . ARG G 2 33 ? 2.101 -7.121 12.490 1.00 12.92 ? 433 ARG C N 1 ATOM 2337 C CA . ARG G 2 33 ? 2.021 -5.667 12.610 1.00 13.47 ? 433 ARG C CA 1 ATOM 2338 C C . ARG G 2 33 ? 3.009 -5.150 13.660 1.00 14.19 ? 433 ARG C C 1 ATOM 2339 O O . ARG G 2 33 ? 2.947 -3.996 14.095 1.00 14.70 ? 433 ARG C O 1 ATOM 2340 C CB . ARG G 2 33 ? 0.576 -5.205 12.926 1.00 11.78 ? 433 ARG C CB 1 ATOM 2341 C CG . ARG G 2 33 ? -0.401 -5.585 11.832 1.00 13.94 ? 433 ARG C CG 1 ATOM 2342 C CD . ARG G 2 33 ? -0.053 -4.909 10.422 1.00 11.72 ? 433 ARG C CD 1 ATOM 2343 N NE . ARG G 2 33 ? -1.117 -5.177 9.455 1.00 13.77 ? 433 ARG C NE 1 ATOM 2344 C CZ . ARG G 2 33 ? -2.236 -4.481 9.361 1.00 13.45 ? 433 ARG C CZ 1 ATOM 2345 N NH1 . ARG G 2 33 ? -2.442 -3.446 10.180 1.00 12.64 ? 433 ARG C NH1 1 ATOM 2346 N NH2 . ARG G 2 33 ? -3.115 -4.847 8.439 1.00 15.10 ? 433 ARG C NH2 1 ATOM 2347 N N . ASN G 2 34 ? 3.943 -6.023 14.086 1.00 14.36 ? 434 ASN C N 1 ATOM 2348 C CA . ASN G 2 34 ? 4.986 -5.663 15.049 1.00 14.46 ? 434 ASN C CA 1 ATOM 2349 C C . ASN G 2 34 ? 4.526 -5.300 16.458 1.00 16.78 ? 434 ASN C C 1 ATOM 2350 O O . ASN G 2 34 ? 5.159 -4.524 17.198 1.00 18.58 ? 434 ASN C O 1 ATOM 2351 C CB . ASN G 2 34 ? 5.874 -4.536 14.503 1.00 17.91 ? 434 ASN C CB 1 ATOM 2352 C CG . ASN G 2 34 ? 6.867 -5.049 13.470 1.00 31.97 ? 434 ASN C CG 1 ATOM 2353 O OD1 . ASN G 2 34 ? 7.260 -4.318 12.550 1.00 42.06 ? 434 ASN C OD1 1 ATOM 2354 N ND2 . ASN G 2 34 ? 7.283 -6.309 13.612 1.00 27.44 ? 434 ASN C ND2 1 ATOM 2355 N N . LEU G 2 35 ? 3.394 -5.878 16.851 1.00 13.36 ? 435 LEU C N 1 ATOM 2356 C CA . LEU G 2 35 ? 2.844 -5.628 18.159 1.00 14.41 ? 435 LEU C CA 1 ATOM 2357 C C . LEU G 2 35 ? 3.360 -6.649 19.156 1.00 16.55 ? 435 LEU C C 1 ATOM 2358 O O . LEU G 2 35 ? 2.905 -6.684 20.318 1.00 16.97 ? 435 LEU C O 1 ATOM 2359 C CB . LEU G 2 35 ? 1.321 -5.698 18.126 1.00 12.82 ? 435 LEU C CB 1 ATOM 2360 C CG . LEU G 2 35 ? 0.801 -4.764 17.019 1.00 11.45 ? 435 LEU C CG 1 ATOM 2361 C CD1 . LEU G 2 35 ? -0.739 -4.680 17.117 1.00 17.44 ? 435 LEU C CD1 1 ATOM 2362 C CD2 . LEU G 2 35 ? 1.422 -3.432 17.144 1.00 18.54 ? 435 LEU C CD2 1 ATOM 2363 N N . THR G 2 36 ? 4.288 -7.494 18.727 1.00 14.69 ? 436 THR C N 1 ATOM 2364 C CA . THR G 2 36 ? 4.883 -8.448 19.681 1.00 15.78 ? 436 THR C CA 1 ATOM 2365 C C . THR G 2 36 ? 6.409 -8.374 19.567 1.00 16.68 ? 436 THR C C 1 ATOM 2366 O O . THR G 2 36 ? 7.135 -9.294 19.989 1.00 18.30 ? 436 THR C O 1 ATOM 2367 C CB . THR G 2 36 ? 4.481 -9.901 19.404 1.00 13.20 ? 436 THR C CB 1 ATOM 2368 O OG1 . THR G 2 36 ? 4.916 -10.299 18.090 1.00 18.44 ? 436 THR C OG1 1 ATOM 2369 C CG2 . THR G 2 36 ? 2.934 -10.032 19.540 1.00 16.86 ? 436 THR C CG2 1 ATOM 2370 N N . LYS G 2 37 ? 6.876 -7.275 19.003 1.00 16.86 ? 437 LYS C N 1 ATOM 2371 C CA . LYS G 2 37 ? 8.316 -7.163 18.736 1.00 17.91 ? 437 LYS C CA 1 ATOM 2372 C C . LYS G 2 37 ? 9.238 -7.245 19.940 1.00 18.52 ? 437 LYS C C 1 ATOM 2373 O O . LYS G 2 37 ? 10.213 -8.078 19.923 1.00 21.81 ? 437 LYS C O 1 ATOM 2374 C CB . LYS G 2 37 ? 8.566 -5.898 17.872 1.00 18.95 ? 437 LYS C CB 1 ATOM 2375 C CG . LYS G 2 37 ? 9.973 -5.888 17.214 1.00 32.76 ? 437 LYS C CG 1 ATOM 2376 C CD . LYS G 2 37 ? 10.092 -7.140 16.356 1.00 41.04 ? 437 LYS C CD 1 ATOM 2377 C CE . LYS G 2 37 ? 11.506 -7.483 15.942 1.00 48.19 ? 437 LYS C CE 1 ATOM 2378 N NZ . LYS G 2 37 ? 11.491 -8.813 15.228 1.00 56.08 ? 437 LYS C NZ 1 ATOM 2379 N N . ASP G 2 38 ? 8.954 -6.432 20.949 1.00 19.47 ? 438 ASP C N 1 ATOM 2380 C CA . ASP G 2 38 ? 9.729 -6.365 22.186 1.00 23.30 ? 438 ASP C CA 1 ATOM 2381 C C . ASP G 2 38 ? 8.942 -6.703 23.444 1.00 23.34 ? 438 ASP C C 1 ATOM 2382 O O . ASP G 2 38 ? 9.522 -6.920 24.515 1.00 23.24 ? 438 ASP C O 1 ATOM 2383 C CB . ASP G 2 38 ? 10.385 -4.986 22.318 1.00 25.47 ? 438 ASP C CB 1 ATOM 2384 C CG . ASP G 2 38 ? 11.268 -4.673 21.132 1.00 33.28 ? 438 ASP C CG 1 ATOM 2385 O OD1 . ASP G 2 38 ? 12.098 -5.533 20.755 1.00 35.59 ? 438 ASP C OD1 1 ATOM 2386 O OD2 . ASP G 2 38 ? 11.129 -3.569 20.568 1.00 32.12 ? 438 ASP C OD2 1 ATOM 2387 N N . ARG G 2 39 ? 7.612 -6.750 23.336 1.00 17.70 ? 439 ARG C N 1 ATOM 2388 C CA . ARG G 2 39 ? 6.797 -7.140 24.448 1.00 15.44 ? 439 ARG C CA 1 ATOM 2389 C C . ARG G 2 39 ? 5.476 -7.534 23.802 1.00 14.13 ? 439 ARG C C 1 ATOM 2390 O O . ARG G 2 39 ? 5.263 -7.233 22.591 1.00 17.20 ? 439 ARG C O 1 ATOM 2391 C CB . ARG G 2 39 ? 6.568 -5.977 25.410 1.00 22.61 ? 439 ARG C CB 1 ATOM 2392 C CG . ARG G 2 39 ? 5.782 -4.855 24.782 1.00 24.27 ? 439 ARG C CG 1 ATOM 2393 C CD . ARG G 2 39 ? 5.879 -3.617 25.675 1.00 41.06 ? 439 ARG C CD 1 ATOM 2394 N NE . ARG G 2 39 ? 7.264 -3.125 25.694 1.00 46.77 ? 439 ARG C NE 1 ATOM 2395 C CZ . ARG G 2 39 ? 7.845 -2.493 24.667 1.00 53.29 ? 439 ARG C CZ 1 ATOM 2396 N NH1 . ARG G 2 39 ? 7.161 -2.266 23.547 1.00 55.24 ? 439 ARG C NH1 1 ATOM 2397 N NH2 . ARG G 2 39 ? 9.114 -2.112 24.738 1.00 51.65 ? 439 ARG C NH2 1 ATOM 2398 N N . CYS G 2 40 ? 4.650 -8.253 24.555 1.00 13.80 ? 440 CYS C N 1 ATOM 2399 C CA . CYS G 2 40 ? 3.360 -8.627 23.996 1.00 15.52 ? 440 CYS C CA 1 ATOM 2400 C C . CYS G 2 40 ? 2.328 -7.553 24.303 1.00 15.20 ? 440 CYS C C 1 ATOM 2401 O O . CYS G 2 40 ? 2.005 -7.348 25.469 1.00 17.03 ? 440 CYS C O 1 ATOM 2402 C CB . CYS G 2 40 ? 2.852 -9.928 24.615 1.00 17.75 ? 440 CYS C CB 1 ATOM 2403 S SG . CYS G 2 40 ? 3.985 -11.350 24.570 1.00 19.25 ? 440 CYS C SG 1 ATOM 2404 N N . LYS G 2 41 ? 1.830 -6.833 23.288 1.00 12.88 ? 441 LYS C N 1 ATOM 2405 C CA . LYS G 2 41 ? 0.803 -5.863 23.544 1.00 10.92 ? 441 LYS C CA 1 ATOM 2406 C C . LYS G 2 41 ? -0.371 -6.658 24.099 1.00 12.25 ? 441 LYS C C 1 ATOM 2407 O O . LYS G 2 41 ? -0.829 -7.610 23.478 1.00 14.97 ? 441 LYS C O 1 ATOM 2408 C CB . LYS G 2 41 ? 0.475 -5.099 22.241 1.00 11.75 ? 441 LYS C CB 1 ATOM 2409 C CG . LYS G 2 41 ? -0.605 -4.041 22.538 1.00 14.95 ? 441 LYS C CG 1 ATOM 2410 C CD . LYS G 2 41 ? -0.955 -3.210 21.294 1.00 15.57 ? 441 LYS C CD 1 ATOM 2411 C CE . LYS G 2 41 ? -1.999 -2.170 21.667 1.00 14.14 ? 441 LYS C CE 1 ATOM 2412 N NZ . LYS G 2 41 ? -2.271 -1.281 20.465 1.00 14.67 ? 441 LYS C NZ 1 ATOM 2413 N N . PRO G 2 42 ? -0.948 -6.224 25.218 1.00 13.59 ? 442 PRO C N 1 ATOM 2414 C CA . PRO G 2 42 ? -2.034 -7.062 25.778 1.00 13.44 ? 442 PRO C CA 1 ATOM 2415 C C . PRO G 2 42 ? -3.409 -7.161 25.137 1.00 13.24 ? 442 PRO C C 1 ATOM 2416 O O . PRO G 2 42 ? -3.978 -8.263 25.106 1.00 15.62 ? 442 PRO C O 1 ATOM 2417 C CB . PRO G 2 42 ? -2.114 -6.597 27.258 1.00 16.28 ? 442 PRO C CB 1 ATOM 2418 C CG . PRO G 2 42 ? -1.665 -5.208 27.199 1.00 16.22 ? 442 PRO C CG 1 ATOM 2419 C CD . PRO G 2 42 ? -0.507 -5.207 26.193 1.00 16.42 ? 442 PRO C CD 1 ATOM 2420 N N . VAL G 2 43 ? -3.914 -6.045 24.594 1.00 11.41 ? 443 VAL C N 1 ATOM 2421 C CA . VAL G 2 43 ? -5.248 -6.030 24.018 1.00 10.14 ? 443 VAL C CA 1 ATOM 2422 C C . VAL G 2 43 ? -5.121 -5.124 22.830 1.00 14.95 ? 443 VAL C C 1 ATOM 2423 O O . VAL G 2 43 ? -4.477 -4.062 22.940 1.00 16.77 ? 443 VAL C O 1 ATOM 2424 C CB . VAL G 2 43 ? -6.276 -5.387 25.021 1.00 14.61 ? 443 VAL C CB 1 ATOM 2425 C CG1 . VAL G 2 43 ? -7.610 -5.149 24.352 1.00 16.06 ? 443 VAL C CG1 1 ATOM 2426 C CG2 . VAL G 2 43 ? -6.494 -6.355 26.241 1.00 15.15 ? 443 VAL C CG2 1 ATOM 2427 N N . ASN G 2 44 ? -5.758 -5.516 21.725 1.00 11.61 ? 444 ASN C N 1 ATOM 2428 C CA . ASN G 2 44 ? -5.666 -4.678 20.526 1.00 11.34 ? 444 ASN C CA 1 ATOM 2429 C C . ASN G 2 44 ? -6.816 -4.993 19.608 1.00 14.43 ? 444 ASN C C 1 ATOM 2430 O O . ASN G 2 44 ? -7.106 -6.142 19.372 1.00 13.84 ? 444 ASN C O 1 ATOM 2431 C CB . ASN G 2 44 ? -4.324 -4.938 19.804 1.00 11.14 ? 444 ASN C CB 1 ATOM 2432 C CG . ASN G 2 44 ? -4.118 -4.013 18.608 1.00 11.14 ? 444 ASN C CG 1 ATOM 2433 O OD1 . ASN G 2 44 ? -3.814 -2.825 18.803 1.00 13.67 ? 444 ASN C OD1 1 ATOM 2434 N ND2 . ASN G 2 44 ? -4.289 -4.540 17.376 1.00 11.73 ? 444 ASN C ND2 1 ATOM 2435 N N . THR G 2 45 ? -7.429 -3.972 19.026 1.00 11.28 ? 445 THR C N 1 ATOM 2436 C CA . THR G 2 45 ? -8.538 -4.215 18.129 1.00 11.43 ? 445 THR C CA 1 ATOM 2437 C C . THR G 2 45 ? -8.172 -3.883 16.674 1.00 11.03 ? 445 THR C C 1 ATOM 2438 O O . THR G 2 45 ? -7.500 -2.849 16.387 1.00 12.35 ? 445 THR C O 1 ATOM 2439 C CB . THR G 2 45 ? -9.761 -3.317 18.538 1.00 11.33 ? 445 THR C CB 1 ATOM 2440 O OG1 . THR G 2 45 ? -10.165 -3.628 19.878 1.00 13.29 ? 445 THR C OG1 1 ATOM 2441 C CG2 . THR G 2 45 ? -10.944 -3.533 17.550 1.00 14.54 ? 445 THR C CG2 1 ATOM 2442 N N . PHE G 2 46 ? -8.577 -4.770 15.781 1.00 12.28 ? 446 PHE C N 1 ATOM 2443 C CA . PHE G 2 46 ? -8.416 -4.553 14.355 1.00 10.49 ? 446 PHE C CA 1 ATOM 2444 C C . PHE G 2 46 ? -9.776 -4.252 13.747 1.00 12.91 ? 446 PHE C C 1 ATOM 2445 O O . PHE G 2 46 ? -10.786 -4.790 14.148 1.00 14.70 ? 446 PHE C O 1 ATOM 2446 C CB . PHE G 2 46 ? -7.821 -5.777 13.636 1.00 11.82 ? 446 PHE C CB 1 ATOM 2447 C CG . PHE G 2 46 ? -6.338 -5.962 13.883 1.00 11.69 ? 446 PHE C CG 1 ATOM 2448 C CD1 . PHE G 2 46 ? -5.390 -5.168 13.203 1.00 13.67 ? 446 PHE C CD1 1 ATOM 2449 C CD2 . PHE G 2 46 ? -5.902 -6.897 14.821 1.00 14.07 ? 446 PHE C CD2 1 ATOM 2450 C CE1 . PHE G 2 46 ? -4.016 -5.313 13.473 1.00 13.49 ? 446 PHE C CE1 1 ATOM 2451 C CE2 . PHE G 2 46 ? -4.504 -7.036 15.079 1.00 12.96 ? 446 PHE C CE2 1 ATOM 2452 C CZ . PHE G 2 46 ? -3.596 -6.236 14.397 1.00 13.80 ? 446 PHE C CZ 1 ATOM 2453 N N . VAL G 2 47 ? -9.784 -3.321 12.782 1.00 13.23 ? 447 VAL C N 1 ATOM 2454 C CA . VAL G 2 47 ? -11.057 -2.892 12.135 1.00 13.05 ? 447 VAL C CA 1 ATOM 2455 C C . VAL G 2 47 ? -11.060 -3.310 10.664 1.00 12.14 ? 447 VAL C C 1 ATOM 2456 O O . VAL G 2 47 ? -10.158 -2.992 9.907 1.00 16.10 ? 447 VAL C O 1 ATOM 2457 C CB . VAL G 2 47 ? -11.174 -1.365 12.237 1.00 12.85 ? 447 VAL C CB 1 ATOM 2458 C CG1 . VAL G 2 47 ? -12.486 -0.895 11.572 1.00 17.92 ? 447 VAL C CG1 1 ATOM 2459 C CG2 . VAL G 2 47 ? -11.134 -0.926 13.759 1.00 10.34 ? 447 VAL C CG2 1 ATOM 2460 N N . HIS G 2 48 ? -12.120 -3.998 10.256 1.00 11.91 ? 448 HIS C N 1 ATOM 2461 C CA . HIS G 2 48 ? -12.215 -4.530 8.905 1.00 14.39 ? 448 HIS C CA 1 ATOM 2462 C C . HIS G 2 48 ? -13.166 -3.644 8.096 1.00 15.23 ? 448 HIS C C 1 ATOM 2463 O O . HIS G 2 48 ? -14.260 -4.093 7.678 1.00 17.81 ? 448 HIS C O 1 ATOM 2464 C CB . HIS G 2 48 ? -12.763 -5.951 8.914 1.00 14.96 ? 448 HIS C CB 1 ATOM 2465 C CG . HIS G 2 48 ? -12.012 -6.893 9.813 1.00 14.48 ? 448 HIS C CG 1 ATOM 2466 N ND1 . HIS G 2 48 ? -10.907 -7.605 9.377 1.00 21.86 ? 448 HIS C ND1 1 ATOM 2467 C CD2 . HIS G 2 48 ? -12.215 -7.249 11.101 1.00 13.37 ? 448 HIS C CD2 1 ATOM 2468 C CE1 . HIS G 2 48 ? -10.461 -8.366 10.368 1.00 20.49 ? 448 HIS C CE1 1 ATOM 2469 N NE2 . HIS G 2 48 ? -11.228 -8.166 11.428 1.00 17.39 ? 448 HIS C NE2 1 ATOM 2470 N N . GLU G 2 49 ? -12.765 -2.391 7.917 1.00 15.40 ? 449 GLU C N 1 ATOM 2471 C CA . GLU G 2 49 ? -13.559 -1.459 7.116 1.00 14.58 ? 449 GLU C CA 1 ATOM 2472 C C . GLU G 2 49 ? -12.558 -0.651 6.314 1.00 15.83 ? 449 GLU C C 1 ATOM 2473 O O . GLU G 2 49 ? -11.370 -0.698 6.556 1.00 15.78 ? 449 GLU C O 1 ATOM 2474 C CB . GLU G 2 49 ? -14.380 -0.509 8.012 1.00 16.07 ? 449 GLU C CB 1 ATOM 2475 C CG . GLU G 2 49 ? -15.400 -1.279 8.944 1.00 15.57 ? 449 GLU C CG 1 ATOM 2476 C CD . GLU G 2 49 ? -16.547 -1.976 8.213 1.00 20.53 ? 449 GLU C CD 1 ATOM 2477 O OE1 . GLU G 2 49 ? -16.743 -1.773 6.998 1.00 19.59 ? 449 GLU C OE1 1 ATOM 2478 O OE2 . GLU G 2 49 ? -17.282 -2.738 8.883 1.00 19.62 ? 449 GLU C OE2 1 ATOM 2479 N N . SER G 2 50 ? -13.045 0.086 5.319 1.00 16.76 ? 450 SER C N 1 ATOM 2480 C CA . SER G 2 50 ? -12.126 0.900 4.513 1.00 16.12 ? 450 SER C CA 1 ATOM 2481 C C . SER G 2 50 ? -11.497 1.992 5.346 1.00 16.56 ? 450 SER C C 1 ATOM 2482 O O . SER G 2 50 ? -12.037 2.406 6.385 1.00 18.06 ? 450 SER C O 1 ATOM 2483 C CB . SER G 2 50 ? -12.894 1.546 3.352 1.00 16.87 ? 450 SER C CB 1 ATOM 2484 O OG . SER G 2 50 ? -13.796 2.516 3.817 1.00 18.84 ? 450 SER C OG 1 ATOM 2485 N N . LEU G 2 51 ? -10.343 2.475 4.887 1.00 14.60 ? 451 LEU C N 1 ATOM 2486 C CA . LEU G 2 51 ? -9.654 3.538 5.593 1.00 14.56 ? 451 LEU C CA 1 ATOM 2487 C C . LEU G 2 51 ? -10.541 4.796 5.555 1.00 15.54 ? 451 LEU C C 1 ATOM 2488 O O . LEU G 2 51 ? -10.579 5.557 6.536 1.00 17.69 ? 451 LEU C O 1 ATOM 2489 C CB . LEU G 2 51 ? -8.308 3.798 4.914 1.00 14.51 ? 451 LEU C CB 1 ATOM 2490 C CG . LEU G 2 51 ? -7.488 4.894 5.566 1.00 15.78 ? 451 LEU C CG 1 ATOM 2491 C CD1 . LEU G 2 51 ? -7.177 4.593 7.042 1.00 16.61 ? 451 LEU C CD1 1 ATOM 2492 C CD2 . LEU G 2 51 ? -6.165 5.069 4.764 1.00 19.43 ? 451 LEU C CD2 1 ATOM 2493 N N . ALA G 2 52 ? -11.280 4.973 4.449 1.00 16.28 ? 452 ALA C N 1 ATOM 2494 C CA . ALA G 2 52 ? -12.169 6.142 4.367 1.00 17.20 ? 452 ALA C CA 1 ATOM 2495 C C . ALA G 2 52 ? -13.239 6.096 5.449 1.00 15.26 ? 452 ALA C C 1 ATOM 2496 O O . ALA G 2 52 ? -13.487 7.122 6.119 1.00 16.99 ? 452 ALA C O 1 ATOM 2497 C CB . ALA G 2 52 ? -12.825 6.200 2.999 1.00 21.14 ? 452 ALA C CB 1 ATOM 2498 N N . ASP G 2 53 ? -13.844 4.921 5.644 1.00 15.32 ? 453 ASP C N 1 ATOM 2499 C CA . ASP G 2 53 ? -14.889 4.763 6.662 1.00 17.71 ? 453 ASP C CA 1 ATOM 2500 C C . ASP G 2 53 ? -14.327 4.986 8.062 1.00 17.44 ? 453 ASP C C 1 ATOM 2501 O O . ASP G 2 53 ? -14.957 5.592 8.923 1.00 15.13 ? 453 ASP C O 1 ATOM 2502 C CB . ASP G 2 53 ? -15.520 3.385 6.583 1.00 15.41 ? 453 ASP C CB 1 ATOM 2503 C CG . ASP G 2 53 ? -16.594 3.285 5.516 1.00 21.54 ? 453 ASP C CG 1 ATOM 2504 O OD1 . ASP G 2 53 ? -16.822 4.294 4.807 1.00 22.24 ? 453 ASP C OD1 1 ATOM 2505 O OD2 . ASP G 2 53 ? -17.190 2.190 5.389 1.00 20.98 ? 453 ASP C OD2 1 ATOM 2506 N N . VAL G 2 54 ? -13.120 4.490 8.300 1.00 14.95 ? 454 VAL C N 1 ATOM 2507 C CA . VAL G 2 54 ? -12.568 4.691 9.636 1.00 15.44 ? 454 VAL C CA 1 ATOM 2508 C C . VAL G 2 54 ? -12.141 6.136 9.877 1.00 15.57 ? 454 VAL C C 1 ATOM 2509 O O . VAL G 2 54 ? -12.397 6.700 10.955 1.00 14.15 ? 454 VAL C O 1 ATOM 2510 C CB . VAL G 2 54 ? -11.431 3.659 9.885 1.00 15.43 ? 454 VAL C CB 1 ATOM 2511 C CG1 . VAL G 2 54 ? -10.808 3.859 11.307 1.00 14.44 ? 454 VAL C CG1 1 ATOM 2512 C CG2 . VAL G 2 54 ? -12.037 2.258 9.764 1.00 13.48 ? 454 VAL C CG2 1 ATOM 2513 N N . GLN G 2 55 ? -11.519 6.764 8.888 1.00 13.63 ? 455 GLN C N 1 ATOM 2514 C CA . GLN G 2 55 ? -11.122 8.151 9.066 1.00 12.26 ? 455 GLN C CA 1 ATOM 2515 C C . GLN G 2 55 ? -12.381 9.018 9.271 1.00 17.34 ? 455 GLN C C 1 ATOM 2516 O O . GLN G 2 55 ? -12.326 10.019 10.014 1.00 17.61 ? 455 GLN C O 1 ATOM 2517 C CB . GLN G 2 55 ? -10.360 8.699 7.830 1.00 14.51 ? 455 GLN C CB 1 ATOM 2518 C CG . GLN G 2 55 ? -8.918 8.233 7.802 1.00 13.99 ? 455 GLN C CG 1 ATOM 2519 C CD . GLN G 2 55 ? -8.161 8.750 6.601 1.00 19.86 ? 455 GLN C CD 1 ATOM 2520 O OE1 . GLN G 2 55 ? -8.752 9.353 5.681 1.00 21.63 ? 455 GLN C OE1 1 ATOM 2521 N NE2 . GLN G 2 55 ? -6.849 8.493 6.570 1.00 17.41 ? 455 GLN C NE2 1 ATOM 2522 N N . ALA G 2 56 ? -13.471 8.630 8.621 1.00 16.70 ? 456 ALA C N 1 ATOM 2523 C CA . ALA G 2 56 ? -14.722 9.446 8.699 1.00 17.54 ? 456 ALA C CA 1 ATOM 2524 C C . ALA G 2 56 ? -15.263 9.488 10.115 1.00 20.29 ? 456 ALA C C 1 ATOM 2525 O O . ALA G 2 56 ? -16.062 10.401 10.468 1.00 17.54 ? 456 ALA C O 1 ATOM 2526 C CB . ALA G 2 56 ? -15.811 8.872 7.758 1.00 19.80 ? 456 ALA C CB 1 ATOM 2527 N N . VAL G 2 57 ? -14.868 8.530 10.956 1.00 15.43 ? 457 VAL C N 1 ATOM 2528 C CA . VAL G 2 57 ? -15.368 8.527 12.334 1.00 13.36 ? 457 VAL C CA 1 ATOM 2529 C C . VAL G 2 57 ? -14.995 9.799 13.072 1.00 18.00 ? 457 VAL C C 1 ATOM 2530 O O . VAL G 2 57 ? -15.723 10.214 13.985 1.00 17.57 ? 457 VAL C O 1 ATOM 2531 C CB . VAL G 2 57 ? -14.835 7.272 13.090 1.00 16.80 ? 457 VAL C CB 1 ATOM 2532 C CG1 . VAL G 2 57 ? -15.297 7.258 14.569 1.00 14.01 ? 457 VAL C CG1 1 ATOM 2533 C CG2 . VAL G 2 57 ? -15.401 6.020 12.392 1.00 12.72 ? 457 VAL C CG2 1 ATOM 2534 N N . CYS G 2 58 ? -13.884 10.438 12.682 1.00 16.54 ? 458 CYS C N 1 ATOM 2535 C CA . CYS G 2 58 ? -13.444 11.659 13.305 1.00 14.49 ? 458 CYS C CA 1 ATOM 2536 C C . CYS G 2 58 ? -14.489 12.795 13.108 1.00 18.42 ? 458 CYS C C 1 ATOM 2537 O O . CYS G 2 58 ? -14.423 13.833 13.809 1.00 23.92 ? 458 CYS C O 1 ATOM 2538 C CB . CYS G 2 58 ? -12.086 12.109 12.722 1.00 17.42 ? 458 CYS C CB 1 ATOM 2539 S SG . CYS G 2 58 ? -10.767 10.926 13.214 1.00 19.19 ? 458 CYS C SG 1 ATOM 2540 N N . SER G 2 59 ? -15.408 12.600 12.169 1.00 20.98 ? 459 SER C N 1 ATOM 2541 C CA . SER G 2 59 ? -16.444 13.639 11.909 1.00 22.40 ? 459 SER C CA 1 ATOM 2542 C C . SER G 2 59 ? -17.800 13.137 12.394 1.00 22.11 ? 459 SER C C 1 ATOM 2543 O O . SER G 2 59 ? -18.844 13.712 12.055 1.00 24.22 ? 459 SER C O 1 ATOM 2544 C CB A SER G 2 59 ? -16.503 13.975 10.416 0.57 22.78 ? 459 SER C CB 1 ATOM 2545 C CB B SER G 2 59 ? -16.434 13.973 10.437 0.43 21.74 ? 459 SER C CB 1 ATOM 2546 O OG A SER G 2 59 ? -17.225 13.002 9.699 0.57 21.39 ? 459 SER C OG 1 ATOM 2547 O OG B SER G 2 59 ? -15.160 14.480 10.089 0.43 22.14 ? 459 SER C OG 1 ATOM 2548 N N . GLN G 2 60 ? -17.797 12.096 13.223 1.00 20.37 ? 460 GLN C N 1 ATOM 2549 C CA . GLN G 2 60 ? -19.021 11.520 13.704 1.00 19.94 ? 460 GLN C CA 1 ATOM 2550 C C . GLN G 2 60 ? -19.366 11.910 15.150 1.00 20.15 ? 460 GLN C C 1 ATOM 2551 O O . GLN G 2 60 ? -19.240 13.094 15.480 1.00 22.52 ? 460 GLN C O 1 ATOM 2552 C CB . GLN G 2 60 ? -19.020 10.002 13.426 1.00 17.83 ? 460 GLN C CB 1 ATOM 2553 C CG . GLN G 2 60 ? -19.043 9.846 11.895 1.00 18.30 ? 460 GLN C CG 1 ATOM 2554 C CD . GLN G 2 60 ? -18.943 8.436 11.357 1.00 17.12 ? 460 GLN C CD 1 ATOM 2555 O OE1 . GLN G 2 60 ? -19.120 7.454 12.062 1.00 18.86 ? 460 GLN C OE1 1 ATOM 2556 N NE2 . GLN G 2 60 ? -18.635 8.338 10.079 1.00 19.42 ? 460 GLN C NE2 1 ATOM 2557 N N . LYS G 2 61 ? -19.756 10.971 16.002 1.00 22.53 ? 461 LYS C N 1 ATOM 2558 C CA . LYS G 2 61 ? -20.173 11.321 17.373 1.00 23.76 ? 461 LYS C CA 1 ATOM 2559 C C . LYS G 2 61 ? -19.103 11.610 18.407 1.00 22.85 ? 461 LYS C C 1 ATOM 2560 O O . LYS G 2 61 ? -18.369 10.722 18.855 1.00 21.87 ? 461 LYS C O 1 ATOM 2561 C CB . LYS G 2 61 ? -21.152 10.248 17.911 1.00 21.46 ? 461 LYS C CB 1 ATOM 2562 C CG . LYS G 2 61 ? -21.903 10.673 19.203 1.00 23.50 ? 461 LYS C CG 1 ATOM 2563 C CD . LYS G 2 61 ? -22.770 9.527 19.704 1.00 28.51 ? 461 LYS C CD 1 ATOM 2564 C CE . LYS G 2 61 ? -23.515 9.854 21.011 1.00 36.09 ? 461 LYS C CE 1 ATOM 2565 N NZ . LYS G 2 61 ? -24.179 8.597 21.496 1.00 41.45 ? 461 LYS C NZ 1 ATOM 2566 N N . ASN G 2 62 ? -19.008 12.878 18.803 1.00 24.00 ? 462 ASN C N 1 ATOM 2567 C CA . ASN G 2 62 ? -18.046 13.260 19.816 1.00 24.73 ? 462 ASN C CA 1 ATOM 2568 C C . ASN G 2 62 ? -18.478 12.640 21.138 1.00 26.63 ? 462 ASN C C 1 ATOM 2569 O O . ASN G 2 62 ? -19.635 12.780 21.561 1.00 30.02 ? 462 ASN C O 1 ATOM 2570 C CB . ASN G 2 62 ? -17.993 14.793 19.914 1.00 25.29 ? 462 ASN C CB 1 ATOM 2571 C CG . ASN G 2 62 ? -16.866 15.295 20.785 1.00 34.49 ? 462 ASN C CG 1 ATOM 2572 O OD1 . ASN G 2 62 ? -17.015 16.345 21.416 1.00 37.97 ? 462 ASN C OD1 1 ATOM 2573 N ND2 . ASN G 2 62 ? -15.717 14.578 20.822 1.00 27.13 ? 462 ASN C ND2 1 ATOM 2574 N N . VAL G 2 63 ? -17.560 11.926 21.775 1.00 22.93 ? 463 VAL C N 1 ATOM 2575 C CA . VAL G 2 63 ? -17.779 11.260 23.060 1.00 25.44 ? 463 VAL C CA 1 ATOM 2576 C C . VAL G 2 63 ? -16.546 11.408 23.901 1.00 29.23 ? 463 VAL C C 1 ATOM 2577 O O . VAL G 2 63 ? -15.471 11.741 23.403 1.00 27.93 ? 463 VAL C O 1 ATOM 2578 C CB . VAL G 2 63 ? -18.100 9.752 22.923 1.00 29.40 ? 463 VAL C CB 1 ATOM 2579 C CG1 . VAL G 2 63 ? -19.371 9.568 22.145 1.00 25.11 ? 463 VAL C CG1 1 ATOM 2580 C CG2 . VAL G 2 63 ? -16.890 8.997 22.261 1.00 23.63 ? 463 VAL C CG2 1 ATOM 2581 N N . ALA G 2 64 ? -16.687 11.197 25.202 1.00 30.56 ? 464 ALA C N 1 ATOM 2582 C CA . ALA G 2 64 ? -15.522 11.350 26.032 1.00 32.01 ? 464 ALA C CA 1 ATOM 2583 C C . ALA G 2 64 ? -14.623 10.144 25.876 1.00 26.28 ? 464 ALA C C 1 ATOM 2584 O O . ALA G 2 64 ? -15.105 9.029 25.641 1.00 30.18 ? 464 ALA C O 1 ATOM 2585 C CB . ALA G 2 64 ? -15.932 11.508 27.504 1.00 37.48 ? 464 ALA C CB 1 ATOM 2586 N N . CYS G 2 65 ? -13.318 10.391 25.967 1.00 26.23 ? 465 CYS C N 1 ATOM 2587 C CA . CYS G 2 65 ? -12.299 9.349 25.938 1.00 22.91 ? 465 CYS C CA 1 ATOM 2588 C C . CYS G 2 65 ? -12.245 8.745 27.339 1.00 25.53 ? 465 CYS C C 1 ATOM 2589 O O . CYS G 2 65 ? -12.572 9.421 28.334 1.00 27.03 ? 465 CYS C O 1 ATOM 2590 C CB . CYS G 2 65 ? -10.919 9.931 25.681 1.00 25.34 ? 465 CYS C CB 1 ATOM 2591 S SG . CYS G 2 65 ? -10.709 10.759 24.070 1.00 26.35 ? 465 CYS C SG 1 ATOM 2592 N N . LYS G 2 66 ? -11.778 7.514 27.431 1.00 25.26 ? 466 LYS C N 1 ATOM 2593 C CA . LYS G 2 66 ? -11.667 6.844 28.706 1.00 33.08 ? 466 LYS C CA 1 ATOM 2594 C C . LYS G 2 66 ? -10.859 7.701 29.659 1.00 36.68 ? 466 LYS C C 1 ATOM 2595 O O . LYS G 2 66 ? -11.225 7.840 30.833 1.00 38.04 ? 466 LYS C O 1 ATOM 2596 C CB . LYS G 2 66 ? -10.977 5.499 28.532 1.00 31.43 ? 466 LYS C CB 1 ATOM 2597 C CG . LYS G 2 66 ? -11.808 4.469 27.862 1.00 40.95 ? 466 LYS C CG 1 ATOM 2598 C CD . LYS G 2 66 ? -11.005 3.172 27.743 1.00 43.98 ? 466 LYS C CD 1 ATOM 2599 C CE . LYS G 2 66 ? -11.828 2.099 27.041 1.00 48.23 ? 466 LYS C CE 1 ATOM 2600 N NZ . LYS G 2 66 ? -13.183 1.840 27.676 1.00 47.80 ? 466 LYS C NZ 1 ATOM 2601 N N . ASN G 2 67 ? -9.789 8.309 29.142 1.00 35.46 ? 467 ASN C N 1 ATOM 2602 C CA . ASN G 2 67 ? -8.914 9.128 29.981 1.00 33.92 ? 467 ASN C CA 1 ATOM 2603 C C . ASN G 2 67 ? -9.410 10.533 30.289 1.00 33.83 ? 467 ASN C C 1 ATOM 2604 O O . ASN G 2 67 ? -8.688 11.305 30.915 1.00 39.40 ? 467 ASN C O 1 ATOM 2605 C CB . ASN G 2 67 ? -7.505 9.190 29.379 1.00 32.01 ? 467 ASN C CB 1 ATOM 2606 C CG . ASN G 2 67 ? -7.452 9.976 28.098 1.00 27.38 ? 467 ASN C CG 1 ATOM 2607 O OD1 . ASN G 2 67 ? -8.436 10.581 27.697 1.00 29.80 ? 467 ASN C OD1 1 ATOM 2608 N ND2 . ASN G 2 67 ? -6.285 9.993 27.463 1.00 30.06 ? 467 ASN C ND2 1 ATOM 2609 N N . GLY G 2 68 ? -10.618 10.881 29.866 1.00 31.82 ? 468 GLY C N 1 ATOM 2610 C CA . GLY G 2 68 ? -11.133 12.215 30.151 1.00 34.03 ? 468 GLY C CA 1 ATOM 2611 C C . GLY G 2 68 ? -10.961 13.247 29.054 1.00 35.96 ? 468 GLY C C 1 ATOM 2612 O O . GLY G 2 68 ? -11.641 14.296 29.064 1.00 36.64 ? 468 GLY C O 1 ATOM 2613 N N . GLN G 2 69 ? -10.069 12.978 28.102 1.00 31.67 ? 469 GLN C N 1 ATOM 2614 C CA . GLN G 2 69 ? -9.872 13.937 27.009 1.00 32.06 ? 469 GLN C CA 1 ATOM 2615 C C . GLN G 2 69 ? -11.140 14.078 26.137 1.00 27.78 ? 469 GLN C C 1 ATOM 2616 O O . GLN G 2 69 ? -12.035 13.205 26.139 1.00 29.50 ? 469 GLN C O 1 ATOM 2617 C CB . GLN G 2 69 ? -8.642 13.534 26.202 1.00 29.60 ? 469 GLN C CB 1 ATOM 2618 C CG . GLN G 2 69 ? -7.433 13.495 27.099 1.00 35.62 ? 469 GLN C CG 1 ATOM 2619 C CD . GLN G 2 69 ? -6.141 13.325 26.357 1.00 41.64 ? 469 GLN C CD 1 ATOM 2620 O OE1 . GLN G 2 69 ? -5.894 12.284 25.740 1.00 41.81 ? 469 GLN C OE1 1 ATOM 2621 N NE2 . GLN G 2 69 ? -5.293 14.353 26.412 1.00 46.84 ? 469 GLN C NE2 1 ATOM 2622 N N . THR G 2 70 ? -11.237 15.151 25.363 1.00 28.36 ? 470 THR C N 1 ATOM 2623 C CA . THR G 2 70 ? -12.485 15.381 24.614 1.00 25.58 ? 470 THR C CA 1 ATOM 2624 C C . THR G 2 70 ? -12.429 15.169 23.106 1.00 27.85 ? 470 THR C C 1 ATOM 2625 O O . THR G 2 70 ? -13.363 15.538 22.367 1.00 29.98 ? 470 THR C O 1 ATOM 2626 C CB . THR G 2 70 ? -12.986 16.828 24.861 1.00 30.96 ? 470 THR C CB 1 ATOM 2627 O OG1 . THR G 2 70 ? -12.111 17.747 24.196 1.00 33.17 ? 470 THR C OG1 1 ATOM 2628 C CG2 . THR G 2 70 ? -12.983 17.130 26.353 1.00 33.05 ? 470 THR C CG2 1 ATOM 2629 N N . ASN G 2 71 ? -11.338 14.579 22.648 1.00 21.70 ? 471 ASN C N 1 ATOM 2630 C CA . ASN G 2 71 ? -11.186 14.350 21.211 1.00 20.79 ? 471 ASN C CA 1 ATOM 2631 C C . ASN G 2 71 ? -11.481 12.922 20.762 1.00 19.79 ? 471 ASN C C 1 ATOM 2632 O O . ASN G 2 71 ? -10.850 12.468 19.822 1.00 18.67 ? 471 ASN C O 1 ATOM 2633 C CB . ASN G 2 71 ? -9.772 14.744 20.778 1.00 23.68 ? 471 ASN C CB 1 ATOM 2634 C CG . ASN G 2 71 ? -8.680 13.870 21.416 1.00 23.42 ? 471 ASN C CG 1 ATOM 2635 O OD1 . ASN G 2 71 ? -8.756 13.504 22.585 1.00 26.08 ? 471 ASN C OD1 1 ATOM 2636 N ND2 . ASN G 2 71 ? -7.650 13.549 20.638 1.00 20.69 ? 471 ASN C ND2 1 ATOM 2637 N N . CYS G 2 72 ? -12.414 12.231 21.413 1.00 21.81 ? 472 CYS C N 1 ATOM 2638 C CA . CYS G 2 72 ? -12.787 10.866 20.993 1.00 20.20 ? 472 CYS C CA 1 ATOM 2639 C C . CYS G 2 72 ? -14.068 10.895 20.192 1.00 20.92 ? 472 CYS C C 1 ATOM 2640 O O . CYS G 2 72 ? -14.943 11.751 20.381 1.00 21.98 ? 472 CYS C O 1 ATOM 2641 C CB . CYS G 2 72 ? -12.944 9.863 22.180 1.00 21.12 ? 472 CYS C CB 1 ATOM 2642 S SG . CYS G 2 72 ? -11.277 9.310 22.693 1.00 25.76 ? 472 CYS C SG 1 ATOM 2643 N N . TYR G 2 73 ? -14.149 9.979 19.229 1.00 17.34 ? 473 TYR C N 1 ATOM 2644 C CA . TYR G 2 73 ? -15.312 9.950 18.362 1.00 17.73 ? 473 TYR C CA 1 ATOM 2645 C C . TYR G 2 73 ? -15.818 8.543 18.229 1.00 18.04 ? 473 TYR C C 1 ATOM 2646 O O . TYR G 2 73 ? -15.047 7.601 18.125 1.00 18.26 ? 473 TYR C O 1 ATOM 2647 C CB . TYR G 2 73 ? -14.997 10.514 16.969 1.00 15.64 ? 473 TYR C CB 1 ATOM 2648 C CG . TYR G 2 73 ? -14.816 12.011 17.009 1.00 18.77 ? 473 TYR C CG 1 ATOM 2649 C CD1 . TYR G 2 73 ? -13.606 12.564 17.370 1.00 20.88 ? 473 TYR C CD1 1 ATOM 2650 C CD2 . TYR G 2 73 ? -15.912 12.854 16.788 1.00 25.57 ? 473 TYR C CD2 1 ATOM 2651 C CE1 . TYR G 2 73 ? -13.464 13.944 17.537 1.00 26.75 ? 473 TYR C CE1 1 ATOM 2652 C CE2 . TYR G 2 73 ? -15.789 14.238 16.935 1.00 27.20 ? 473 TYR C CE2 1 ATOM 2653 C CZ . TYR G 2 73 ? -14.571 14.763 17.319 1.00 25.38 ? 473 TYR C CZ 1 ATOM 2654 O OH . TYR G 2 73 ? -14.462 16.108 17.585 1.00 32.65 ? 473 TYR C OH 1 ATOM 2655 N N . GLN G 2 74 ? -17.138 8.418 18.234 1.00 14.85 ? 474 GLN C N 1 ATOM 2656 C CA . GLN G 2 74 ? -17.811 7.115 18.135 1.00 15.52 ? 474 GLN C CA 1 ATOM 2657 C C . GLN G 2 74 ? -18.479 6.982 16.747 1.00 19.62 ? 474 GLN C C 1 ATOM 2658 O O . GLN G 2 74 ? -19.137 7.917 16.265 1.00 17.03 ? 474 GLN C O 1 ATOM 2659 C CB . GLN G 2 74 ? -18.853 6.981 19.266 1.00 20.26 ? 474 GLN C CB 1 ATOM 2660 C CG . GLN G 2 74 ? -19.633 5.691 19.185 1.00 21.23 ? 474 GLN C CG 1 ATOM 2661 C CD . GLN G 2 74 ? -20.539 5.566 20.376 1.00 28.96 ? 474 GLN C CD 1 ATOM 2662 O OE1 . GLN G 2 74 ? -20.100 5.729 21.524 1.00 24.57 ? 474 GLN C OE1 1 ATOM 2663 N NE2 . GLN G 2 74 ? -21.807 5.276 20.122 1.00 30.10 ? 474 GLN C NE2 1 ATOM 2664 N N . SER G 2 75 ? -18.311 5.827 16.097 1.00 16.54 ? 475 SER C N 1 ATOM 2665 C CA . SER G 2 75 ? -18.842 5.637 14.767 1.00 16.74 ? 475 SER C CA 1 ATOM 2666 C C . SER G 2 75 ? -20.362 5.580 14.797 1.00 17.19 ? 475 SER C C 1 ATOM 2667 O O . SER G 2 75 ? -20.952 5.037 15.735 1.00 20.70 ? 475 SER C O 1 ATOM 2668 C CB . SER G 2 75 ? -18.293 4.360 14.117 1.00 17.84 ? 475 SER C CB 1 ATOM 2669 O OG . SER G 2 75 ? -18.629 3.203 14.861 1.00 15.94 ? 475 SER C OG 1 ATOM 2670 N N . TYR G 2 76 ? -20.976 6.219 13.815 1.00 18.63 ? 476 TYR C N 1 ATOM 2671 C CA . TYR G 2 76 ? -22.452 6.162 13.729 1.00 20.51 ? 476 TYR C CA 1 ATOM 2672 C C . TYR G 2 76 ? -22.883 4.734 13.483 1.00 21.30 ? 476 TYR C C 1 ATOM 2673 O O . TYR G 2 76 ? -23.852 4.264 14.086 1.00 21.96 ? 476 TYR C O 1 ATOM 2674 C CB . TYR G 2 76 ? -22.961 7.015 12.568 1.00 21.12 ? 476 TYR C CB 1 ATOM 2675 C CG . TYR G 2 76 ? -22.860 8.488 12.791 1.00 19.04 ? 476 TYR C CG 1 ATOM 2676 C CD1 . TYR G 2 76 ? -23.005 9.027 14.070 1.00 20.09 ? 476 TYR C CD1 1 ATOM 2677 C CD2 . TYR G 2 76 ? -22.657 9.340 11.716 1.00 20.78 ? 476 TYR C CD2 1 ATOM 2678 C CE1 . TYR G 2 76 ? -22.949 10.422 14.269 1.00 27.64 ? 476 TYR C CE1 1 ATOM 2679 C CE2 . TYR G 2 76 ? -22.590 10.718 11.898 1.00 23.90 ? 476 TYR C CE2 1 ATOM 2680 C CZ . TYR G 2 76 ? -22.737 11.238 13.184 1.00 22.98 ? 476 TYR C CZ 1 ATOM 2681 O OH . TYR G 2 76 ? -22.644 12.600 13.353 1.00 29.96 ? 476 TYR C OH 1 ATOM 2682 N N . SER G 2 77 ? -22.147 4.035 12.605 1.00 19.99 ? 477 SER C N 1 ATOM 2683 C CA . SER G 2 77 ? -22.445 2.654 12.227 1.00 16.94 ? 477 SER C CA 1 ATOM 2684 C C . SER G 2 77 ? -21.641 1.638 13.028 1.00 19.65 ? 477 SER C C 1 ATOM 2685 O O . SER G 2 77 ? -20.558 1.945 13.547 1.00 18.22 ? 477 SER C O 1 ATOM 2686 C CB . SER G 2 77 ? -22.089 2.423 10.741 1.00 16.57 ? 477 SER C CB 1 ATOM 2687 O OG . SER G 2 77 ? -22.380 1.091 10.353 1.00 19.09 ? 477 SER C OG 1 ATOM 2688 N N . THR G 2 78 ? -22.181 0.436 13.109 1.00 16.62 ? 478 THR C N 1 ATOM 2689 C CA . THR G 2 78 ? -21.455 -0.664 13.691 1.00 15.16 ? 478 THR C CA 1 ATOM 2690 C C . THR G 2 78 ? -20.440 -1.002 12.600 1.00 16.82 ? 478 THR C C 1 ATOM 2691 O O . THR G 2 78 ? -20.699 -0.730 11.418 1.00 17.51 ? 478 THR C O 1 ATOM 2692 C CB . THR G 2 78 ? -22.338 -1.905 13.935 1.00 21.77 ? 478 THR C CB 1 ATOM 2693 O OG1 . THR G 2 78 ? -23.127 -2.176 12.774 1.00 25.81 ? 478 THR C OG1 1 ATOM 2694 C CG2 . THR G 2 78 ? -23.252 -1.677 15.144 1.00 21.12 ? 478 THR C CG2 1 ATOM 2695 N N . MET G 2 79 ? -19.283 -1.557 13.002 1.00 14.42 ? 479 MET C N 1 ATOM 2696 C CA . MET G 2 79 ? -18.228 -1.946 12.073 1.00 14.47 ? 479 MET C CA 1 ATOM 2697 C C . MET G 2 79 ? -17.761 -3.349 12.413 1.00 14.93 ? 479 MET C C 1 ATOM 2698 O O . MET G 2 79 ? -17.846 -3.771 13.580 1.00 15.94 ? 479 MET C O 1 ATOM 2699 C CB . MET G 2 79 ? -17.009 -0.997 12.186 1.00 16.97 ? 479 MET C CB 1 ATOM 2700 C CG . MET G 2 79 ? -17.324 0.374 11.670 1.00 17.49 ? 479 MET C CG 1 ATOM 2701 S SD . MET G 2 79 ? -15.863 1.364 11.792 1.00 17.31 ? 479 MET C SD 1 ATOM 2702 C CE . MET G 2 79 ? -16.474 2.888 10.991 1.00 20.06 ? 479 MET C CE 1 ATOM 2703 N N . SER G 2 80 ? -17.284 -4.064 11.401 1.00 14.80 ? 480 SER C N 1 ATOM 2704 C CA . SER G 2 80 ? -16.760 -5.434 11.615 1.00 15.79 ? 480 SER C CA 1 ATOM 2705 C C . SER G 2 80 ? -15.386 -5.250 12.322 1.00 13.24 ? 480 SER C C 1 ATOM 2706 O O . SER G 2 80 ? -14.501 -4.520 11.786 1.00 15.15 ? 480 SER C O 1 ATOM 2707 C CB . SER G 2 80 ? -16.516 -6.131 10.275 1.00 17.43 ? 480 SER C CB 1 ATOM 2708 O OG . SER G 2 80 ? -15.837 -7.385 10.446 1.00 18.68 ? 480 SER C OG 1 ATOM 2709 N N . ILE G 2 81 ? -15.216 -5.833 13.507 1.00 13.32 ? 481 ILE C N 1 ATOM 2710 C CA . ILE G 2 81 ? -13.932 -5.695 14.222 1.00 12.97 ? 481 ILE C CA 1 ATOM 2711 C C . ILE G 2 81 ? -13.453 -7.022 14.786 1.00 15.17 ? 481 ILE C C 1 ATOM 2712 O O . ILE G 2 81 ? -14.197 -7.967 14.849 1.00 18.34 ? 481 ILE C O 1 ATOM 2713 C CB . ILE G 2 81 ? -14.003 -4.686 15.415 1.00 14.99 ? 481 ILE C CB 1 ATOM 2714 C CG1 . ILE G 2 81 ? -14.976 -5.189 16.515 1.00 17.38 ? 481 ILE C CG1 1 ATOM 2715 C CG2 . ILE G 2 81 ? -14.394 -3.311 14.866 1.00 15.43 ? 481 ILE C CG2 1 ATOM 2716 C CD1 . ILE G 2 81 ? -15.111 -4.190 17.685 1.00 20.76 ? 481 ILE C CD1 1 ATOM 2717 N N . THR G 2 82 ? -12.171 -7.108 15.130 1.00 12.45 ? 482 THR C N 1 ATOM 2718 C CA . THR G 2 82 ? -11.709 -8.338 15.773 1.00 12.16 ? 482 THR C CA 1 ATOM 2719 C C . THR G 2 82 ? -10.955 -7.847 17.046 1.00 15.55 ? 482 THR C C 1 ATOM 2720 O O . THR G 2 82 ? -10.132 -6.953 16.943 1.00 14.44 ? 482 THR C O 1 ATOM 2721 C CB . THR G 2 82 ? -10.723 -9.070 14.904 1.00 14.70 ? 482 THR C CB 1 ATOM 2722 O OG1 . THR G 2 82 ? -11.367 -9.452 13.670 1.00 15.87 ? 482 THR C OG1 1 ATOM 2723 C CG2 . THR G 2 82 ? -10.169 -10.336 15.636 1.00 15.90 ? 482 THR C CG2 1 ATOM 2724 N N . ASP G 2 83 ? -11.307 -8.388 18.229 1.00 13.33 ? 483 ASP C N 1 ATOM 2725 C CA . ASP G 2 83 ? -10.631 -8.086 19.498 1.00 13.93 ? 483 ASP C CA 1 ATOM 2726 C C . ASP G 2 83 ? -9.525 -9.128 19.692 1.00 15.64 ? 483 ASP C C 1 ATOM 2727 O O . ASP G 2 83 ? -9.794 -10.333 19.548 1.00 14.32 ? 483 ASP C O 1 ATOM 2728 C CB . ASP G 2 83 ? -11.626 -8.264 20.675 1.00 19.96 ? 483 ASP C CB 1 ATOM 2729 C CG . ASP G 2 83 ? -12.738 -7.242 20.617 1.00 32.62 ? 483 ASP C CG 1 ATOM 2730 O OD1 . ASP G 2 83 ? -12.378 -6.072 20.404 1.00 34.52 ? 483 ASP C OD1 1 ATOM 2731 O OD2 . ASP G 2 83 ? -13.936 -7.593 20.763 1.00 39.91 ? 483 ASP C OD2 1 ATOM 2732 N N . CYS G 2 84 ? -8.293 -8.690 19.965 1.00 12.75 ? 484 CYS C N 1 ATOM 2733 C CA . CYS G 2 84 ? -7.204 -9.623 20.200 1.00 11.80 ? 484 CYS C CA 1 ATOM 2734 C C . CYS G 2 84 ? -6.853 -9.423 21.670 1.00 12.41 ? 484 CYS C C 1 ATOM 2735 O O . CYS G 2 84 ? -6.543 -8.295 22.079 1.00 14.13 ? 484 CYS C O 1 ATOM 2736 C CB . CYS G 2 84 ? -5.980 -9.261 19.361 1.00 16.06 ? 484 CYS C CB 1 ATOM 2737 S SG . CYS G 2 84 ? -6.318 -9.481 17.586 1.00 17.22 ? 484 CYS C SG 1 ATOM 2738 N N . ARG G 2 85 ? -6.934 -10.497 22.474 1.00 13.96 ? 485 ARG C N 1 ATOM 2739 C CA . ARG G 2 85 ? -6.636 -10.408 23.925 1.00 12.93 ? 485 ARG C CA 1 ATOM 2740 C C . ARG G 2 85 ? -5.617 -11.485 24.277 1.00 12.79 ? 485 ARG C C 1 ATOM 2741 O O . ARG G 2 85 ? -5.772 -12.660 23.929 1.00 12.72 ? 485 ARG C O 1 ATOM 2742 C CB . ARG G 2 85 ? -7.930 -10.647 24.739 1.00 16.21 ? 485 ARG C CB 1 ATOM 2743 C CG . ARG G 2 85 ? -8.955 -9.528 24.618 1.00 23.03 ? 485 ARG C CG 1 ATOM 2744 C CD . ARG G 2 85 ? -10.195 -9.868 25.482 1.00 35.23 ? 485 ARG C CD 1 ATOM 2745 N NE . ARG G 2 85 ? -11.259 -10.525 24.701 1.00 45.65 ? 485 ARG C NE 1 ATOM 2746 C CZ . ARG G 2 85 ? -12.382 -9.934 24.294 1.00 42.24 ? 485 ARG C CZ 1 ATOM 2747 N NH1 . ARG G 2 85 ? -12.624 -8.654 24.597 1.00 46.94 ? 485 ARG C NH1 1 ATOM 2748 N NH2 . ARG G 2 85 ? -13.253 -10.601 23.547 1.00 47.00 ? 485 ARG C NH2 1 ATOM 2749 N N . GLU G 2 86 ? -4.574 -11.112 25.001 1.00 12.02 ? 486 GLU C N 1 ATOM 2750 C CA . GLU G 2 86 ? -3.573 -12.102 25.360 1.00 12.21 ? 486 GLU C CA 1 ATOM 2751 C C . GLU G 2 86 ? -4.159 -13.258 26.180 1.00 13.42 ? 486 GLU C C 1 ATOM 2752 O O . GLU G 2 86 ? -5.077 -13.068 26.983 1.00 14.64 ? 486 GLU C O 1 ATOM 2753 C CB . GLU G 2 86 ? -2.499 -11.484 26.265 1.00 15.37 ? 486 GLU C CB 1 ATOM 2754 C CG . GLU G 2 86 ? -1.282 -11.011 25.640 1.00 20.26 ? 486 GLU C CG 1 ATOM 2755 C CD . GLU G 2 86 ? -0.212 -10.792 26.729 1.00 19.06 ? 486 GLU C CD 1 ATOM 2756 O OE1 . GLU G 2 86 ? -0.560 -10.023 27.659 1.00 18.00 ? 486 GLU C OE1 1 ATOM 2757 O OE2 . GLU G 2 86 ? 0.884 -11.369 26.634 1.00 18.77 ? 486 GLU C OE2 1 ATOM 2758 N N . THR G 2 87 ? -3.666 -14.465 25.900 1.00 12.04 ? 487 THR C N 1 ATOM 2759 C CA . THR G 2 87 ? -4.066 -15.606 26.737 1.00 14.92 ? 487 THR C CA 1 ATOM 2760 C C . THR G 2 87 ? -3.162 -15.660 27.980 1.00 14.16 ? 487 THR C C 1 ATOM 2761 O O . THR G 2 87 ? -2.118 -15.014 28.068 1.00 14.64 ? 487 THR C O 1 ATOM 2762 C CB . THR G 2 87 ? -3.873 -16.950 26.019 1.00 14.10 ? 487 THR C CB 1 ATOM 2763 O OG1 . THR G 2 87 ? -2.464 -17.197 25.839 1.00 16.73 ? 487 THR C OG1 1 ATOM 2764 C CG2 . THR G 2 87 ? -4.589 -16.923 24.686 1.00 20.46 ? 487 THR C CG2 1 ATOM 2765 N N . GLY G 2 88 ? -3.531 -16.513 28.938 1.00 15.23 ? 488 GLY C N 1 ATOM 2766 C CA . GLY G 2 88 ? -2.690 -16.650 30.115 1.00 18.42 ? 488 GLY C CA 1 ATOM 2767 C C . GLY G 2 88 ? -1.340 -17.316 29.901 1.00 18.54 ? 488 GLY C C 1 ATOM 2768 O O . GLY G 2 88 ? -0.443 -17.181 30.744 1.00 21.52 ? 488 GLY C O 1 ATOM 2769 N N . SER G 2 89 ? -1.170 -18.023 28.779 1.00 17.94 ? 489 SER C N 1 ATOM 2770 C CA . SER G 2 89 ? 0.110 -18.682 28.540 1.00 18.34 ? 489 SER C CA 1 ATOM 2771 C C . SER G 2 89 ? 1.061 -17.842 27.672 1.00 20.21 ? 489 SER C C 1 ATOM 2772 O O . SER G 2 89 ? 2.194 -18.241 27.397 1.00 22.20 ? 489 SER C O 1 ATOM 2773 C CB A SER G 2 89 ? -0.096 -20.068 27.912 0.65 24.66 ? 489 SER C CB 1 ATOM 2774 C CB B SER G 2 89 ? -0.152 -20.025 27.731 0.35 21.58 ? 489 SER C CB 1 ATOM 2775 O OG A SER G 2 89 ? -0.680 -19.955 26.629 0.65 27.51 ? 489 SER C OG 1 ATOM 2776 O OG B SER G 2 89 ? -1.161 -20.807 28.333 0.35 16.23 ? 489 SER C OG 1 ATOM 2777 N N . SER G 2 90 ? 0.576 -16.674 27.278 1.00 18.00 ? 490 SER C N 1 ATOM 2778 C CA . SER G 2 90 ? 1.357 -15.752 26.456 1.00 17.60 ? 490 SER C CA 1 ATOM 2779 C C . SER G 2 90 ? 2.593 -15.311 27.244 1.00 21.47 ? 490 SER C C 1 ATOM 2780 O O . SER G 2 90 ? 2.465 -14.806 28.354 1.00 22.95 ? 490 SER C O 1 ATOM 2781 C CB . SER G 2 90 ? 0.483 -14.550 26.104 1.00 14.53 ? 490 SER C CB 1 ATOM 2782 O OG . SER G 2 90 ? 1.264 -13.638 25.317 1.00 17.45 ? 490 SER C OG 1 ATOM 2783 N N . LYS G 2 91 ? 3.762 -15.496 26.661 1.00 18.93 ? 491 LYS C N 1 ATOM 2784 C CA . LYS G 2 91 ? 4.996 -15.113 27.346 1.00 21.31 ? 491 LYS C CA 1 ATOM 2785 C C . LYS G 2 91 ? 6.062 -14.767 26.349 1.00 15.16 ? 491 LYS C C 1 ATOM 2786 O O . LYS G 2 91 ? 6.579 -15.654 25.635 1.00 22.68 ? 491 LYS C O 1 ATOM 2787 C CB . LYS G 2 91 ? 5.441 -16.258 28.256 1.00 25.00 ? 491 LYS C CB 1 ATOM 2788 C CG . LYS G 2 91 ? 5.380 -15.865 29.768 1.00 41.27 ? 491 LYS C CG 1 ATOM 2789 C CD . LYS G 2 91 ? 3.946 -15.797 30.413 1.00 38.25 ? 491 LYS C CD 1 ATOM 2790 C CE . LYS G 2 91 ? 3.108 -17.120 30.284 1.00 37.89 ? 491 LYS C CE 1 ATOM 2791 N NZ . LYS G 2 91 ? 2.378 -17.614 31.536 1.00 40.18 ? 491 LYS C NZ 1 ATOM 2792 N N . TYR G 2 92 ? 6.353 -13.462 26.259 1.00 18.01 ? 492 TYR C N 1 ATOM 2793 C CA . TYR G 2 92 ? 7.343 -12.967 25.309 1.00 17.77 ? 492 TYR C CA 1 ATOM 2794 C C . TYR G 2 92 ? 8.566 -13.896 25.312 1.00 19.68 ? 492 TYR C C 1 ATOM 2795 O O . TYR G 2 92 ? 9.065 -14.203 26.392 1.00 22.81 ? 492 TYR C O 1 ATOM 2796 C CB . TYR G 2 92 ? 7.762 -11.560 25.690 1.00 14.25 ? 492 TYR C CB 1 ATOM 2797 C CG . TYR G 2 92 ? 8.700 -10.972 24.715 1.00 17.38 ? 492 TYR C CG 1 ATOM 2798 C CD1 . TYR G 2 92 ? 8.241 -10.377 23.526 1.00 16.34 ? 492 TYR C CD1 1 ATOM 2799 C CD2 . TYR G 2 92 ? 10.090 -11.047 24.927 1.00 15.91 ? 492 TYR C CD2 1 ATOM 2800 C CE1 . TYR G 2 92 ? 9.139 -9.881 22.585 1.00 19.51 ? 492 TYR C CE1 1 ATOM 2801 C CE2 . TYR G 2 92 ? 10.990 -10.551 23.978 1.00 18.01 ? 492 TYR C CE2 1 ATOM 2802 C CZ . TYR G 2 92 ? 10.519 -9.975 22.830 1.00 15.40 ? 492 TYR C CZ 1 ATOM 2803 O OH . TYR G 2 92 ? 11.393 -9.500 21.899 1.00 18.78 ? 492 TYR C OH 1 ATOM 2804 N N . PRO G 2 93 ? 9.123 -14.248 24.128 1.00 18.48 ? 493 PRO C N 1 ATOM 2805 C CA . PRO G 2 93 ? 8.757 -13.888 22.765 1.00 20.22 ? 493 PRO C CA 1 ATOM 2806 C C . PRO G 2 93 ? 7.696 -14.757 22.133 1.00 20.65 ? 493 PRO C C 1 ATOM 2807 O O . PRO G 2 93 ? 7.430 -14.582 20.959 1.00 29.82 ? 493 PRO C O 1 ATOM 2808 C CB . PRO G 2 93 ? 10.083 -14.015 22.001 1.00 20.86 ? 493 PRO C CB 1 ATOM 2809 C CG . PRO G 2 93 ? 10.587 -15.282 22.580 1.00 20.71 ? 493 PRO C CG 1 ATOM 2810 C CD . PRO G 2 93 ? 10.336 -15.112 24.096 1.00 20.34 ? 493 PRO C CD 1 ATOM 2811 N N . ASN G 2 94 ? 7.065 -15.620 22.920 1.00 19.28 ? 494 ASN C N 1 ATOM 2812 C CA . ASN G 2 94 ? 6.015 -16.490 22.358 1.00 21.63 ? 494 ASN C CA 1 ATOM 2813 C C . ASN G 2 94 ? 4.671 -15.902 22.818 1.00 21.04 ? 494 ASN C C 1 ATOM 2814 O O . ASN G 2 94 ? 4.031 -16.381 23.737 1.00 21.36 ? 494 ASN C O 1 ATOM 2815 C CB . ASN G 2 94 ? 6.184 -17.919 22.893 1.00 27.86 ? 494 ASN C CB 1 ATOM 2816 C CG . ASN G 2 94 ? 7.489 -18.554 22.432 1.00 30.17 ? 494 ASN C CG 1 ATOM 2817 O OD1 . ASN G 2 94 ? 7.662 -18.827 21.236 1.00 35.58 ? 494 ASN C OD1 1 ATOM 2818 N ND2 . ASN G 2 94 ? 8.413 -18.766 23.358 1.00 33.04 ? 494 ASN C ND2 1 ATOM 2819 N N . CYS G 2 95 ? 4.307 -14.784 22.224 1.00 20.26 ? 495 CYS C N 1 ATOM 2820 C CA . CYS G 2 95 ? 3.066 -14.124 22.587 1.00 20.34 ? 495 CYS C CA 1 ATOM 2821 C C . CYS G 2 95 ? 1.911 -14.994 22.067 1.00 19.48 ? 495 CYS C C 1 ATOM 2822 O O . CYS G 2 95 ? 2.097 -15.755 21.137 1.00 21.91 ? 495 CYS C O 1 ATOM 2823 C CB . CYS G 2 95 ? 3.063 -12.729 21.938 1.00 19.64 ? 495 CYS C CB 1 ATOM 2824 S SG . CYS G 2 95 ? 4.441 -11.684 22.594 1.00 20.40 ? 495 CYS C SG 1 ATOM 2825 N N . ALA G 2 96 ? 0.740 -14.906 22.685 1.00 12.89 ? 496 ALA C N 1 ATOM 2826 C CA . ALA G 2 96 ? -0.403 -15.725 22.234 1.00 13.94 ? 496 ALA C CA 1 ATOM 2827 C C . ALA G 2 96 ? -1.673 -14.988 22.555 1.00 15.78 ? 496 ALA C C 1 ATOM 2828 O O . ALA G 2 96 ? -1.755 -14.341 23.621 1.00 12.48 ? 496 ALA C O 1 ATOM 2829 C CB . ALA G 2 96 ? -0.389 -17.076 22.961 1.00 15.51 ? 496 ALA C CB 1 ATOM 2830 N N . TYR G 2 97 ? -2.674 -15.093 21.676 1.00 13.18 ? 497 TYR C N 1 ATOM 2831 C CA . TYR G 2 97 ? -3.910 -14.347 21.764 1.00 11.62 ? 497 TYR C CA 1 ATOM 2832 C C . TYR G 2 97 ? -5.141 -15.125 21.438 1.00 12.99 ? 497 TYR C C 1 ATOM 2833 O O . TYR G 2 97 ? -5.101 -16.068 20.652 1.00 15.05 ? 497 TYR C O 1 ATOM 2834 C CB . TYR G 2 97 ? -3.877 -13.180 20.724 1.00 12.38 ? 497 TYR C CB 1 ATOM 2835 C CG . TYR G 2 97 ? -2.780 -12.173 20.957 1.00 11.62 ? 497 TYR C CG 1 ATOM 2836 C CD1 . TYR G 2 97 ? -1.466 -12.402 20.506 1.00 10.94 ? 497 TYR C CD1 1 ATOM 2837 C CD2 . TYR G 2 97 ? -3.041 -11.047 21.740 1.00 12.10 ? 497 TYR C CD2 1 ATOM 2838 C CE1 . TYR G 2 97 ? -0.441 -11.511 20.854 1.00 9.72 ? 497 TYR C CE1 1 ATOM 2839 C CE2 . TYR G 2 97 ? -1.997 -10.145 22.099 1.00 10.54 ? 497 TYR C CE2 1 ATOM 2840 C CZ . TYR G 2 97 ? -0.735 -10.388 21.655 1.00 15.90 ? 497 TYR C CZ 1 ATOM 2841 O OH . TYR G 2 97 ? 0.291 -9.531 21.951 1.00 13.72 ? 497 TYR C OH 1 ATOM 2842 N N . LYS G 2 98 ? -6.228 -14.673 22.030 1.00 11.46 ? 498 LYS C N 1 ATOM 2843 C CA . LYS G 2 98 ? -7.541 -15.193 21.699 1.00 11.96 ? 498 LYS C CA 1 ATOM 2844 C C . LYS G 2 98 ? -8.143 -14.177 20.694 1.00 14.99 ? 498 LYS C C 1 ATOM 2845 O O . LYS G 2 98 ? -8.079 -12.968 20.906 1.00 16.10 ? 498 LYS C O 1 ATOM 2846 C CB . LYS G 2 98 ? -8.375 -15.220 22.954 1.00 16.56 ? 498 LYS C CB 1 ATOM 2847 C CG . LYS G 2 98 ? -9.824 -15.573 22.732 1.00 25.86 ? 498 LYS C CG 1 ATOM 2848 C CD . LYS G 2 98 ? -10.516 -15.375 24.088 1.00 31.80 ? 498 LYS C CD 1 ATOM 2849 C CE . LYS G 2 98 ? -12.005 -15.608 24.060 1.00 41.12 ? 498 LYS C CE 1 ATOM 2850 N NZ . LYS G 2 98 ? -12.494 -15.483 25.485 1.00 47.15 ? 498 LYS C NZ 1 ATOM 2851 N N . THR G 2 99 ? -8.754 -14.702 19.639 1.00 12.88 ? 499 THR C N 1 ATOM 2852 C CA . THR G 2 99 ? -9.400 -13.920 18.565 1.00 14.54 ? 499 THR C CA 1 ATOM 2853 C C . THR G 2 99 ? -10.908 -13.951 18.766 1.00 16.42 ? 499 THR C C 1 ATOM 2854 O O . THR G 2 99 ? -11.476 -15.044 18.941 1.00 16.17 ? 499 THR C O 1 ATOM 2855 C CB . THR G 2 99 ? -9.058 -14.627 17.219 1.00 14.06 ? 499 THR C CB 1 ATOM 2856 O OG1 . THR G 2 99 ? -7.643 -14.547 17.005 1.00 12.95 ? 499 THR C OG1 1 ATOM 2857 C CG2 . THR G 2 99 ? -9.776 -13.973 16.030 1.00 14.50 ? 499 THR C CG2 1 ATOM 2858 N N . THR G 2 100 ? -11.562 -12.784 18.765 1.00 15.79 ? 500 THR C N 1 ATOM 2859 C CA . THR G 2 100 ? -13.019 -12.709 18.882 1.00 16.90 ? 500 THR C CA 1 ATOM 2860 C C . THR G 2 100 ? -13.533 -11.718 17.862 1.00 19.16 ? 500 THR C C 1 ATOM 2861 O O . THR G 2 100 ? -13.134 -10.585 17.860 1.00 17.32 ? 500 THR C O 1 ATOM 2862 C CB . THR G 2 100 ? -13.475 -12.241 20.286 1.00 19.15 ? 500 THR C CB 1 ATOM 2863 O OG1 . THR G 2 100 ? -12.873 -13.099 21.264 1.00 23.66 ? 500 THR C OG1 1 ATOM 2864 C CG2 . THR G 2 100 ? -15.044 -12.356 20.418 1.00 20.28 ? 500 THR C CG2 1 ATOM 2865 N N . GLN G 2 101 ? -14.473 -12.154 17.019 1.00 20.14 ? 501 GLN C N 1 ATOM 2866 C CA . GLN G 2 101 ? -15.036 -11.257 15.998 1.00 20.79 ? 501 GLN C CA 1 ATOM 2867 C C . GLN G 2 101 ? -16.225 -10.547 16.600 1.00 21.39 ? 501 GLN C C 1 ATOM 2868 O O . GLN G 2 101 ? -16.946 -11.115 17.448 1.00 24.07 ? 501 GLN C O 1 ATOM 2869 C CB . GLN G 2 101 ? -15.590 -12.035 14.821 1.00 24.02 ? 501 GLN C CB 1 ATOM 2870 C CG . GLN G 2 101 ? -14.712 -13.037 14.236 1.00 36.34 ? 501 GLN C CG 1 ATOM 2871 C CD . GLN G 2 101 ? -15.453 -13.844 13.195 1.00 41.15 ? 501 GLN C CD 1 ATOM 2872 O OE1 . GLN G 2 101 ? -16.621 -14.205 13.392 1.00 43.45 ? 501 GLN C OE1 1 ATOM 2873 N NE2 . GLN G 2 101 ? -14.782 -14.136 12.082 1.00 36.93 ? 501 GLN C NE2 1 ATOM 2874 N N . ALA G 2 102 ? -16.477 -9.325 16.151 1.00 19.75 ? 502 ALA C N 1 ATOM 2875 C CA . ALA G 2 102 ? -17.615 -8.559 16.661 1.00 22.60 ? 502 ALA C CA 1 ATOM 2876 C C . ALA G 2 102 ? -18.071 -7.523 15.622 1.00 20.61 ? 502 ALA C C 1 ATOM 2877 O O . ALA G 2 102 ? -17.371 -7.275 14.629 1.00 20.25 ? 502 ALA C O 1 ATOM 2878 C CB . ALA G 2 102 ? -17.252 -7.853 17.991 1.00 20.29 ? 502 ALA C CB 1 ATOM 2879 N N . ASN G 2 103 ? -19.289 -6.982 15.827 1.00 18.41 ? 503 ASN C N 1 ATOM 2880 C CA . ASN G 2 103 ? -19.842 -5.914 14.966 1.00 19.48 ? 503 ASN C CA 1 ATOM 2881 C C . ASN G 2 103 ? -20.302 -4.882 15.961 1.00 20.25 ? 503 ASN C C 1 ATOM 2882 O O . ASN G 2 103 ? -21.362 -5.033 16.569 1.00 21.66 ? 503 ASN C O 1 ATOM 2883 C CB . ASN G 2 103 ? -21.023 -6.422 14.098 1.00 24.25 ? 503 ASN C CB 1 ATOM 2884 C CG . ASN G 2 103 ? -20.549 -7.345 12.967 1.00 31.91 ? 503 ASN C CG 1 ATOM 2885 O OD1 . ASN G 2 103 ? -20.032 -6.891 11.938 1.00 32.14 ? 503 ASN C OD1 1 ATOM 2886 N ND2 . ASN G 2 103 ? -20.681 -8.657 13.177 1.00 41.21 ? 503 ASN C ND2 1 ATOM 2887 N N . LYS G 2 104 ? -19.475 -3.859 16.181 1.00 17.05 ? 504 LYS C N 1 ATOM 2888 C CA . LYS G 2 104 ? -19.739 -2.834 17.172 1.00 14.75 ? 504 LYS C CA 1 ATOM 2889 C C . LYS G 2 104 ? -19.333 -1.450 16.677 1.00 12.85 ? 504 LYS C C 1 ATOM 2890 O O . LYS G 2 104 ? -18.636 -1.310 15.673 1.00 15.65 ? 504 LYS C O 1 ATOM 2891 C CB . LYS G 2 104 ? -18.896 -3.121 18.420 1.00 18.36 ? 504 LYS C CB 1 ATOM 2892 C CG . LYS G 2 104 ? -19.191 -4.509 19.050 1.00 24.35 ? 504 LYS C CG 1 ATOM 2893 C CD . LYS G 2 104 ? -18.202 -4.822 20.164 1.00 33.28 ? 504 LYS C CD 1 ATOM 2894 C CE . LYS G 2 104 ? -18.483 -3.992 21.413 1.00 40.70 ? 504 LYS C CE 1 ATOM 2895 N NZ . LYS G 2 104 ? -17.401 -4.136 22.483 1.00 48.55 ? 504 LYS C NZ 1 ATOM 2896 N N . HIS G 2 105 ? -19.745 -0.429 17.402 1.00 17.19 ? 505 HIS C N 1 ATOM 2897 C CA . HIS G 2 105 ? -19.306 0.908 17.035 1.00 18.85 ? 505 HIS C CA 1 ATOM 2898 C C . HIS G 2 105 ? -17.893 1.046 17.599 1.00 17.81 ? 505 HIS C C 1 ATOM 2899 O O . HIS G 2 105 ? -17.596 0.514 18.662 1.00 19.55 ? 505 HIS C O 1 ATOM 2900 C CB . HIS G 2 105 ? -20.136 1.960 17.747 1.00 19.71 ? 505 HIS C CB 1 ATOM 2901 C CG . HIS G 2 105 ? -21.574 1.888 17.423 1.00 20.44 ? 505 HIS C CG 1 ATOM 2902 N ND1 . HIS G 2 105 ? -22.436 1.005 18.042 1.00 28.69 ? 505 HIS C ND1 1 ATOM 2903 C CD2 . HIS G 2 105 ? -22.290 2.526 16.481 1.00 21.14 ? 505 HIS C CD2 1 ATOM 2904 C CE1 . HIS G 2 105 ? -23.631 1.105 17.484 1.00 24.08 ? 505 HIS C CE1 1 ATOM 2905 N NE2 . HIS G 2 105 ? -23.572 2.017 16.537 1.00 26.81 ? 505 HIS C NE2 1 ATOM 2906 N N . ILE G 2 106 ? -17.022 1.774 16.911 1.00 15.39 ? 506 ILE C N 1 ATOM 2907 C CA . ILE G 2 106 ? -15.686 1.961 17.462 1.00 14.93 ? 506 ILE C CA 1 ATOM 2908 C C . ILE G 2 106 ? -15.560 3.370 18.024 1.00 19.31 ? 506 ILE C C 1 ATOM 2909 O O . ILE G 2 106 ? -16.305 4.294 17.606 1.00 18.48 ? 506 ILE C O 1 ATOM 2910 C CB . ILE G 2 106 ? -14.566 1.731 16.425 1.00 15.16 ? 506 ILE C CB 1 ATOM 2911 C CG1 . ILE G 2 106 ? -14.684 2.746 15.281 1.00 16.66 ? 506 ILE C CG1 1 ATOM 2912 C CG2 . ILE G 2 106 ? -14.670 0.275 15.845 1.00 14.30 ? 506 ILE C CG2 1 ATOM 2913 C CD1 . ILE G 2 106 ? -13.492 2.728 14.313 1.00 16.86 ? 506 ILE C CD1 1 ATOM 2914 N N . ILE G 2 107 ? -14.655 3.526 18.998 1.00 13.98 ? 507 ILE C N 1 ATOM 2915 C CA . ILE G 2 107 ? -14.423 4.835 19.588 1.00 14.41 ? 507 ILE C CA 1 ATOM 2916 C C . ILE G 2 107 ? -12.931 5.086 19.428 1.00 15.83 ? 507 ILE C C 1 ATOM 2917 O O . ILE G 2 107 ? -12.135 4.310 19.918 1.00 15.74 ? 507 ILE C O 1 ATOM 2918 C CB . ILE G 2 107 ? -14.779 4.837 21.058 1.00 16.23 ? 507 ILE C CB 1 ATOM 2919 C CG1 . ILE G 2 107 ? -16.269 4.501 21.220 1.00 19.76 ? 507 ILE C CG1 1 ATOM 2920 C CG2 . ILE G 2 107 ? -14.450 6.187 21.661 1.00 19.17 ? 507 ILE C CG2 1 ATOM 2921 C CD1 . ILE G 2 107 ? -16.684 4.344 22.684 1.00 26.44 ? 507 ILE C CD1 1 ATOM 2922 N N . VAL G 2 108 ? -12.569 6.165 18.738 1.00 15.88 ? 508 VAL C N 1 ATOM 2923 C CA . VAL G 2 108 ? -11.164 6.458 18.500 1.00 14.51 ? 508 VAL C CA 1 ATOM 2924 C C . VAL G 2 108 ? -10.876 7.895 18.884 1.00 17.69 ? 508 VAL C C 1 ATOM 2925 O O . VAL G 2 108 ? -11.777 8.745 18.854 1.00 19.92 ? 508 VAL C O 1 ATOM 2926 C CB . VAL G 2 108 ? -10.761 6.257 16.980 1.00 13.99 ? 508 VAL C CB 1 ATOM 2927 C CG1 . VAL G 2 108 ? -10.933 4.784 16.568 1.00 15.24 ? 508 VAL C CG1 1 ATOM 2928 C CG2 . VAL G 2 108 ? -11.669 7.107 16.046 1.00 17.28 ? 508 VAL C CG2 1 ATOM 2929 N N . ALA G 2 109 ? -9.628 8.168 19.221 1.00 16.49 ? 509 ALA C N 1 ATOM 2930 C CA . ALA G 2 109 ? -9.196 9.552 19.517 1.00 14.46 ? 509 ALA C CA 1 ATOM 2931 C C . ALA G 2 109 ? -8.641 10.075 18.197 1.00 15.87 ? 509 ALA C C 1 ATOM 2932 O O . ALA G 2 109 ? -7.889 9.389 17.507 1.00 15.82 ? 509 ALA C O 1 ATOM 2933 C CB . ALA G 2 109 ? -8.098 9.554 20.597 1.00 16.92 ? 509 ALA C CB 1 ATOM 2934 N N . CYS G 2 110 ? -8.968 11.314 17.870 1.00 15.75 ? 510 CYS C N 1 ATOM 2935 C CA . CYS G 2 110 ? -8.528 11.896 16.593 1.00 15.09 ? 510 CYS C CA 1 ATOM 2936 C C . CYS G 2 110 ? -7.712 13.168 16.788 1.00 18.89 ? 510 CYS C C 1 ATOM 2937 O O . CYS G 2 110 ? -7.957 13.952 17.709 1.00 21.90 ? 510 CYS C O 1 ATOM 2938 C CB . CYS G 2 110 ? -9.742 12.266 15.755 1.00 18.49 ? 510 CYS C CB 1 ATOM 2939 S SG . CYS G 2 110 ? -10.829 10.880 15.288 1.00 22.46 ? 510 CYS C SG 1 ATOM 2940 N N . GLU G 2 111 ? -6.757 13.386 15.893 1.00 14.82 ? 511 GLU C N 1 ATOM 2941 C CA . GLU G 2 111 ? -5.945 14.590 15.947 1.00 15.42 ? 511 GLU C CA 1 ATOM 2942 C C . GLU G 2 111 ? -5.837 15.170 14.555 1.00 17.73 ? 511 GLU C C 1 ATOM 2943 O O . GLU G 2 111 ? -5.845 14.442 13.559 1.00 17.66 ? 511 GLU C O 1 ATOM 2944 C CB . GLU G 2 111 ? -4.541 14.280 16.480 1.00 18.62 ? 511 GLU C CB 1 ATOM 2945 C CG . GLU G 2 111 ? -4.628 14.000 17.982 1.00 23.65 ? 511 GLU C CG 1 ATOM 2946 C CD . GLU G 2 111 ? -3.290 13.608 18.583 1.00 30.85 ? 511 GLU C CD 1 ATOM 2947 O OE1 . GLU G 2 111 ? -2.314 13.465 17.818 1.00 30.75 ? 511 GLU C OE1 1 ATOM 2948 O OE2 . GLU G 2 111 ? -3.243 13.434 19.830 1.00 32.35 ? 511 GLU C OE2 1 ATOM 2949 N N . GLY G 2 112 ? -5.670 16.496 14.530 1.00 15.72 ? 512 GLY C N 1 ATOM 2950 C CA . GLY G 2 112 ? -5.542 17.198 13.250 1.00 16.00 ? 512 GLY C CA 1 ATOM 2951 C C . GLY G 2 112 ? -5.353 18.664 13.534 1.00 18.27 ? 512 GLY C C 1 ATOM 2952 O O . GLY G 2 112 ? -5.091 19.033 14.679 1.00 18.16 ? 512 GLY C O 1 ATOM 2953 N N . ASN G 2 113 ? -5.477 19.487 12.481 1.00 16.93 ? 513 ASN C N 1 ATOM 2954 C CA . ASN G 2 113 ? -5.352 20.973 12.589 1.00 17.68 ? 513 ASN C CA 1 ATOM 2955 C C . ASN G 2 113 ? -6.483 21.552 11.759 1.00 16.78 ? 513 ASN C C 1 ATOM 2956 O O . ASN G 2 113 ? -6.778 21.092 10.692 1.00 17.82 ? 513 ASN C O 1 ATOM 2957 C CB . ASN G 2 113 ? -4.010 21.462 12.049 1.00 17.25 ? 513 ASN C CB 1 ATOM 2958 C CG . ASN G 2 113 ? -2.888 21.151 13.012 1.00 27.48 ? 513 ASN C CG 1 ATOM 2959 O OD1 . ASN G 2 113 ? -2.982 21.464 14.212 1.00 27.17 ? 513 ASN C OD1 1 ATOM 2960 N ND2 . ASN G 2 113 ? -1.831 20.541 12.504 1.00 24.98 ? 513 ASN C ND2 1 ATOM 2961 N N . PRO G 2 114 ? -7.149 22.581 12.275 1.00 16.37 ? 514 PRO C N 1 ATOM 2962 C CA . PRO G 2 114 ? -8.275 23.191 11.559 1.00 16.65 ? 514 PRO C CA 1 ATOM 2963 C C . PRO G 2 114 ? -7.830 23.818 10.256 1.00 15.16 ? 514 PRO C C 1 ATOM 2964 O O . PRO G 2 114 ? -6.680 24.213 10.129 1.00 16.39 ? 514 PRO C O 1 ATOM 2965 C CB . PRO G 2 114 ? -8.842 24.208 12.596 1.00 17.77 ? 514 PRO C CB 1 ATOM 2966 C CG . PRO G 2 114 ? -7.606 24.595 13.346 1.00 19.82 ? 514 PRO C CG 1 ATOM 2967 C CD . PRO G 2 114 ? -6.887 23.241 13.566 1.00 18.88 ? 514 PRO C CD 1 ATOM 2968 N N . TYR G 2 115 ? -8.732 23.831 9.272 1.00 15.32 ? 515 TYR C N 1 ATOM 2969 C CA . TYR G 2 115 ? -8.407 24.380 7.928 1.00 14.81 ? 515 TYR C CA 1 ATOM 2970 C C . TYR G 2 115 ? -8.638 25.895 8.082 1.00 13.75 ? 515 TYR C C 1 ATOM 2971 O O . TYR G 2 115 ? -9.783 26.355 8.133 1.00 16.86 ? 515 TYR C O 1 ATOM 2972 C CB . TYR G 2 115 ? -9.350 23.677 6.949 1.00 17.34 ? 515 TYR C CB 1 ATOM 2973 C CG . TYR G 2 115 ? -9.062 23.900 5.476 1.00 16.31 ? 515 TYR C CG 1 ATOM 2974 C CD1 . TYR G 2 115 ? -7.896 23.391 4.894 1.00 16.70 ? 515 TYR C CD1 1 ATOM 2975 C CD2 . TYR G 2 115 ? -9.979 24.608 4.664 1.00 20.08 ? 515 TYR C CD2 1 ATOM 2976 C CE1 . TYR G 2 115 ? -7.656 23.558 3.515 1.00 18.18 ? 515 TYR C CE1 1 ATOM 2977 C CE2 . TYR G 2 115 ? -9.731 24.800 3.293 1.00 20.57 ? 515 TYR C CE2 1 ATOM 2978 C CZ . TYR G 2 115 ? -8.560 24.248 2.742 1.00 21.07 ? 515 TYR C CZ 1 ATOM 2979 O OH . TYR G 2 115 ? -8.321 24.333 1.382 1.00 21.76 ? 515 TYR C OH 1 ATOM 2980 N N . VAL G 2 116 ? -7.508 26.604 8.183 1.00 13.91 ? 516 VAL C N 1 ATOM 2981 C CA . VAL G 2 116 ? -7.466 28.049 8.441 1.00 14.47 ? 516 VAL C CA 1 ATOM 2982 C C . VAL G 2 116 ? -6.589 28.838 7.470 1.00 14.69 ? 516 VAL C C 1 ATOM 2983 O O . VAL G 2 116 ? -5.772 28.297 6.743 1.00 12.33 ? 516 VAL C O 1 ATOM 2984 C CB . VAL G 2 116 ? -6.978 28.361 9.864 1.00 16.03 ? 516 VAL C CB 1 ATOM 2985 C CG1 . VAL G 2 116 ? -7.954 27.722 10.897 1.00 17.56 ? 516 VAL C CG1 1 ATOM 2986 C CG2 . VAL G 2 116 ? -5.554 27.858 10.088 1.00 15.03 ? 516 VAL C CG2 1 ATOM 2987 N N . PRO G 2 117 ? -6.765 30.150 7.459 1.00 15.15 ? 517 PRO C N 1 ATOM 2988 C CA . PRO G 2 117 ? -5.944 30.957 6.548 1.00 14.05 ? 517 PRO C CA 1 ATOM 2989 C C . PRO G 2 117 ? -4.462 30.912 6.945 1.00 13.66 ? 517 PRO C C 1 ATOM 2990 O O . PRO G 2 117 ? -4.084 31.062 8.126 1.00 14.49 ? 517 PRO C O 1 ATOM 2991 C CB . PRO G 2 117 ? -6.485 32.397 6.749 1.00 14.27 ? 517 PRO C CB 1 ATOM 2992 C CG . PRO G 2 117 ? -7.893 32.217 7.265 1.00 12.89 ? 517 PRO C CG 1 ATOM 2993 C CD . PRO G 2 117 ? -7.723 30.992 8.210 1.00 12.98 ? 517 PRO C CD 1 ATOM 2994 N N . VAL G 2 118 ? -3.602 30.705 5.959 1.00 13.17 ? 518 VAL C N 1 ATOM 2995 C CA . VAL G 2 118 ? -2.156 30.761 6.195 1.00 15.27 ? 518 VAL C CA 1 ATOM 2996 C C . VAL G 2 118 ? -1.458 31.803 5.363 1.00 15.05 ? 518 VAL C C 1 ATOM 2997 O O . VAL G 2 118 ? -0.316 32.125 5.628 1.00 17.21 ? 518 VAL C O 1 ATOM 2998 C CB . VAL G 2 118 ? -1.437 29.408 6.009 1.00 17.28 ? 518 VAL C CB 1 ATOM 2999 C CG1 . VAL G 2 118 ? -1.869 28.450 7.162 1.00 16.84 ? 518 VAL C CG1 1 ATOM 3000 C CG2 . VAL G 2 118 ? -1.748 28.813 4.600 1.00 15.79 ? 518 VAL C CG2 1 ATOM 3001 N N . HIS G 2 119 ? -2.131 32.332 4.346 1.00 13.02 ? 519 HIS C N 1 ATOM 3002 C CA . HIS G 2 119 ? -1.479 33.385 3.556 1.00 14.45 ? 519 HIS C CA 1 ATOM 3003 C C . HIS G 2 119 ? -2.594 34.305 3.053 1.00 13.89 ? 519 HIS C C 1 ATOM 3004 O O . HIS G 2 119 ? -3.729 33.871 2.811 1.00 12.03 ? 519 HIS C O 1 ATOM 3005 C CB A HIS G 2 119 ? -0.783 32.799 2.286 0.57 14.27 ? 519 HIS C CB 1 ATOM 3006 C CB B HIS G 2 119 ? -0.541 32.720 2.495 0.43 21.57 ? 519 HIS C CB 1 ATOM 3007 C CG A HIS G 2 119 ? 0.197 31.689 2.539 0.57 14.54 ? 519 HIS C CG 1 ATOM 3008 C CG B HIS G 2 119 ? -0.754 33.190 1.090 0.43 22.84 ? 519 HIS C CG 1 ATOM 3009 N ND1 A HIS G 2 119 ? 1.363 31.853 3.255 0.57 15.33 ? 519 HIS C ND1 1 ATOM 3010 N ND1 B HIS G 2 119 ? -0.008 34.192 0.502 0.43 24.17 ? 519 HIS C ND1 1 ATOM 3011 C CD2 A HIS G 2 119 ? 0.212 30.411 2.079 0.57 13.61 ? 519 HIS C CD2 1 ATOM 3012 C CD2 B HIS G 2 119 ? -1.593 32.734 0.126 0.43 24.97 ? 519 HIS C CD2 1 ATOM 3013 C CE1 A HIS G 2 119 ? 2.057 30.726 3.225 0.57 15.98 ? 519 HIS C CE1 1 ATOM 3014 C CE1 B HIS G 2 119 ? -0.378 34.323 -0.763 0.43 20.70 ? 519 HIS C CE1 1 ATOM 3015 N NE2 A HIS G 2 119 ? 1.382 29.835 2.516 0.57 16.99 ? 519 HIS C NE2 1 ATOM 3016 N NE2 B HIS G 2 119 ? -1.338 33.444 -1.012 0.43 8.33 ? 519 HIS C NE2 1 ATOM 3017 N N . PHE G 2 120 ? -2.262 35.590 2.898 1.00 14.54 ? 520 PHE C N 1 ATOM 3018 C CA . PHE G 2 120 ? -3.222 36.540 2.349 1.00 13.33 ? 520 PHE C CA 1 ATOM 3019 C C . PHE G 2 120 ? -2.856 36.693 0.866 1.00 14.80 ? 520 PHE C C 1 ATOM 3020 O O . PHE G 2 120 ? -1.700 37.002 0.506 1.00 14.06 ? 520 PHE C O 1 ATOM 3021 C CB . PHE G 2 120 ? -3.184 37.859 3.099 1.00 13.45 ? 520 PHE C CB 1 ATOM 3022 C CG . PHE G 2 120 ? -4.322 38.773 2.692 1.00 12.39 ? 520 PHE C CG 1 ATOM 3023 C CD1 . PHE G 2 120 ? -4.291 39.478 1.457 1.00 11.33 ? 520 PHE C CD1 1 ATOM 3024 C CD2 . PHE G 2 120 ? -5.441 38.872 3.478 1.00 13.11 ? 520 PHE C CD2 1 ATOM 3025 C CE1 . PHE G 2 120 ? -5.388 40.263 1.046 1.00 9.30 ? 520 PHE C CE1 1 ATOM 3026 C CE2 . PHE G 2 120 ? -6.566 39.671 3.060 1.00 14.26 ? 520 PHE C CE2 1 ATOM 3027 C CZ . PHE G 2 120 ? -6.513 40.357 1.834 1.00 13.79 ? 520 PHE C CZ 1 ATOM 3028 N N . ASP G 2 121 ? -3.814 36.419 -0.008 1.00 12.36 ? 521 ASP C N 1 ATOM 3029 C CA . ASP G 2 121 ? -3.486 36.407 -1.427 1.00 11.78 ? 521 ASP C CA 1 ATOM 3030 C C . ASP G 2 121 ? -3.752 37.683 -2.185 1.00 16.42 ? 521 ASP C C 1 ATOM 3031 O O . ASP G 2 121 ? -2.875 38.151 -2.906 1.00 16.02 ? 521 ASP C O 1 ATOM 3032 C CB . ASP G 2 121 ? -4.262 35.251 -2.138 1.00 11.83 ? 521 ASP C CB 1 ATOM 3033 C CG . ASP G 2 121 ? -3.554 34.783 -3.388 1.00 16.52 ? 521 ASP C CG 1 ATOM 3034 O OD1 . ASP G 2 121 ? -2.357 34.458 -3.281 1.00 18.71 ? 521 ASP C OD1 1 ATOM 3035 O OD2 . ASP G 2 121 ? -4.189 34.702 -4.467 1.00 18.83 ? 521 ASP C OD2 1 ATOM 3036 N N . ALA G 2 122 ? -4.958 38.215 -2.015 1.00 12.49 ? 522 ALA C N 1 ATOM 3037 C CA . ALA G 2 122 ? -5.399 39.431 -2.726 1.00 13.39 ? 522 ALA C CA 1 ATOM 3038 C C . ALA G 2 122 ? -6.779 39.805 -2.241 1.00 14.90 ? 522 ALA C C 1 ATOM 3039 O O . ALA G 2 122 ? -7.361 39.154 -1.397 1.00 13.69 ? 522 ALA C O 1 ATOM 3040 C CB . ALA G 2 122 ? -5.517 39.104 -4.241 1.00 17.29 ? 522 ALA C CB 1 ATOM 3041 N N . SER G 2 123 ? -7.304 40.900 -2.764 1.00 15.36 ? 523 SER C N 1 ATOM 3042 C CA . SER G 2 123 ? -8.687 41.246 -2.427 1.00 13.12 ? 523 SER C CA 1 ATOM 3043 C C . SER G 2 123 ? -9.322 41.673 -3.760 1.00 19.32 ? 523 SER C C 1 ATOM 3044 O O . SER G 2 123 ? -8.609 42.070 -4.679 1.00 17.96 ? 523 SER C O 1 ATOM 3045 C CB A SER G 2 123 ? -8.744 42.386 -1.425 0.70 14.40 ? 523 SER C CB 1 ATOM 3046 C CB B SER G 2 123 ? -8.584 42.546 -1.406 0.30 17.88 ? 523 SER C CB 1 ATOM 3047 O OG A SER G 2 123 ? -8.093 43.595 -1.889 0.70 17.35 ? 523 SER C OG 1 ATOM 3048 O OG B SER G 2 123 ? -8.048 42.217 -0.129 0.30 14.70 ? 523 SER C OG 1 ATOM 3049 N N . VAL G 2 124 ? -10.645 41.574 -3.839 1.00 16.95 ? 524 VAL C N 1 ATOM 3050 C CA . VAL G 2 124 ? -11.373 41.951 -5.053 1.00 19.30 ? 524 VAL C CA 1 ATOM 3051 C C . VAL G 2 124 ? -12.703 42.579 -4.721 1.00 23.11 ? 524 VAL C C 1 ATOM 3052 O O . VAL G 2 124 ? -13.229 43.421 -5.539 1.00 23.38 ? 524 VAL C O 1 ATOM 3053 C CB A VAL G 2 124 ? -11.584 40.716 -5.944 0.57 22.95 ? 524 VAL C CB 1 ATOM 3054 C CB B VAL G 2 124 ? -11.407 40.627 -5.894 0.43 14.72 ? 524 VAL C CB 1 ATOM 3055 C CG1 A VAL G 2 124 ? -12.639 41.005 -7.052 0.57 28.25 ? 524 VAL C CG1 1 ATOM 3056 C CG1 B VAL G 2 124 ? -12.415 39.654 -5.309 0.43 11.05 ? 524 VAL C CG1 1 ATOM 3057 C CG2 A VAL G 2 124 ? -10.245 40.324 -6.578 0.57 30.49 ? 524 VAL C CG2 1 ATOM 3058 C CG2 B VAL G 2 124 ? -11.744 41.044 -7.332 0.43 20.01 ? 524 VAL C CG2 1 ATOM 3059 O OXT . VAL G 2 124 ? -13.288 42.240 -3.670 1.00 21.37 ? 524 VAL C OXT 1 ATOM 3060 N N . LYS H 2 1 ? 8.520 27.197 17.346 1.00 44.91 ? 601 LYS D N 1 ATOM 3061 C CA . LYS H 2 1 ? 8.378 27.955 16.070 1.00 41.44 ? 601 LYS D CA 1 ATOM 3062 C C . LYS H 2 1 ? 6.938 28.432 15.933 1.00 36.85 ? 601 LYS D C 1 ATOM 3063 O O . LYS H 2 1 ? 5.998 27.720 16.286 1.00 39.09 ? 601 LYS D O 1 ATOM 3064 C CB . LYS H 2 1 ? 8.709 27.065 14.860 1.00 43.92 ? 601 LYS D CB 1 ATOM 3065 C CG . LYS H 2 1 ? 10.169 26.615 14.762 1.00 54.00 ? 601 LYS D CG 1 ATOM 3066 C CD . LYS H 2 1 ? 10.573 25.648 15.892 1.00 55.39 ? 601 LYS D CD 1 ATOM 3067 C CE . LYS H 2 1 ? 12.104 25.503 15.990 1.00 57.27 ? 601 LYS D CE 1 ATOM 3068 N NZ . LYS H 2 1 ? 12.698 24.755 14.840 1.00 58.28 ? 601 LYS D NZ 1 ATOM 3069 N N . GLU H 2 2 ? 6.775 29.649 15.441 1.00 32.96 ? 602 GLU D N 1 ATOM 3070 C CA . GLU H 2 2 ? 5.450 30.199 15.209 1.00 26.89 ? 602 GLU D CA 1 ATOM 3071 C C . GLU H 2 2 ? 4.771 29.319 14.153 1.00 21.02 ? 602 GLU D C 1 ATOM 3072 O O . GLU H 2 2 ? 5.408 28.936 13.158 1.00 27.76 ? 602 GLU D O 1 ATOM 3073 C CB . GLU H 2 2 ? 5.621 31.644 14.705 1.00 28.52 ? 602 GLU D CB 1 ATOM 3074 C CG . GLU H 2 2 ? 4.368 32.337 14.166 1.00 24.42 ? 602 GLU D CG 1 ATOM 3075 C CD . GLU H 2 2 ? 4.725 33.738 13.571 1.00 22.22 ? 602 GLU D CD 1 ATOM 3076 O OE1 . GLU H 2 2 ? 5.650 33.850 12.717 1.00 25.35 ? 602 GLU D OE1 1 ATOM 3077 O OE2 . GLU H 2 2 ? 4.100 34.739 13.966 1.00 24.51 ? 602 GLU D OE2 1 ATOM 3078 N N . THR H 2 3 ? 3.499 28.985 14.349 1.00 24.96 ? 603 THR D N 1 ATOM 3079 C CA . THR H 2 3 ? 2.764 28.154 13.394 1.00 21.94 ? 603 THR D CA 1 ATOM 3080 C C . THR H 2 3 ? 2.365 29.074 12.239 1.00 25.45 ? 603 THR D C 1 ATOM 3081 O O . THR H 2 3 ? 2.384 30.313 12.386 1.00 20.92 ? 603 THR D O 1 ATOM 3082 C CB . THR H 2 3 ? 1.457 27.595 13.988 1.00 29.50 ? 603 THR D CB 1 ATOM 3083 O OG1 . THR H 2 3 ? 0.575 28.688 14.298 1.00 26.84 ? 603 THR D OG1 1 ATOM 3084 C CG2 . THR H 2 3 ? 1.735 26.837 15.328 1.00 26.19 ? 603 THR D CG2 1 ATOM 3085 N N . ALA H 2 4 ? 2.041 28.457 11.110 1.00 21.45 ? 604 ALA D N 1 ATOM 3086 C CA . ALA H 2 4 ? 1.623 29.211 9.910 1.00 21.07 ? 604 ALA D CA 1 ATOM 3087 C C . ALA H 2 4 ? 0.346 29.982 10.263 1.00 19.42 ? 604 ALA D C 1 ATOM 3088 O O . ALA H 2 4 ? 0.174 31.142 9.795 1.00 16.36 ? 604 ALA D O 1 ATOM 3089 C CB . ALA H 2 4 ? 1.343 28.247 8.720 1.00 21.06 ? 604 ALA D CB 1 ATOM 3090 N N . ALA H 2 5 ? -0.563 29.351 10.993 1.00 19.35 ? 605 ALA D N 1 ATOM 3091 C CA . ALA H 2 5 ? -1.813 30.020 11.381 1.00 17.25 ? 605 ALA D CA 1 ATOM 3092 C C . ALA H 2 5 ? -1.512 31.270 12.207 1.00 19.89 ? 605 ALA D C 1 ATOM 3093 O O . ALA H 2 5 ? -2.103 32.341 11.984 1.00 14.84 ? 605 ALA D O 1 ATOM 3094 C CB . ALA H 2 5 ? -2.758 29.055 12.189 1.00 17.42 ? 605 ALA D CB 1 ATOM 3095 N N . ALA H 2 6 ? -0.580 31.155 13.165 1.00 17.05 ? 606 ALA D N 1 ATOM 3096 C CA . ALA H 2 6 ? -0.241 32.297 13.983 1.00 20.58 ? 606 ALA D CA 1 ATOM 3097 C C . ALA H 2 6 ? 0.456 33.361 13.184 1.00 15.87 ? 606 ALA D C 1 ATOM 3098 O O . ALA H 2 6 ? 0.250 34.551 13.458 1.00 16.61 ? 606 ALA D O 1 ATOM 3099 C CB . ALA H 2 6 ? 0.651 31.867 15.204 1.00 22.07 ? 606 ALA D CB 1 ATOM 3100 N N . LYS H 2 7 ? 1.272 32.964 12.206 1.00 14.03 ? 607 LYS D N 1 ATOM 3101 C CA . LYS H 2 7 ? 1.947 33.945 11.365 1.00 16.36 ? 607 LYS D CA 1 ATOM 3102 C C . LYS H 2 7 ? 0.890 34.747 10.563 1.00 13.19 ? 607 LYS D C 1 ATOM 3103 O O . LYS H 2 7 ? 1.034 35.979 10.377 1.00 15.00 ? 607 LYS D O 1 ATOM 3104 C CB . LYS H 2 7 ? 2.879 33.275 10.362 1.00 17.65 ? 607 LYS D CB 1 ATOM 3105 C CG . LYS H 2 7 ? 3.620 34.307 9.471 1.00 18.80 ? 607 LYS D CG 1 ATOM 3106 C CD . LYS H 2 7 ? 4.651 33.609 8.593 1.00 26.08 ? 607 LYS D CD 1 ATOM 3107 C CE . LYS H 2 7 ? 5.526 34.629 7.850 1.00 29.76 ? 607 LYS D CE 1 ATOM 3108 N NZ . LYS H 2 7 ? 6.518 33.917 6.929 1.00 29.42 ? 607 LYS D NZ 1 ATOM 3109 N N . PHE H 2 8 ? -0.148 34.070 10.090 1.00 14.58 ? 608 PHE D N 1 ATOM 3110 C CA . PHE H 2 8 ? -1.201 34.814 9.371 1.00 11.17 ? 608 PHE D CA 1 ATOM 3111 C C . PHE H 2 8 ? -1.887 35.838 10.290 1.00 15.27 ? 608 PHE D C 1 ATOM 3112 O O . PHE H 2 8 ? -2.204 36.957 9.863 1.00 13.11 ? 608 PHE D O 1 ATOM 3113 C CB . PHE H 2 8 ? -2.283 33.835 8.827 1.00 14.66 ? 608 PHE D CB 1 ATOM 3114 C CG . PHE H 2 8 ? -3.452 34.544 8.183 1.00 10.38 ? 608 PHE D CG 1 ATOM 3115 C CD1 . PHE H 2 8 ? -4.531 35.000 8.956 1.00 11.95 ? 608 PHE D CD1 1 ATOM 3116 C CD2 . PHE H 2 8 ? -3.455 34.746 6.770 1.00 11.83 ? 608 PHE D CD2 1 ATOM 3117 C CE1 . PHE H 2 8 ? -5.619 35.661 8.352 1.00 15.04 ? 608 PHE D CE1 1 ATOM 3118 C CE2 . PHE H 2 8 ? -4.510 35.400 6.130 1.00 12.09 ? 608 PHE D CE2 1 ATOM 3119 C CZ . PHE H 2 8 ? -5.603 35.869 6.903 1.00 14.18 ? 608 PHE D CZ 1 ATOM 3120 N N . GLU H 2 9 ? -2.137 35.468 11.551 1.00 15.67 ? 609 GLU D N 1 ATOM 3121 C CA . GLU H 2 9 ? -2.806 36.382 12.469 1.00 14.35 ? 609 GLU D CA 1 ATOM 3122 C C . GLU H 2 9 ? -1.862 37.556 12.707 1.00 14.94 ? 609 GLU D C 1 ATOM 3123 O O . GLU H 2 9 ? -2.288 38.734 12.648 1.00 14.93 ? 609 GLU D O 1 ATOM 3124 C CB . GLU H 2 9 ? -3.119 35.651 13.813 1.00 12.13 ? 609 GLU D CB 1 ATOM 3125 C CG . GLU H 2 9 ? -4.167 34.562 13.666 1.00 17.03 ? 609 GLU D CG 1 ATOM 3126 C CD . GLU H 2 9 ? -4.373 33.816 14.989 1.00 21.45 ? 609 GLU D CD 1 ATOM 3127 O OE1 . GLU H 2 9 ? -3.733 34.261 15.980 1.00 24.23 ? 609 GLU D OE1 1 ATOM 3128 O OE2 . GLU H 2 9 ? -5.143 32.829 15.027 1.00 17.90 ? 609 GLU D OE2 1 ATOM 3129 N N . ARG H 2 10 ? -0.574 37.270 12.939 1.00 12.67 ? 610 ARG D N 1 ATOM 3130 C CA . ARG H 2 10 ? 0.348 38.348 13.161 1.00 11.89 ? 610 ARG D CA 1 ATOM 3131 C C . ARG H 2 10 ? 0.422 39.311 11.964 1.00 14.03 ? 610 ARG D C 1 ATOM 3132 O O . ARG H 2 10 ? 0.429 40.534 12.124 1.00 13.80 ? 610 ARG D O 1 ATOM 3133 C CB . ARG H 2 10 ? 1.785 37.818 13.407 1.00 13.67 ? 610 ARG D CB 1 ATOM 3134 C CG . ARG H 2 10 ? 2.822 38.940 13.334 1.00 14.71 ? 610 ARG D CG 1 ATOM 3135 C CD . ARG H 2 10 ? 4.182 38.418 13.907 1.00 17.86 ? 610 ARG D CD 1 ATOM 3136 N NE . ARG H 2 10 ? 4.744 37.303 13.112 1.00 20.00 ? 610 ARG D NE 1 ATOM 3137 C CZ . ARG H 2 10 ? 5.494 37.437 12.030 1.00 17.07 ? 610 ARG D CZ 1 ATOM 3138 N NH1 . ARG H 2 10 ? 5.806 38.655 11.584 1.00 20.47 ? 610 ARG D NH1 1 ATOM 3139 N NH2 . ARG H 2 10 ? 5.917 36.367 11.351 1.00 19.96 ? 610 ARG D NH2 1 ATOM 3140 N N . GLN H 2 11 ? 0.510 38.767 10.752 1.00 13.73 ? 611 GLN D N 1 ATOM 3141 C CA . GLN H 2 11 ? 0.661 39.661 9.610 1.00 13.92 ? 611 GLN D CA 1 ATOM 3142 C C . GLN H 2 11 ? -0.607 40.342 9.101 1.00 14.11 ? 611 GLN D C 1 ATOM 3143 O O . GLN H 2 11 ? -0.526 41.387 8.445 1.00 15.06 ? 611 GLN D O 1 ATOM 3144 C CB . GLN H 2 11 ? 1.225 38.868 8.424 1.00 13.15 ? 611 GLN D CB 1 ATOM 3145 C CG . GLN H 2 11 ? 2.631 38.229 8.634 1.00 12.99 ? 611 GLN D CG 1 ATOM 3146 C CD . GLN H 2 11 ? 3.179 37.861 7.285 1.00 15.95 ? 611 GLN D CD 1 ATOM 3147 O OE1 . GLN H 2 11 ? 4.035 38.561 6.746 1.00 21.52 ? 611 GLN D OE1 1 ATOM 3148 N NE2 . GLN H 2 11 ? 2.674 36.792 6.716 1.00 18.09 ? 611 GLN D NE2 1 ATOM 3149 N N . HIS H 2 12 ? -1.756 39.752 9.386 1.00 12.84 ? 612 HIS D N 1 ATOM 3150 C CA . HIS H 2 12 ? -2.979 40.261 8.752 1.00 12.35 ? 612 HIS D CA 1 ATOM 3151 C C . HIS H 2 12 ? -4.191 40.569 9.581 1.00 13.77 ? 612 HIS D C 1 ATOM 3152 O O . HIS H 2 12 ? -5.158 41.102 9.076 1.00 15.63 ? 612 HIS D O 1 ATOM 3153 C CB . HIS H 2 12 ? -3.421 39.226 7.672 1.00 11.66 ? 612 HIS D CB 1 ATOM 3154 C CG . HIS H 2 12 ? -2.368 38.914 6.650 1.00 10.41 ? 612 HIS D CG 1 ATOM 3155 N ND1 . HIS H 2 12 ? -1.834 39.876 5.805 1.00 10.86 ? 612 HIS D ND1 1 ATOM 3156 C CD2 . HIS H 2 12 ? -1.693 37.764 6.384 1.00 12.34 ? 612 HIS D CD2 1 ATOM 3157 C CE1 . HIS H 2 12 ? -0.875 39.328 5.072 1.00 12.74 ? 612 HIS D CE1 1 ATOM 3158 N NE2 . HIS H 2 12 ? -0.769 38.050 5.405 1.00 14.47 ? 612 HIS D NE2 1 ATOM 3159 N N . MET H 2 13 ? -4.212 40.122 10.829 1.00 13.21 ? 613 MET D N 1 ATOM 3160 C CA . MET H 2 13 ? -5.386 40.355 11.633 1.00 13.78 ? 613 MET D CA 1 ATOM 3161 C C . MET H 2 13 ? -5.293 41.582 12.499 1.00 13.88 ? 613 MET D C 1 ATOM 3162 O O . MET H 2 13 ? -4.309 41.793 13.185 1.00 13.30 ? 613 MET D O 1 ATOM 3163 C CB . MET H 2 13 ? -5.639 39.135 12.574 1.00 12.49 ? 613 MET D CB 1 ATOM 3164 C CG . MET H 2 13 ? -6.139 37.872 11.851 1.00 12.87 ? 613 MET D CG 1 ATOM 3165 S SD . MET H 2 13 ? -7.770 38.084 11.043 1.00 14.60 ? 613 MET D SD 1 ATOM 3166 C CE . MET H 2 13 ? -8.864 38.752 12.357 1.00 16.46 ? 613 MET D CE 1 ATOM 3167 N N . ASP H 2 14 ? -6.372 42.358 12.502 1.00 11.65 ? 614 ASP D N 1 ATOM 3168 C CA . ASP H 2 14 ? -6.490 43.482 13.445 1.00 13.32 ? 614 ASP D CA 1 ATOM 3169 C C . ASP H 2 14 ? -7.965 43.717 13.749 1.00 12.95 ? 614 ASP D C 1 ATOM 3170 O O . ASP H 2 14 ? -8.562 44.678 13.354 1.00 14.42 ? 614 ASP D O 1 ATOM 3171 C CB . ASP H 2 14 ? -5.793 44.758 12.962 1.00 14.68 ? 614 ASP D CB 1 ATOM 3172 C CG . ASP H 2 14 ? -5.721 45.797 14.069 1.00 17.62 ? 614 ASP D CG 1 ATOM 3173 O OD1 . ASP H 2 14 ? -5.936 45.382 15.234 1.00 23.77 ? 614 ASP D OD1 1 ATOM 3174 O OD2 . ASP H 2 14 ? -5.491 47.008 13.791 1.00 19.13 ? 614 ASP D OD2 1 ATOM 3175 N N . SER H 2 15 ? -8.542 42.801 14.515 1.00 12.53 ? 615 SER D N 1 ATOM 3176 C CA . SER H 2 15 ? -9.941 42.905 14.879 1.00 12.41 ? 615 SER D CA 1 ATOM 3177 C C . SER H 2 15 ? -10.249 43.926 15.928 1.00 12.84 ? 615 SER D C 1 ATOM 3178 O O . SER H 2 15 ? -11.421 44.193 16.182 1.00 15.44 ? 615 SER D O 1 ATOM 3179 C CB . SER H 2 15 ? -10.482 41.537 15.338 1.00 15.30 ? 615 SER D CB 1 ATOM 3180 O OG . SER H 2 15 ? -9.869 41.097 16.538 1.00 14.11 ? 615 SER D OG 1 ATOM 3181 N N . SER H 2 16 ? -9.218 44.515 16.532 1.00 15.71 ? 616 SER D N 1 ATOM 3182 C CA . SER H 2 16 ? -9.485 45.473 17.581 1.00 17.36 ? 616 SER D CA 1 ATOM 3183 C C . SER H 2 16 ? -9.992 46.820 17.113 1.00 19.76 ? 616 SER D C 1 ATOM 3184 O O . SER H 2 16 ? -10.406 47.661 17.951 1.00 20.37 ? 616 SER D O 1 ATOM 3185 C CB . SER H 2 16 ? -8.206 45.714 18.434 1.00 19.04 ? 616 SER D CB 1 ATOM 3186 O OG . SER H 2 16 ? -7.251 46.393 17.671 1.00 20.96 ? 616 SER D OG 1 ATOM 3187 N N . THR H 2 17 ? -9.966 47.040 15.797 1.00 16.21 ? 617 THR D N 1 ATOM 3188 C CA . THR H 2 17 ? -10.414 48.296 15.254 1.00 18.59 ? 617 THR D CA 1 ATOM 3189 C C . THR H 2 17 ? -11.278 47.987 14.056 1.00 19.55 ? 617 THR D C 1 ATOM 3190 O O . THR H 2 17 ? -11.128 46.911 13.457 1.00 18.70 ? 617 THR D O 1 ATOM 3191 C CB . THR H 2 17 ? -9.228 49.188 14.834 1.00 20.78 ? 617 THR D CB 1 ATOM 3192 O OG1 . THR H 2 17 ? -9.747 50.475 14.487 1.00 28.83 ? 617 THR D OG1 1 ATOM 3193 C CG2 . THR H 2 17 ? -8.475 48.650 13.635 1.00 16.49 ? 617 THR D CG2 1 ATOM 3194 N N . SER H 2 18 ? -12.207 48.889 13.730 1.00 19.74 ? 618 SER D N 1 ATOM 3195 C CA . SER H 2 18 ? -13.085 48.631 12.583 1.00 16.41 ? 618 SER D CA 1 ATOM 3196 C C . SER H 2 18 ? -12.524 49.146 11.265 1.00 16.98 ? 618 SER D C 1 ATOM 3197 O O . SER H 2 18 ? -13.019 48.801 10.188 1.00 18.21 ? 618 SER D O 1 ATOM 3198 C CB . SER H 2 18 ? -14.490 49.201 12.859 1.00 22.68 ? 618 SER D CB 1 ATOM 3199 O OG . SER H 2 18 ? -14.375 50.601 12.972 1.00 30.16 ? 618 SER D OG 1 ATOM 3200 N N . ALA H 2 19 ? -11.445 49.931 11.343 1.00 17.81 ? 619 ALA D N 1 ATOM 3201 C CA . ALA H 2 19 ? -10.780 50.464 10.137 1.00 18.21 ? 619 ALA D CA 1 ATOM 3202 C C . ALA H 2 19 ? -9.500 51.165 10.600 1.00 18.02 ? 619 ALA D C 1 ATOM 3203 O O . ALA H 2 19 ? -9.329 51.454 11.789 1.00 21.34 ? 619 ALA D O 1 ATOM 3204 C CB . ALA H 2 19 ? -11.668 51.502 9.439 1.00 20.41 ? 619 ALA D CB 1 ATOM 3205 N N . ALA H 2 20 ? -8.642 51.490 9.648 1.00 19.68 ? 620 ALA D N 1 ATOM 3206 C CA . ALA H 2 20 ? -7.375 52.168 9.948 1.00 19.99 ? 620 ALA D CA 1 ATOM 3207 C C . ALA H 2 20 ? -7.807 53.501 10.531 1.00 24.31 ? 620 ALA D C 1 ATOM 3208 O O . ALA H 2 20 ? -8.619 54.208 9.949 1.00 26.84 ? 620 ALA D O 1 ATOM 3209 C CB . ALA H 2 20 ? -6.604 52.382 8.663 1.00 20.29 ? 620 ALA D CB 1 ATOM 3210 N N . SER H 2 21 ? -7.233 53.850 11.671 1.00 31.83 ? 621 SER D N 1 ATOM 3211 C CA . SER H 2 21 ? -7.633 55.068 12.358 1.00 31.39 ? 621 SER D CA 1 ATOM 3212 C C . SER H 2 21 ? -6.799 56.293 12.051 1.00 32.99 ? 621 SER D C 1 ATOM 3213 O O . SER H 2 21 ? -7.014 57.333 12.658 1.00 34.41 ? 621 SER D O 1 ATOM 3214 C CB . SER H 2 21 ? -7.551 54.843 13.846 1.00 36.63 ? 621 SER D CB 1 ATOM 3215 O OG . SER H 2 21 ? -6.221 54.440 14.128 1.00 39.10 ? 621 SER D OG 1 ATOM 3216 N N . SER H 2 22 ? -5.848 56.180 11.142 1.00 23.93 ? 622 SER D N 1 ATOM 3217 C CA . SER H 2 22 ? -5.023 57.339 10.803 1.00 25.00 ? 622 SER D CA 1 ATOM 3218 C C . SER H 2 22 ? -4.124 57.018 9.645 1.00 26.38 ? 622 SER D C 1 ATOM 3219 O O . SER H 2 22 ? -3.938 55.845 9.335 1.00 23.89 ? 622 SER D O 1 ATOM 3220 C CB . SER H 2 22 ? -4.185 57.772 12.019 1.00 25.86 ? 622 SER D CB 1 ATOM 3221 O OG . SER H 2 22 ? -2.847 57.323 11.971 1.00 24.05 ? 622 SER D OG 1 ATOM 3222 N N . SER H 2 23 ? -3.549 58.041 9.004 1.00 20.63 ? 623 SER D N 1 ATOM 3223 C CA . SER H 2 23 ? -2.704 57.784 7.864 1.00 19.87 ? 623 SER D CA 1 ATOM 3224 C C . SER H 2 23 ? -1.377 57.124 8.242 1.00 20.75 ? 623 SER D C 1 ATOM 3225 O O . SER H 2 23 ? -0.619 56.717 7.351 1.00 20.88 ? 623 SER D O 1 ATOM 3226 C CB . SER H 2 23 ? -2.451 59.101 7.094 1.00 25.47 ? 623 SER D CB 1 ATOM 3227 O OG . SER H 2 23 ? -1.755 60.019 7.912 1.00 26.51 ? 623 SER D OG 1 ATOM 3228 N N . ASN H 2 24 ? -1.103 56.995 9.547 1.00 20.16 ? 624 ASN D N 1 ATOM 3229 C CA . ASN H 2 24 ? 0.135 56.353 10.020 1.00 20.10 ? 624 ASN D CA 1 ATOM 3230 C C . ASN H 2 24 ? -0.077 54.930 10.458 1.00 15.69 ? 624 ASN D C 1 ATOM 3231 O O . ASN H 2 24 ? 0.822 54.306 10.962 1.00 18.27 ? 624 ASN D O 1 ATOM 3232 C CB . ASN H 2 24 ? 0.719 57.141 11.185 1.00 22.29 ? 624 ASN D CB 1 ATOM 3233 C CG . ASN H 2 24 ? 1.507 58.328 10.699 1.00 29.97 ? 624 ASN D CG 1 ATOM 3234 O OD1 . ASN H 2 24 ? 2.309 58.209 9.758 1.00 27.64 ? 624 ASN D OD1 1 ATOM 3235 N ND2 . ASN H 2 24 ? 1.296 59.481 11.328 1.00 30.11 ? 624 ASN D ND2 1 ATOM 3236 N N . TYR H 2 25 ? -1.294 54.426 10.261 1.00 17.67 ? 625 TYR D N 1 ATOM 3237 C CA . TYR H 2 25 ? -1.641 53.061 10.689 1.00 16.46 ? 625 TYR D CA 1 ATOM 3238 C C . TYR H 2 25 ? -0.633 52.072 10.160 1.00 14.53 ? 625 TYR D C 1 ATOM 3239 O O . TYR H 2 25 ? -0.097 51.253 10.915 1.00 16.47 ? 625 TYR D O 1 ATOM 3240 C CB . TYR H 2 25 ? -3.080 52.719 10.186 1.00 15.91 ? 625 TYR D CB 1 ATOM 3241 C CG . TYR H 2 25 ? -3.523 51.277 10.497 1.00 15.46 ? 625 TYR D CG 1 ATOM 3242 C CD1 . TYR H 2 25 ? -3.202 50.221 9.638 1.00 17.27 ? 625 TYR D CD1 1 ATOM 3243 C CD2 . TYR H 2 25 ? -4.201 50.992 11.683 1.00 17.62 ? 625 TYR D CD2 1 ATOM 3244 C CE1 . TYR H 2 25 ? -3.547 48.915 9.951 1.00 16.31 ? 625 TYR D CE1 1 ATOM 3245 C CE2 . TYR H 2 25 ? -4.542 49.656 12.017 1.00 15.94 ? 625 TYR D CE2 1 ATOM 3246 C CZ . TYR H 2 25 ? -4.196 48.636 11.123 1.00 16.98 ? 625 TYR D CZ 1 ATOM 3247 O OH . TYR H 2 25 ? -4.492 47.308 11.432 1.00 19.12 ? 625 TYR D OH 1 ATOM 3248 N N . CYS H 2 26 ? -0.353 52.095 8.856 1.00 16.81 ? 626 CYS D N 1 ATOM 3249 C CA . CYS H 2 26 ? 0.591 51.107 8.353 1.00 16.34 ? 626 CYS D CA 1 ATOM 3250 C C . CYS H 2 26 ? 2.011 51.301 8.882 1.00 13.39 ? 626 CYS D C 1 ATOM 3251 O O . CYS H 2 26 ? 2.702 50.354 9.184 1.00 15.21 ? 626 CYS D O 1 ATOM 3252 C CB . CYS H 2 26 ? 0.603 51.093 6.820 1.00 16.11 ? 626 CYS D CB 1 ATOM 3253 S SG . CYS H 2 26 ? -1.026 50.554 6.111 1.00 18.05 ? 626 CYS D SG 1 ATOM 3254 N N . ASN H 2 27 ? 2.448 52.531 9.002 1.00 15.45 ? 627 ASN D N 1 ATOM 3255 C CA . ASN H 2 27 ? 3.794 52.728 9.531 1.00 18.53 ? 627 ASN D CA 1 ATOM 3256 C C . ASN H 2 27 ? 3.884 52.084 10.911 1.00 18.63 ? 627 ASN D C 1 ATOM 3257 O O . ASN H 2 27 ? 4.849 51.413 11.224 1.00 20.84 ? 627 ASN D O 1 ATOM 3258 C CB . ASN H 2 27 ? 4.082 54.216 9.692 1.00 16.85 ? 627 ASN D CB 1 ATOM 3259 C CG . ASN H 2 27 ? 4.372 54.882 8.400 1.00 16.49 ? 627 ASN D CG 1 ATOM 3260 O OD1 . ASN H 2 27 ? 4.840 54.238 7.468 1.00 17.40 ? 627 ASN D OD1 1 ATOM 3261 N ND2 . ASN H 2 27 ? 4.124 56.195 8.331 1.00 21.93 ? 627 ASN D ND2 1 ATOM 3262 N N . GLN H 2 28 ? 2.844 52.272 11.712 1.00 18.46 ? 628 GLN D N 1 ATOM 3263 C CA . GLN H 2 28 ? 2.851 51.719 13.071 1.00 19.70 ? 628 GLN D CA 1 ATOM 3264 C C . GLN H 2 28 ? 2.699 50.197 13.111 1.00 18.49 ? 628 GLN D C 1 ATOM 3265 O O . GLN H 2 28 ? 3.421 49.481 13.843 1.00 18.60 ? 628 GLN D O 1 ATOM 3266 C CB . GLN H 2 28 ? 1.722 52.368 13.908 1.00 23.29 ? 628 GLN D CB 1 ATOM 3267 C CG . GLN H 2 28 ? 1.653 53.894 13.850 1.00 27.93 ? 628 GLN D CG 1 ATOM 3268 C CD . GLN H 2 28 ? 0.249 54.476 14.142 1.00 38.94 ? 628 GLN D CD 1 ATOM 3269 O OE1 . GLN H 2 28 ? -0.784 53.783 14.058 1.00 37.23 ? 628 GLN D OE1 1 ATOM 3270 N NE2 . GLN H 2 28 ? 0.209 55.776 14.459 1.00 38.99 ? 628 GLN D NE2 1 ATOM 3271 N N . MET H 2 29 ? 1.750 49.694 12.314 1.00 16.70 ? 629 MET D N 1 ATOM 3272 C CA . MET H 2 29 ? 1.438 48.262 12.340 1.00 17.05 ? 629 MET D CA 1 ATOM 3273 C C . MET H 2 29 ? 2.462 47.421 11.644 1.00 16.61 ? 629 MET D C 1 ATOM 3274 O O . MET H 2 29 ? 2.769 46.318 12.100 1.00 16.77 ? 629 MET D O 1 ATOM 3275 C CB . MET H 2 29 ? 0.040 48.035 11.747 1.00 18.21 ? 629 MET D CB 1 ATOM 3276 C CG . MET H 2 29 ? -1.085 48.638 12.595 1.00 25.62 ? 629 MET D CG 1 ATOM 3277 S SD . MET H 2 29 ? -1.320 47.829 14.254 1.00 35.43 ? 629 MET D SD 1 ATOM 3278 C CE . MET H 2 29 ? -0.815 46.326 13.944 1.00 30.59 ? 629 MET D CE 1 ATOM 3279 N N . MET H 2 30 ? 3.004 47.906 10.520 1.00 17.87 ? 630 MET D N 1 ATOM 3280 C CA . MET H 2 30 ? 4.046 47.113 9.845 1.00 15.14 ? 630 MET D CA 1 ATOM 3281 C C . MET H 2 30 ? 5.244 46.936 10.798 1.00 19.50 ? 630 MET D C 1 ATOM 3282 O O . MET H 2 30 ? 5.884 45.893 10.808 1.00 18.82 ? 630 MET D O 1 ATOM 3283 C CB . MET H 2 30 ? 4.473 47.780 8.523 1.00 15.30 ? 630 MET D CB 1 ATOM 3284 C CG . MET H 2 30 ? 3.317 47.777 7.483 1.00 16.19 ? 630 MET D CG 1 ATOM 3285 S SD . MET H 2 30 ? 2.785 46.102 7.006 1.00 15.94 ? 630 MET D SD 1 ATOM 3286 C CE . MET H 2 30 ? 4.216 45.602 6.003 1.00 19.09 ? 630 MET D CE 1 ATOM 3287 N N . LYS H 2 31 ? 5.475 47.941 11.635 1.00 22.61 ? 631 LYS D N 1 ATOM 3288 C CA . LYS H 2 31 ? 6.571 47.861 12.624 1.00 20.58 ? 631 LYS D CA 1 ATOM 3289 C C . LYS H 2 31 ? 6.226 46.900 13.767 1.00 18.37 ? 631 LYS D C 1 ATOM 3290 O O . LYS H 2 31 ? 6.998 45.976 14.098 1.00 21.27 ? 631 LYS D O 1 ATOM 3291 C CB . LYS H 2 31 ? 6.827 49.263 13.170 1.00 24.51 ? 631 LYS D CB 1 ATOM 3292 C CG . LYS H 2 31 ? 7.854 49.269 14.285 1.00 25.86 ? 631 LYS D CG 1 ATOM 3293 C CD . LYS H 2 31 ? 8.235 50.697 14.639 1.00 33.81 ? 631 LYS D CD 1 ATOM 3294 C CE . LYS H 2 31 ? 9.209 50.697 15.812 1.00 36.92 ? 631 LYS D CE 1 ATOM 3295 N NZ . LYS H 2 31 ? 8.483 50.288 17.055 1.00 45.76 ? 631 LYS D NZ 1 ATOM 3296 N N . SER H 2 32 ? 5.032 47.083 14.335 1.00 17.56 ? 632 SER D N 1 ATOM 3297 C CA . SER H 2 32 ? 4.552 46.313 15.482 1.00 19.33 ? 632 SER D CA 1 ATOM 3298 C C . SER H 2 32 ? 4.451 44.834 15.224 1.00 22.32 ? 632 SER D C 1 ATOM 3299 O O . SER H 2 32 ? 4.689 44.007 16.114 1.00 22.28 ? 632 SER D O 1 ATOM 3300 C CB . SER H 2 32 ? 3.169 46.846 15.910 1.00 25.02 ? 632 SER D CB 1 ATOM 3301 O OG . SER H 2 32 ? 2.589 46.023 16.915 1.00 36.93 ? 632 SER D OG 1 ATOM 3302 N N . ARG H 2 33 ? 4.102 44.481 13.990 1.00 21.91 ? 633 ARG D N 1 ATOM 3303 C CA . ARG H 2 33 ? 3.930 43.071 13.626 1.00 17.38 ? 633 ARG D CA 1 ATOM 3304 C C . ARG H 2 33 ? 5.202 42.436 13.088 1.00 20.15 ? 633 ARG D C 1 ATOM 3305 O O . ARG H 2 33 ? 5.203 41.310 12.556 1.00 19.99 ? 633 ARG D O 1 ATOM 3306 C CB . ARG H 2 33 ? 2.771 42.967 12.577 1.00 15.03 ? 633 ARG D CB 1 ATOM 3307 C CG . ARG H 2 33 ? 1.457 43.532 13.121 1.00 15.81 ? 633 ARG D CG 1 ATOM 3308 C CD . ARG H 2 33 ? 0.939 42.793 14.367 1.00 13.97 ? 633 ARG D CD 1 ATOM 3309 N NE . ARG H 2 33 ? -0.349 43.318 14.824 1.00 15.70 ? 633 ARG D NE 1 ATOM 3310 C CZ . ARG H 2 33 ? -1.508 42.858 14.395 1.00 17.84 ? 633 ARG D CZ 1 ATOM 3311 N NH1 . ARG H 2 33 ? -1.533 41.835 13.502 1.00 14.34 ? 633 ARG D NH1 1 ATOM 3312 N NH2 . ARG H 2 33 ? -2.635 43.436 14.820 1.00 16.38 ? 633 ARG D NH2 1 ATOM 3313 N N . ASN H 2 34 ? 6.299 43.164 13.236 1.00 21.82 ? 634 ASN D N 1 ATOM 3314 C CA . ASN H 2 34 ? 7.601 42.663 12.816 1.00 20.71 ? 634 ASN D CA 1 ATOM 3315 C C . ASN H 2 34 ? 7.796 42.508 11.337 1.00 19.77 ? 634 ASN D C 1 ATOM 3316 O O . ASN H 2 34 ? 8.613 41.709 10.912 1.00 24.35 ? 634 ASN D O 1 ATOM 3317 C CB . ASN H 2 34 ? 7.862 41.306 13.511 1.00 26.22 ? 634 ASN D CB 1 ATOM 3318 C CG . ASN H 2 34 ? 8.475 41.470 14.865 1.00 38.42 ? 634 ASN D CG 1 ATOM 3319 O OD1 . ASN H 2 34 ? 8.819 40.479 15.522 1.00 47.07 ? 634 ASN D OD1 1 ATOM 3320 N ND2 . ASN H 2 34 ? 8.636 42.727 15.307 1.00 37.55 ? 634 ASN D ND2 1 ATOM 3321 N N . LEU H 2 35 ? 7.076 43.302 10.540 1.00 16.85 ? 635 LEU D N 1 ATOM 3322 C CA . LEU H 2 35 ? 7.212 43.206 9.088 1.00 14.86 ? 635 LEU D CA 1 ATOM 3323 C C . LEU H 2 35 ? 8.194 44.211 8.523 1.00 19.87 ? 635 LEU D C 1 ATOM 3324 O O . LEU H 2 35 ? 8.238 44.433 7.321 1.00 21.44 ? 635 LEU D O 1 ATOM 3325 C CB . LEU H 2 35 ? 5.813 43.424 8.448 1.00 14.86 ? 635 LEU D CB 1 ATOM 3326 C CG . LEU H 2 35 ? 4.817 42.425 9.049 1.00 17.32 ? 635 LEU D CG 1 ATOM 3327 C CD1 . LEU H 2 35 ? 3.364 42.585 8.387 1.00 15.67 ? 635 LEU D CD1 1 ATOM 3328 C CD2 . LEU H 2 35 ? 5.314 41.003 8.810 1.00 22.94 ? 635 LEU D CD2 1 ATOM 3329 N N . THR H 2 36 ? 9.006 44.818 9.386 1.00 21.93 ? 636 THR D N 1 ATOM 3330 C CA . THR H 2 36 ? 10.025 45.746 8.917 1.00 22.92 ? 636 THR D CA 1 ATOM 3331 C C . THR H 2 36 ? 11.360 45.302 9.566 1.00 26.02 ? 636 THR D C 1 ATOM 3332 O O . THR H 2 36 ? 12.335 46.030 9.486 1.00 29.09 ? 636 THR D O 1 ATOM 3333 C CB . THR H 2 36 ? 9.742 47.229 9.328 1.00 25.04 ? 636 THR D CB 1 ATOM 3334 O OG1 . THR H 2 36 ? 9.624 47.342 10.760 1.00 26.58 ? 636 THR D OG1 1 ATOM 3335 C CG2 . THR H 2 36 ? 8.420 47.718 8.677 1.00 28.21 ? 636 THR D CG2 1 ATOM 3336 N N . LYS H 2 37 ? 11.406 44.104 10.128 1.00 29.61 ? 637 LYS D N 1 ATOM 3337 C CA . LYS H 2 37 ? 12.635 43.629 10.811 1.00 37.13 ? 637 LYS D CA 1 ATOM 3338 C C . LYS H 2 37 ? 13.912 43.570 9.958 1.00 41.22 ? 637 LYS D C 1 ATOM 3339 O O . LYS H 2 37 ? 14.899 44.247 10.257 1.00 46.56 ? 637 LYS D O 1 ATOM 3340 C CB . LYS H 2 37 ? 12.391 42.267 11.464 1.00 34.03 ? 637 LYS D CB 1 ATOM 3341 C CG . LYS H 2 37 ? 13.570 41.773 12.301 1.00 45.84 ? 637 LYS D CG 1 ATOM 3342 C CD . LYS H 2 37 ? 13.667 42.529 13.628 1.00 52.57 ? 637 LYS D CD 1 ATOM 3343 C CE . LYS H 2 37 ? 12.338 42.373 14.391 1.00 57.95 ? 637 LYS D CE 1 ATOM 3344 N NZ . LYS H 2 37 ? 12.393 42.518 15.884 1.00 57.01 ? 637 LYS D NZ 1 ATOM 3345 N N . ASP H 2 38 ? 13.933 42.790 8.889 1.00 43.78 ? 638 ASP D N 1 ATOM 3346 C CA . ASP H 2 38 ? 15.177 42.765 8.119 1.00 40.61 ? 638 ASP D CA 1 ATOM 3347 C C . ASP H 2 38 ? 15.103 43.542 6.803 1.00 39.40 ? 638 ASP D C 1 ATOM 3348 O O . ASP H 2 38 ? 16.122 43.889 6.186 1.00 39.42 ? 638 ASP D O 1 ATOM 3349 C CB . ASP H 2 38 ? 15.587 41.304 7.901 1.00 45.82 ? 638 ASP D CB 1 ATOM 3350 C CG . ASP H 2 38 ? 16.440 40.753 9.059 1.00 49.48 ? 638 ASP D CG 1 ATOM 3351 O OD1 . ASP H 2 38 ? 16.068 40.932 10.240 1.00 48.68 ? 638 ASP D OD1 1 ATOM 3352 O OD2 . ASP H 2 38 ? 17.496 40.139 8.783 1.00 57.76 ? 638 ASP D OD2 1 ATOM 3353 N N . ARG H 2 39 ? 13.877 43.850 6.391 1.00 29.38 ? 639 ARG D N 1 ATOM 3354 C CA . ARG H 2 39 ? 13.645 44.587 5.183 1.00 26.68 ? 639 ARG D CA 1 ATOM 3355 C C . ARG H 2 39 ? 12.212 45.099 5.377 1.00 22.31 ? 639 ARG D C 1 ATOM 3356 O O . ARG H 2 39 ? 11.546 44.706 6.349 1.00 24.27 ? 639 ARG D O 1 ATOM 3357 C CB . ARG H 2 39 ? 13.710 43.660 3.977 1.00 30.50 ? 639 ARG D CB 1 ATOM 3358 C CG . ARG H 2 39 ? 12.733 42.494 4.055 1.00 37.97 ? 639 ARG D CG 1 ATOM 3359 C CD . ARG H 2 39 ? 13.102 41.397 3.060 1.00 46.16 ? 639 ARG D CD 1 ATOM 3360 N NE . ARG H 2 39 ? 13.484 40.156 3.737 1.00 54.57 ? 639 ARG D NE 1 ATOM 3361 C CZ . ARG H 2 39 ? 14.531 40.031 4.557 1.00 57.08 ? 639 ARG D CZ 1 ATOM 3362 N NH1 . ARG H 2 39 ? 15.318 41.073 4.809 1.00 60.62 ? 639 ARG D NH1 1 ATOM 3363 N NH2 . ARG H 2 39 ? 14.791 38.865 5.136 1.00 58.48 ? 639 ARG D NH2 1 ATOM 3364 N N . CYS H 2 40 ? 11.773 45.984 4.497 1.00 22.83 ? 640 CYS D N 1 ATOM 3365 C CA . CYS H 2 40 ? 10.392 46.477 4.611 1.00 21.08 ? 640 CYS D CA 1 ATOM 3366 C C . CYS H 2 40 ? 9.546 45.592 3.699 1.00 19.84 ? 640 CYS D C 1 ATOM 3367 O O . CYS H 2 40 ? 9.836 45.494 2.505 1.00 22.68 ? 640 CYS D O 1 ATOM 3368 C CB . CYS H 2 40 ? 10.249 47.904 4.116 1.00 25.06 ? 640 CYS D CB 1 ATOM 3369 S SG . CYS H 2 40 ? 11.556 49.080 4.721 1.00 27.90 ? 640 CYS D SG 1 ATOM 3370 N N . LYS H 2 41 ? 8.545 44.887 4.261 1.00 19.96 ? 641 LYS D N 1 ATOM 3371 C CA . LYS H 2 41 ? 7.687 44.063 3.415 1.00 16.58 ? 641 LYS D CA 1 ATOM 3372 C C . LYS H 2 41 ? 6.923 45.128 2.592 1.00 16.36 ? 641 LYS D C 1 ATOM 3373 O O . LYS H 2 41 ? 6.231 45.935 3.118 1.00 16.31 ? 641 LYS D O 1 ATOM 3374 C CB . LYS H 2 41 ? 6.717 43.237 4.281 1.00 16.77 ? 641 LYS D CB 1 ATOM 3375 C CG . LYS H 2 41 ? 5.872 42.255 3.461 1.00 16.27 ? 641 LYS D CG 1 ATOM 3376 C CD . LYS H 2 41 ? 4.943 41.464 4.351 1.00 14.73 ? 641 LYS D CD 1 ATOM 3377 C CE . LYS H 2 41 ? 4.070 40.547 3.495 1.00 14.97 ? 641 LYS D CE 1 ATOM 3378 N NZ . LYS H 2 41 ? 3.124 39.799 4.335 1.00 15.66 ? 641 LYS D NZ 1 ATOM 3379 N N . PRO H 2 42 ? 6.967 45.054 1.263 1.00 15.75 ? 642 PRO D N 1 ATOM 3380 C CA . PRO H 2 42 ? 6.313 46.065 0.434 1.00 16.40 ? 642 PRO D CA 1 ATOM 3381 C C . PRO H 2 42 ? 4.808 46.173 0.323 1.00 14.44 ? 642 PRO D C 1 ATOM 3382 O O . PRO H 2 42 ? 4.289 47.263 0.104 1.00 16.46 ? 642 PRO D O 1 ATOM 3383 C CB . PRO H 2 42 ? 6.921 45.826 -0.962 1.00 21.95 ? 642 PRO D CB 1 ATOM 3384 C CG . PRO H 2 42 ? 8.180 45.026 -0.683 1.00 28.03 ? 642 PRO D CG 1 ATOM 3385 C CD . PRO H 2 42 ? 7.797 44.150 0.461 1.00 19.49 ? 642 PRO D CD 1 ATOM 3386 N N . VAL H 2 43 ? 4.148 45.012 0.436 1.00 14.85 ? 643 VAL D N 1 ATOM 3387 C CA . VAL H 2 43 ? 2.707 44.955 0.213 1.00 15.05 ? 643 VAL D CA 1 ATOM 3388 C C . VAL H 2 43 ? 2.117 44.053 1.302 1.00 10.13 ? 643 VAL D C 1 ATOM 3389 O O . VAL H 2 43 ? 2.566 42.913 1.421 1.00 12.94 ? 643 VAL D O 1 ATOM 3390 C CB . VAL H 2 43 ? 2.438 44.289 -1.143 1.00 16.41 ? 643 VAL D CB 1 ATOM 3391 C CG1 . VAL H 2 43 ? 0.934 44.032 -1.315 1.00 19.77 ? 643 VAL D CG1 1 ATOM 3392 C CG2 . VAL H 2 43 ? 2.921 45.217 -2.336 1.00 19.18 ? 643 VAL D CG2 1 ATOM 3393 N N . ASN H 2 44 ? 1.168 44.571 2.084 1.00 15.38 ? 644 ASN D N 1 ATOM 3394 C CA . ASN H 2 44 ? 0.557 43.768 3.128 1.00 12.73 ? 644 ASN D CA 1 ATOM 3395 C C . ASN H 2 44 ? -0.832 44.256 3.429 1.00 14.69 ? 644 ASN D C 1 ATOM 3396 O O . ASN H 2 44 ? -1.046 45.448 3.551 1.00 19.13 ? 644 ASN D O 1 ATOM 3397 C CB . ASN H 2 44 ? 1.414 43.843 4.408 1.00 12.55 ? 644 ASN D CB 1 ATOM 3398 C CG . ASN H 2 44 ? 0.999 42.817 5.440 1.00 12.33 ? 644 ASN D CG 1 ATOM 3399 O OD1 . ASN H 2 44 ? 1.258 41.618 5.284 1.00 15.37 ? 644 ASN D OD1 1 ATOM 3400 N ND2 . ASN H 2 44 ? 0.371 43.281 6.512 1.00 13.52 ? 644 ASN D ND2 1 ATOM 3401 N N . THR H 2 45 ? -1.778 43.331 3.603 1.00 9.41 ? 645 THR D N 1 ATOM 3402 C CA . THR H 2 45 ? -3.141 43.741 3.949 1.00 10.96 ? 645 THR D CA 1 ATOM 3403 C C . THR H 2 45 ? -3.497 43.318 5.389 1.00 11.27 ? 645 THR D C 1 ATOM 3404 O O . THR H 2 45 ? -3.115 42.220 5.826 1.00 13.63 ? 645 THR D O 1 ATOM 3405 C CB . THR H 2 45 ? -4.147 42.996 3.005 1.00 14.15 ? 645 THR D CB 1 ATOM 3406 O OG1 . THR H 2 45 ? -3.869 43.318 1.623 1.00 16.97 ? 645 THR D OG1 1 ATOM 3407 C CG2 . THR H 2 45 ? -5.598 43.447 3.336 1.00 11.43 ? 645 THR D CG2 1 ATOM 3408 N N . PHE H 2 46 ? -4.205 44.195 6.105 1.00 11.11 ? 646 PHE D N 1 ATOM 3409 C CA . PHE H 2 46 ? -4.728 43.893 7.435 1.00 10.67 ? 646 PHE D CA 1 ATOM 3410 C C . PHE H 2 46 ? -6.231 43.828 7.296 1.00 12.28 ? 646 PHE D C 1 ATOM 3411 O O . PHE H 2 46 ? -6.858 44.616 6.569 1.00 13.90 ? 646 PHE D O 1 ATOM 3412 C CB . PHE H 2 46 ? -4.384 44.976 8.480 1.00 12.61 ? 646 PHE D CB 1 ATOM 3413 C CG . PHE H 2 46 ? -2.935 44.942 8.913 1.00 14.80 ? 646 PHE D CG 1 ATOM 3414 C CD1 . PHE H 2 46 ? -2.507 44.040 9.864 1.00 14.76 ? 646 PHE D CD1 1 ATOM 3415 C CD2 . PHE H 2 46 ? -1.994 45.789 8.313 1.00 12.44 ? 646 PHE D CD2 1 ATOM 3416 C CE1 . PHE H 2 46 ? -1.105 43.970 10.224 1.00 16.86 ? 646 PHE D CE1 1 ATOM 3417 C CE2 . PHE H 2 46 ? -0.607 45.706 8.669 1.00 13.75 ? 646 PHE D CE2 1 ATOM 3418 C CZ . PHE H 2 46 ? -0.194 44.803 9.615 1.00 17.90 ? 646 PHE D CZ 1 ATOM 3419 N N . VAL H 2 47 ? -6.831 42.978 8.128 1.00 10.59 ? 647 VAL D N 1 ATOM 3420 C CA . VAL H 2 47 ? -8.281 42.764 8.036 1.00 11.00 ? 647 VAL D CA 1 ATOM 3421 C C . VAL H 2 47 ? -8.889 43.100 9.404 1.00 13.94 ? 647 VAL D C 1 ATOM 3422 O O . VAL H 2 47 ? -8.518 42.536 10.450 1.00 13.27 ? 647 VAL D O 1 ATOM 3423 C CB . VAL H 2 47 ? -8.611 41.270 7.704 1.00 11.12 ? 647 VAL D CB 1 ATOM 3424 C CG1 . VAL H 2 47 ? -10.144 41.089 7.534 1.00 13.51 ? 647 VAL D CG1 1 ATOM 3425 C CG2 . VAL H 2 47 ? -7.884 40.764 6.387 1.00 12.59 ? 647 VAL D CG2 1 ATOM 3426 N N . HIS H 2 48 ? -9.924 43.933 9.352 1.00 12.16 ? 648 HIS D N 1 ATOM 3427 C CA . HIS H 2 48 ? -10.617 44.435 10.543 1.00 11.91 ? 648 HIS D CA 1 ATOM 3428 C C . HIS H 2 48 ? -11.977 43.748 10.668 1.00 11.84 ? 648 HIS D C 1 ATOM 3429 O O . HIS H 2 48 ? -13.041 44.365 10.518 1.00 14.42 ? 648 HIS D O 1 ATOM 3430 C CB . HIS H 2 48 ? -10.820 45.968 10.384 1.00 14.28 ? 648 HIS D CB 1 ATOM 3431 C CG . HIS H 2 48 ? -9.543 46.703 10.134 1.00 15.29 ? 648 HIS D CG 1 ATOM 3432 N ND1 . HIS H 2 48 ? -8.526 46.751 11.060 1.00 19.66 ? 648 HIS D ND1 1 ATOM 3433 C CD2 . HIS H 2 48 ? -9.094 47.373 9.042 1.00 13.83 ? 648 HIS D CD2 1 ATOM 3434 C CE1 . HIS H 2 48 ? -7.498 47.411 10.550 1.00 23.11 ? 648 HIS D CE1 1 ATOM 3435 N NE2 . HIS H 2 48 ? -7.820 47.799 9.324 1.00 22.14 ? 648 HIS D NE2 1 ATOM 3436 N N . GLU H 2 49 ? -11.932 42.441 10.954 1.00 11.23 ? 649 GLU D N 1 ATOM 3437 C CA . GLU H 2 49 ? -13.122 41.645 11.161 1.00 12.61 ? 649 GLU D CA 1 ATOM 3438 C C . GLU H 2 49 ? -12.730 40.618 12.212 1.00 11.49 ? 649 GLU D C 1 ATOM 3439 O O . GLU H 2 49 ? -11.552 40.455 12.521 1.00 12.00 ? 649 GLU D O 1 ATOM 3440 C CB . GLU H 2 49 ? -13.529 40.870 9.936 1.00 13.17 ? 649 GLU D CB 1 ATOM 3441 C CG . GLU H 2 49 ? -13.870 41.785 8.694 1.00 15.55 ? 649 GLU D CG 1 ATOM 3442 C CD . GLU H 2 49 ? -15.119 42.655 8.885 1.00 15.50 ? 649 GLU D CD 1 ATOM 3443 O OE1 . GLU H 2 49 ? -15.950 42.434 9.812 1.00 15.73 ? 649 GLU D OE1 1 ATOM 3444 O OE2 . GLU H 2 49 ? -15.281 43.603 8.054 1.00 15.95 ? 649 GLU D OE2 1 ATOM 3445 N N . SER H 2 50 ? -13.729 39.930 12.757 1.00 12.00 ? 650 SER D N 1 ATOM 3446 C CA . SER H 2 50 ? -13.421 38.957 13.814 1.00 14.30 ? 650 SER D CA 1 ATOM 3447 C C . SER H 2 50 ? -12.601 37.794 13.264 1.00 14.63 ? 650 SER D C 1 ATOM 3448 O O . SER H 2 50 ? -12.632 37.464 12.072 1.00 11.55 ? 650 SER D O 1 ATOM 3449 C CB . SER H 2 50 ? -14.710 38.430 14.447 1.00 14.14 ? 650 SER D CB 1 ATOM 3450 O OG . SER H 2 50 ? -15.402 37.560 13.521 1.00 14.47 ? 650 SER D OG 1 ATOM 3451 N N . LEU H 2 51 ? -11.824 37.186 14.152 1.00 13.08 ? 651 LEU D N 1 ATOM 3452 C CA . LEU H 2 51 ? -11.019 36.035 13.713 1.00 14.15 ? 651 LEU D CA 1 ATOM 3453 C C . LEU H 2 51 ? -11.962 34.933 13.201 1.00 14.37 ? 651 LEU D C 1 ATOM 3454 O O . LEU H 2 51 ? -11.661 34.216 12.222 1.00 14.35 ? 651 LEU D O 1 ATOM 3455 C CB . LEU H 2 51 ? -10.153 35.496 14.891 1.00 12.96 ? 651 LEU D CB 1 ATOM 3456 C CG . LEU H 2 51 ? -9.267 34.302 14.498 1.00 14.35 ? 651 LEU D CG 1 ATOM 3457 C CD1 . LEU H 2 51 ? -8.358 34.649 13.298 1.00 16.71 ? 651 LEU D CD1 1 ATOM 3458 C CD2 . LEU H 2 51 ? -8.363 33.935 15.726 1.00 14.50 ? 651 LEU D CD2 1 ATOM 3459 N N . ALA H 2 52 ? -13.104 34.785 13.844 1.00 12.94 ? 652 ALA D N 1 ATOM 3460 C CA . ALA H 2 52 ? -14.099 33.790 13.418 1.00 13.61 ? 652 ALA D CA 1 ATOM 3461 C C . ALA H 2 52 ? -14.565 34.077 11.982 1.00 13.86 ? 652 ALA D C 1 ATOM 3462 O O . ALA H 2 52 ? -14.693 33.123 11.186 1.00 14.68 ? 652 ALA D O 1 ATOM 3463 C CB . ALA H 2 52 ? -15.336 33.842 14.350 1.00 15.79 ? 652 ALA D CB 1 ATOM 3464 N N . ASP H 2 53 ? -14.835 35.353 11.671 1.00 14.09 ? 653 ASP D N 1 ATOM 3465 C CA . ASP H 2 53 ? -15.282 35.691 10.296 1.00 16.27 ? 653 ASP D CA 1 ATOM 3466 C C . ASP H 2 53 ? -14.198 35.458 9.276 1.00 12.48 ? 653 ASP D C 1 ATOM 3467 O O . ASP H 2 53 ? -14.487 35.040 8.119 1.00 12.49 ? 653 ASP D O 1 ATOM 3468 C CB . ASP H 2 53 ? -15.757 37.153 10.244 1.00 15.73 ? 653 ASP D CB 1 ATOM 3469 C CG . ASP H 2 53 ? -17.175 37.327 10.802 1.00 17.74 ? 653 ASP D CG 1 ATOM 3470 O OD1 . ASP H 2 53 ? -17.785 36.347 11.251 1.00 18.64 ? 653 ASP D OD1 1 ATOM 3471 O OD2 . ASP H 2 53 ? -17.693 38.469 10.775 1.00 20.36 ? 653 ASP D OD2 1 ATOM 3472 N N . VAL H 2 54 ? -12.962 35.742 9.636 1.00 11.57 ? 654 VAL D N 1 ATOM 3473 C CA . VAL H 2 54 ? -11.856 35.515 8.658 1.00 10.07 ? 654 VAL D CA 1 ATOM 3474 C C . VAL H 2 54 ? -11.626 34.032 8.511 1.00 10.66 ? 654 VAL D C 1 ATOM 3475 O O . VAL H 2 54 ? -11.444 33.542 7.380 1.00 12.09 ? 654 VAL D O 1 ATOM 3476 C CB . VAL H 2 54 ? -10.601 36.266 9.101 1.00 10.23 ? 654 VAL D CB 1 ATOM 3477 C CG1 . VAL H 2 54 ? -9.420 35.996 8.129 1.00 11.66 ? 654 VAL D CG1 1 ATOM 3478 C CG2 . VAL H 2 54 ? -10.927 37.752 9.150 1.00 12.49 ? 654 VAL D CG2 1 ATOM 3479 N N . GLN H 2 55 ? -11.604 33.279 9.620 1.00 11.44 ? 655 GLN D N 1 ATOM 3480 C CA . GLN H 2 55 ? -11.406 31.841 9.437 1.00 12.66 ? 655 GLN D CA 1 ATOM 3481 C C . GLN H 2 55 ? -12.556 31.201 8.609 1.00 13.93 ? 655 GLN D C 1 ATOM 3482 O O . GLN H 2 55 ? -12.323 30.221 7.889 1.00 14.44 ? 655 GLN D O 1 ATOM 3483 C CB . GLN H 2 55 ? -11.304 31.125 10.806 1.00 15.08 ? 655 GLN D CB 1 ATOM 3484 C CG . GLN H 2 55 ? -9.992 31.367 11.485 1.00 14.80 ? 655 GLN D CG 1 ATOM 3485 C CD . GLN H 2 55 ? -9.919 30.601 12.802 1.00 12.38 ? 655 GLN D CD 1 ATOM 3486 O OE1 . GLN H 2 55 ? -10.900 29.952 13.212 1.00 17.26 ? 655 GLN D OE1 1 ATOM 3487 N NE2 . GLN H 2 55 ? -8.811 30.700 13.469 1.00 14.19 ? 655 GLN D NE2 1 ATOM 3488 N N . ALA H 2 56 ? -13.777 31.744 8.707 1.00 12.40 ? 656 ALA D N 1 ATOM 3489 C CA . ALA H 2 56 ? -14.901 31.174 7.987 1.00 13.28 ? 656 ALA D CA 1 ATOM 3490 C C . ALA H 2 56 ? -14.704 31.270 6.466 1.00 14.42 ? 656 ALA D C 1 ATOM 3491 O O . ALA H 2 56 ? -15.373 30.547 5.723 1.00 13.87 ? 656 ALA D O 1 ATOM 3492 C CB . ALA H 2 56 ? -16.230 31.893 8.379 1.00 13.98 ? 656 ALA D CB 1 ATOM 3493 N N . VAL H 2 57 ? -13.796 32.150 6.022 1.00 13.39 ? 657 VAL D N 1 ATOM 3494 C CA . VAL H 2 57 ? -13.605 32.290 4.565 1.00 12.66 ? 657 VAL D CA 1 ATOM 3495 C C . VAL H 2 57 ? -13.099 30.981 3.952 1.00 13.56 ? 657 VAL D C 1 ATOM 3496 O O . VAL H 2 57 ? -13.398 30.648 2.772 1.00 13.74 ? 657 VAL D O 1 ATOM 3497 C CB . VAL H 2 57 ? -12.669 33.463 4.295 1.00 12.56 ? 657 VAL D CB 1 ATOM 3498 C CG1 . VAL H 2 57 ? -12.322 33.577 2.763 1.00 11.66 ? 657 VAL D CG1 1 ATOM 3499 C CG2 . VAL H 2 57 ? -13.329 34.744 4.798 1.00 13.78 ? 657 VAL D CG2 1 ATOM 3500 N N . CYS H 2 58 ? -12.385 30.197 4.753 1.00 13.76 ? 658 CYS D N 1 ATOM 3501 C CA . CYS H 2 58 ? -11.893 28.910 4.286 1.00 16.32 ? 658 CYS D CA 1 ATOM 3502 C C . CYS H 2 58 ? -12.989 27.937 3.888 1.00 15.38 ? 658 CYS D C 1 ATOM 3503 O O . CYS H 2 58 ? -12.694 26.883 3.301 1.00 17.56 ? 658 CYS D O 1 ATOM 3504 C CB . CYS H 2 58 ? -10.953 28.305 5.356 1.00 16.15 ? 658 CYS D CB 1 ATOM 3505 S SG . CYS H 2 58 ? -9.445 29.279 5.631 1.00 20.63 ? 658 CYS D SG 1 ATOM 3506 N N . SER H 2 59 ? -14.255 28.243 4.187 1.00 14.76 ? 659 SER D N 1 ATOM 3507 C CA . SER H 2 59 ? -15.347 27.350 3.711 1.00 18.50 ? 659 SER D CA 1 ATOM 3508 C C . SER H 2 59 ? -16.292 28.137 2.793 1.00 16.71 ? 659 SER D C 1 ATOM 3509 O O . SER H 2 59 ? -17.495 27.802 2.612 1.00 20.25 ? 659 SER D O 1 ATOM 3510 C CB A SER H 2 59 ? -16.121 26.723 4.890 0.58 21.14 ? 659 SER D CB 1 ATOM 3511 C CB B SER H 2 59 ? -16.176 27.099 5.117 0.42 19.79 ? 659 SER D CB 1 ATOM 3512 O OG A SER H 2 59 ? -16.662 27.722 5.713 0.58 17.12 ? 659 SER D OG 1 ATOM 3513 O OG B SER H 2 59 ? -15.358 26.378 6.001 0.42 20.75 ? 659 SER D OG 1 ATOM 3514 N N . GLN H 2 60 ? -15.783 29.216 2.199 1.00 14.65 ? 660 GLN D N 1 ATOM 3515 C CA . GLN H 2 60 ? -16.598 29.994 1.315 1.00 14.36 ? 660 GLN D CA 1 ATOM 3516 C C . GLN H 2 60 ? -16.264 29.742 -0.160 1.00 15.03 ? 660 GLN D C 1 ATOM 3517 O O . GLN H 2 60 ? -16.186 28.560 -0.541 1.00 19.10 ? 660 GLN D O 1 ATOM 3518 C CB . GLN H 2 60 ? -16.573 31.484 1.730 1.00 15.10 ? 660 GLN D CB 1 ATOM 3519 C CG . GLN H 2 60 ? -17.125 31.603 3.169 1.00 14.70 ? 660 GLN D CG 1 ATOM 3520 C CD . GLN H 2 60 ? -17.144 33.008 3.779 1.00 13.82 ? 660 GLN D CD 1 ATOM 3521 O OE1 . GLN H 2 60 ? -16.889 34.034 3.110 1.00 14.44 ? 660 GLN D OE1 1 ATOM 3522 N NE2 . GLN H 2 60 ? -17.483 33.059 5.082 1.00 16.10 ? 660 GLN D NE2 1 ATOM 3523 N N . LYS H 2 61 ? -16.053 30.768 -0.975 1.00 15.73 ? 661 LYS D N 1 ATOM 3524 C CA . LYS H 2 61 ? -15.841 30.514 -2.405 1.00 16.28 ? 661 LYS D CA 1 ATOM 3525 C C . LYS H 2 61 ? -14.449 30.080 -2.809 1.00 18.16 ? 661 LYS D C 1 ATOM 3526 O O . LYS H 2 61 ? -13.507 30.868 -2.791 1.00 18.79 ? 661 LYS D O 1 ATOM 3527 C CB . LYS H 2 61 ? -16.234 31.756 -3.197 1.00 15.69 ? 661 LYS D CB 1 ATOM 3528 C CG . LYS H 2 61 ? -16.135 31.556 -4.738 1.00 18.96 ? 661 LYS D CG 1 ATOM 3529 C CD . LYS H 2 61 ? -16.471 32.856 -5.465 1.00 23.11 ? 661 LYS D CD 1 ATOM 3530 C CE . LYS H 2 61 ? -16.509 32.622 -7.017 1.00 26.63 ? 661 LYS D CE 1 ATOM 3531 N NZ . LYS H 2 61 ? -16.777 33.885 -7.753 1.00 29.21 ? 661 LYS D NZ 1 ATOM 3532 N N . ASN H 2 62 ? -14.317 28.817 -3.191 1.00 18.04 ? 662 ASN D N 1 ATOM 3533 C CA . ASN H 2 62 ? -13.016 28.299 -3.618 1.00 19.44 ? 662 ASN D CA 1 ATOM 3534 C C . ASN H 2 62 ? -12.621 28.943 -4.966 1.00 20.29 ? 662 ASN D C 1 ATOM 3535 O O . ASN H 2 62 ? -13.404 28.943 -5.911 1.00 21.50 ? 662 ASN D O 1 ATOM 3536 C CB . ASN H 2 62 ? -13.123 26.782 -3.758 1.00 20.68 ? 662 ASN D CB 1 ATOM 3537 C CG . ASN H 2 62 ? -11.804 26.110 -4.067 1.00 23.25 ? 662 ASN D CG 1 ATOM 3538 O OD1 . ASN H 2 62 ? -11.792 25.033 -4.665 1.00 25.10 ? 662 ASN D OD1 1 ATOM 3539 N ND2 . ASN H 2 62 ? -10.693 26.714 -3.675 1.00 21.24 ? 662 ASN D ND2 1 ATOM 3540 N N . VAL H 2 63 ? -11.409 29.482 -5.027 1.00 18.19 ? 663 VAL D N 1 ATOM 3541 C CA . VAL H 2 63 ? -10.900 30.141 -6.233 1.00 18.27 ? 663 VAL D CA 1 ATOM 3542 C C . VAL H 2 63 ? -9.439 29.798 -6.398 1.00 20.55 ? 663 VAL D C 1 ATOM 3543 O O . VAL H 2 63 ? -8.824 29.283 -5.479 1.00 18.24 ? 663 VAL D O 1 ATOM 3544 C CB . VAL H 2 63 ? -11.008 31.674 -6.162 1.00 13.60 ? 663 VAL D CB 1 ATOM 3545 C CG1 . VAL H 2 63 ? -12.497 32.136 -6.118 1.00 15.60 ? 663 VAL D CG1 1 ATOM 3546 C CG2 . VAL H 2 63 ? -10.133 32.227 -4.958 1.00 16.09 ? 663 VAL D CG2 1 ATOM 3547 N N . ALA H 2 64 ? -8.851 30.103 -7.569 1.00 18.78 ? 664 ALA D N 1 ATOM 3548 C CA . ALA H 2 64 ? -7.426 29.788 -7.751 1.00 21.19 ? 664 ALA D CA 1 ATOM 3549 C C . ALA H 2 64 ? -6.598 30.869 -7.026 1.00 17.99 ? 664 ALA D C 1 ATOM 3550 O O . ALA H 2 64 ? -6.990 32.050 -6.998 1.00 19.47 ? 664 ALA D O 1 ATOM 3551 C CB . ALA H 2 64 ? -7.040 29.801 -9.295 1.00 22.14 ? 664 ALA D CB 1 ATOM 3552 N N . CYS H 2 65 ? -5.479 30.474 -6.441 1.00 18.49 ? 665 CYS D N 1 ATOM 3553 C CA . CYS H 2 65 ? -4.597 31.471 -5.837 1.00 21.28 ? 665 CYS D CA 1 ATOM 3554 C C . CYS H 2 65 ? -3.891 32.176 -6.996 1.00 20.68 ? 665 CYS D C 1 ATOM 3555 O O . CYS H 2 65 ? -3.824 31.623 -8.107 1.00 21.63 ? 665 CYS D O 1 ATOM 3556 C CB . CYS H 2 65 ? -3.532 30.823 -5.008 1.00 18.17 ? 665 CYS D CB 1 ATOM 3557 S SG . CYS H 2 65 ? -4.268 29.808 -3.681 1.00 22.63 ? 665 CYS D SG 1 ATOM 3558 N N . LYS H 2 66 ? -3.323 33.341 -6.734 1.00 17.14 ? 666 LYS D N 1 ATOM 3559 C CA . LYS H 2 66 ? -2.661 34.053 -7.822 1.00 18.98 ? 666 LYS D CA 1 ATOM 3560 C C . LYS H 2 66 ? -1.416 33.308 -8.319 1.00 21.63 ? 666 LYS D C 1 ATOM 3561 O O . LYS H 2 66 ? -0.957 33.575 -9.441 1.00 21.94 ? 666 LYS D O 1 ATOM 3562 C CB . LYS H 2 66 ? -2.372 35.511 -7.416 1.00 20.32 ? 666 LYS D CB 1 ATOM 3563 C CG . LYS H 2 66 ? -1.315 35.714 -6.375 1.00 18.35 ? 666 LYS D CG 1 ATOM 3564 C CD . LYS H 2 66 ? -1.212 37.207 -6.005 1.00 21.96 ? 666 LYS D CD 1 ATOM 3565 C CE . LYS H 2 66 ? -0.045 37.466 -5.028 1.00 25.40 ? 666 LYS D CE 1 ATOM 3566 N NZ . LYS H 2 66 ? -0.408 36.958 -3.634 1.00 22.05 ? 666 LYS D NZ 1 ATOM 3567 N N . ASN H 2 67 ? -0.892 32.352 -7.546 1.00 17.81 ? 667 ASN D N 1 ATOM 3568 C CA . ASN H 2 67 ? 0.282 31.590 -7.976 1.00 23.82 ? 667 ASN D CA 1 ATOM 3569 C C . ASN H 2 67 ? -0.162 30.301 -8.668 1.00 24.25 ? 667 ASN D C 1 ATOM 3570 O O . ASN H 2 67 ? 0.668 29.447 -9.015 1.00 26.85 ? 667 ASN D O 1 ATOM 3571 C CB . ASN H 2 67 ? 1.221 31.262 -6.811 1.00 21.26 ? 667 ASN D CB 1 ATOM 3572 C CG . ASN H 2 67 ? 0.620 30.246 -5.815 1.00 21.02 ? 667 ASN D CG 1 ATOM 3573 O OD1 . ASN H 2 67 ? -0.470 29.737 -6.016 1.00 25.65 ? 667 ASN D OD1 1 ATOM 3574 N ND2 . ASN H 2 67 ? 1.360 29.952 -4.742 1.00 25.26 ? 667 ASN D ND2 1 ATOM 3575 N N . GLY H 2 68 ? -1.475 30.168 -8.844 1.00 23.83 ? 668 GLY D N 1 ATOM 3576 C CA . GLY H 2 68 ? -2.050 29.014 -9.512 1.00 24.20 ? 668 GLY D CA 1 ATOM 3577 C C . GLY H 2 68 ? -2.416 27.822 -8.646 1.00 27.92 ? 668 GLY D C 1 ATOM 3578 O O . GLY H 2 68 ? -2.987 26.854 -9.139 1.00 30.84 ? 668 GLY D O 1 ATOM 3579 N N . GLN H 2 69 ? -2.050 27.847 -7.374 1.00 25.40 ? 669 GLN D N 1 ATOM 3580 C CA . GLN H 2 69 ? -2.431 26.749 -6.495 1.00 21.56 ? 669 GLN D CA 1 ATOM 3581 C C . GLN H 2 69 ? -3.936 26.818 -6.363 1.00 22.28 ? 669 GLN D C 1 ATOM 3582 O O . GLN H 2 69 ? -4.541 27.815 -6.774 1.00 23.97 ? 669 GLN D O 1 ATOM 3583 C CB . GLN H 2 69 ? -1.685 26.864 -5.170 1.00 22.10 ? 669 GLN D CB 1 ATOM 3584 C CG . GLN H 2 69 ? -0.217 26.581 -5.436 1.00 29.95 ? 669 GLN D CG 1 ATOM 3585 C CD . GLN H 2 69 ? 0.586 26.341 -4.202 1.00 32.10 ? 669 GLN D CD 1 ATOM 3586 O OE1 . GLN H 2 69 ? 0.627 27.174 -3.297 1.00 34.20 ? 669 GLN D OE1 1 ATOM 3587 N NE2 . GLN H 2 69 ? 1.246 25.192 -4.153 1.00 41.38 ? 669 GLN D NE2 1 ATOM 3588 N N . THR H 2 70 ? -4.550 25.768 -5.802 1.00 21.68 ? 670 THR D N 1 ATOM 3589 C CA . THR H 2 70 ? -6.001 25.675 -5.755 1.00 21.39 ? 670 THR D CA 1 ATOM 3590 C C . THR H 2 70 ? -6.673 25.912 -4.390 1.00 19.76 ? 670 THR D C 1 ATOM 3591 O O . THR H 2 70 ? -7.907 25.861 -4.287 1.00 21.42 ? 670 THR D O 1 ATOM 3592 C CB . THR H 2 70 ? -6.431 24.262 -6.208 1.00 24.69 ? 670 THR D CB 1 ATOM 3593 O OG1 . THR H 2 70 ? -5.940 23.309 -5.264 1.00 30.95 ? 670 THR D OG1 1 ATOM 3594 C CG2 . THR H 2 70 ? -5.790 23.903 -7.535 1.00 31.08 ? 670 THR D CG2 1 ATOM 3595 N N . ASN H 2 71 ? -5.867 26.163 -3.366 1.00 17.38 ? 671 ASN D N 1 ATOM 3596 C CA . ASN H 2 71 ? -6.426 26.264 -2.004 1.00 19.60 ? 671 ASN D CA 1 ATOM 3597 C C . ASN H 2 71 ? -6.747 27.652 -1.503 1.00 17.18 ? 671 ASN D C 1 ATOM 3598 O O . ASN H 2 71 ? -6.612 27.937 -0.317 1.00 16.23 ? 671 ASN D O 1 ATOM 3599 C CB . ASN H 2 71 ? -5.502 25.566 -0.982 1.00 17.70 ? 671 ASN D CB 1 ATOM 3600 C CG . ASN H 2 71 ? -4.129 26.226 -0.887 1.00 21.04 ? 671 ASN D CG 1 ATOM 3601 O OD1 . ASN H 2 71 ? -3.531 26.599 -1.902 1.00 21.01 ? 671 ASN D OD1 1 ATOM 3602 N ND2 . ASN H 2 71 ? -3.628 26.362 0.330 1.00 19.44 ? 671 ASN D ND2 1 ATOM 3603 N N . CYS H 2 72 ? -7.203 28.507 -2.392 1.00 17.39 ? 672 CYS D N 1 ATOM 3604 C CA . CYS H 2 72 ? -7.575 29.859 -2.004 1.00 14.36 ? 672 CYS D CA 1 ATOM 3605 C C . CYS H 2 72 ? -9.069 29.954 -1.894 1.00 16.03 ? 672 CYS D C 1 ATOM 3606 O O . CYS H 2 72 ? -9.806 29.186 -2.533 1.00 14.79 ? 672 CYS D O 1 ATOM 3607 C CB . CYS H 2 72 ? -7.046 30.945 -2.999 1.00 16.70 ? 672 CYS D CB 1 ATOM 3608 S SG . CYS H 2 72 ? -5.267 31.263 -2.567 1.00 20.88 ? 672 CYS D SG 1 ATOM 3609 N N . TYR H 2 73 ? -9.532 30.909 -1.079 1.00 13.02 ? 673 TYR D N 1 ATOM 3610 C CA . TYR H 2 73 ? -10.983 31.092 -0.872 1.00 12.07 ? 673 TYR D CA 1 ATOM 3611 C C . TYR H 2 73 ? -11.275 32.563 -0.790 1.00 13.23 ? 673 TYR D C 1 ATOM 3612 O O . TYR H 2 73 ? -10.521 33.326 -0.168 1.00 12.75 ? 673 TYR D O 1 ATOM 3613 C CB . TYR H 2 73 ? -11.416 30.442 0.471 1.00 13.23 ? 673 TYR D CB 1 ATOM 3614 C CG . TYR H 2 73 ? -11.323 28.942 0.393 1.00 18.77 ? 673 TYR D CG 1 ATOM 3615 C CD1 . TYR H 2 73 ? -10.061 28.333 0.527 1.00 21.03 ? 673 TYR D CD1 1 ATOM 3616 C CD2 . TYR H 2 73 ? -12.428 28.149 0.044 1.00 22.21 ? 673 TYR D CD2 1 ATOM 3617 C CE1 . TYR H 2 73 ? -9.896 26.972 0.321 1.00 25.36 ? 673 TYR D CE1 1 ATOM 3618 C CE2 . TYR H 2 73 ? -12.250 26.729 -0.174 1.00 20.30 ? 673 TYR D CE2 1 ATOM 3619 C CZ . TYR H 2 73 ? -10.965 26.201 -0.017 1.00 22.34 ? 673 TYR D CZ 1 ATOM 3620 O OH . TYR H 2 73 ? -10.694 24.851 -0.173 1.00 27.08 ? 673 TYR D OH 1 ATOM 3621 N N . GLN H 2 74 ? -12.386 32.952 -1.407 1.00 13.43 ? 674 GLN D N 1 ATOM 3622 C CA . GLN H 2 74 ? -12.795 34.324 -1.451 1.00 12.46 ? 674 GLN D CA 1 ATOM 3623 C C . GLN H 2 74 ? -14.024 34.500 -0.584 1.00 13.76 ? 674 GLN D C 1 ATOM 3624 O O . GLN H 2 74 ? -14.966 33.700 -0.605 1.00 14.55 ? 674 GLN D O 1 ATOM 3625 C CB . GLN H 2 74 ? -13.053 34.666 -2.939 1.00 15.60 ? 674 GLN D CB 1 ATOM 3626 C CG . GLN H 2 74 ? -13.559 36.037 -3.152 1.00 12.70 ? 674 GLN D CG 1 ATOM 3627 C CD . GLN H 2 74 ? -13.819 36.300 -4.637 1.00 19.28 ? 674 GLN D CD 1 ATOM 3628 O OE1 . GLN H 2 74 ? -14.906 36.751 -5.014 1.00 24.42 ? 674 GLN D OE1 1 ATOM 3629 N NE2 . GLN H 2 74 ? -12.862 35.998 -5.464 1.00 17.98 ? 674 GLN D NE2 1 ATOM 3630 N N . SER H 2 75 ? -14.007 35.551 0.220 1.00 12.79 ? 675 SER D N 1 ATOM 3631 C CA . SER H 2 75 ? -15.143 35.796 1.121 1.00 12.41 ? 675 SER D CA 1 ATOM 3632 C C . SER H 2 75 ? -16.409 36.161 0.329 1.00 15.51 ? 675 SER D C 1 ATOM 3633 O O . SER H 2 75 ? -16.354 36.899 -0.687 1.00 14.58 ? 675 SER D O 1 ATOM 3634 C CB . SER H 2 75 ? -14.824 36.923 2.101 1.00 12.84 ? 675 SER D CB 1 ATOM 3635 O OG . SER H 2 75 ? -14.574 38.190 1.472 1.00 11.15 ? 675 SER D OG 1 ATOM 3636 N N . TYR H 2 76 ? -17.535 35.616 0.788 1.00 13.29 ? 676 TYR D N 1 ATOM 3637 C CA . TYR H 2 76 ? -18.824 35.926 0.140 1.00 15.32 ? 676 TYR D CA 1 ATOM 3638 C C . TYR H 2 76 ? -19.181 37.396 0.302 1.00 16.05 ? 676 TYR D C 1 ATOM 3639 O O . TYR H 2 76 ? -19.779 37.997 -0.608 1.00 15.75 ? 676 TYR D O 1 ATOM 3640 C CB . TYR H 2 76 ? -19.927 35.083 0.780 1.00 14.59 ? 676 TYR D CB 1 ATOM 3641 C CG . TYR H 2 76 ? -19.805 33.625 0.499 1.00 15.73 ? 676 TYR D CG 1 ATOM 3642 C CD1 . TYR H 2 76 ? -19.519 33.184 -0.794 1.00 18.66 ? 676 TYR D CD1 1 ATOM 3643 C CD2 . TYR H 2 76 ? -20.073 32.692 1.480 1.00 19.21 ? 676 TYR D CD2 1 ATOM 3644 C CE1 . TYR H 2 76 ? -19.510 31.841 -1.098 1.00 19.99 ? 676 TYR D CE1 1 ATOM 3645 C CE2 . TYR H 2 76 ? -20.054 31.322 1.191 1.00 16.65 ? 676 TYR D CE2 1 ATOM 3646 C CZ . TYR H 2 76 ? -19.770 30.914 -0.101 1.00 22.54 ? 676 TYR D CZ 1 ATOM 3647 O OH . TYR H 2 76 ? -19.745 29.562 -0.409 1.00 27.24 ? 676 TYR D OH 1 ATOM 3648 N N . SER H 2 77 ? -18.817 37.975 1.472 1.00 15.87 ? 677 SER D N 1 ATOM 3649 C CA . SER H 2 77 ? -19.126 39.359 1.783 1.00 14.04 ? 677 SER D CA 1 ATOM 3650 C C . SER H 2 77 ? -17.878 40.210 1.799 1.00 12.23 ? 677 SER D C 1 ATOM 3651 O O . SER H 2 77 ? -16.762 39.687 1.946 1.00 15.36 ? 677 SER D O 1 ATOM 3652 C CB . SER H 2 77 ? -19.742 39.465 3.169 1.00 17.40 ? 677 SER D CB 1 ATOM 3653 O OG . SER H 2 77 ? -21.021 38.866 3.227 1.00 16.70 ? 677 SER D OG 1 ATOM 3654 N N . THR H 2 78 ? -18.048 41.519 1.629 1.00 15.40 ? 678 THR D N 1 ATOM 3655 C CA . THR H 2 78 ? -16.870 42.372 1.711 1.00 14.33 ? 678 THR D CA 1 ATOM 3656 C C . THR H 2 78 ? -16.511 42.504 3.156 1.00 14.64 ? 678 THR D C 1 ATOM 3657 O O . THR H 2 78 ? -17.329 42.320 4.038 1.00 15.88 ? 678 THR D O 1 ATOM 3658 C CB . THR H 2 78 ? -17.086 43.800 1.177 1.00 16.74 ? 678 THR D CB 1 ATOM 3659 O OG1 . THR H 2 78 ? -18.111 44.474 1.918 1.00 18.77 ? 678 THR D OG1 1 ATOM 3660 C CG2 . THR H 2 78 ? -17.407 43.721 -0.275 1.00 17.52 ? 678 THR D CG2 1 ATOM 3661 N N . MET H 2 79 ? -15.243 42.838 3.373 1.00 13.55 ? 679 MET D N 1 ATOM 3662 C CA . MET H 2 79 ? -14.708 43.031 4.722 1.00 12.49 ? 679 MET D CA 1 ATOM 3663 C C . MET H 2 79 ? -13.921 44.318 4.758 1.00 12.46 ? 679 MET D C 1 ATOM 3664 O O . MET H 2 79 ? -13.371 44.756 3.730 1.00 13.19 ? 679 MET D O 1 ATOM 3665 C CB . MET H 2 79 ? -13.763 41.873 5.035 1.00 14.77 ? 679 MET D CB 1 ATOM 3666 C CG . MET H 2 79 ? -14.465 40.570 5.202 1.00 12.74 ? 679 MET D CG 1 ATOM 3667 S SD . MET H 2 79 ? -13.292 39.318 5.771 1.00 15.05 ? 679 MET D SD 1 ATOM 3668 C CE . MET H 2 79 ? -14.454 37.978 6.126 1.00 15.95 ? 679 MET D CE 1 ATOM 3669 N N . SER H 2 80 ? -13.858 44.898 5.961 1.00 13.23 ? 680 SER D N 1 ATOM 3670 C CA . SER H 2 80 ? -13.094 46.139 6.162 1.00 12.61 ? 680 SER D CA 1 ATOM 3671 C C . SER H 2 80 ? -11.624 45.733 6.202 1.00 13.73 ? 680 SER D C 1 ATOM 3672 O O . SER H 2 80 ? -11.245 44.862 6.995 1.00 15.78 ? 680 SER D O 1 ATOM 3673 C CB . SER H 2 80 ? -13.464 46.774 7.515 1.00 14.56 ? 680 SER D CB 1 ATOM 3674 O OG . SER H 2 80 ? -12.552 47.826 7.735 1.00 16.25 ? 680 SER D OG 1 ATOM 3675 N N . ILE H 2 81 ? -10.817 46.328 5.323 1.00 12.14 ? 681 ILE D N 1 ATOM 3676 C CA . ILE H 2 81 ? -9.395 45.986 5.271 1.00 12.80 ? 681 ILE D CA 1 ATOM 3677 C C . ILE H 2 81 ? -8.550 47.242 5.116 1.00 13.38 ? 681 ILE D C 1 ATOM 3678 O O . ILE H 2 81 ? -9.055 48.304 4.832 1.00 15.14 ? 681 ILE D O 1 ATOM 3679 C CB . ILE H 2 81 ? -9.032 45.083 4.053 1.00 13.06 ? 681 ILE D CB 1 ATOM 3680 C CG1 . ILE H 2 81 ? -9.337 45.811 2.732 1.00 13.16 ? 681 ILE D CG1 1 ATOM 3681 C CG2 . ILE H 2 81 ? -9.832 43.773 4.093 1.00 14.17 ? 681 ILE D CG2 1 ATOM 3682 C CD1 . ILE H 2 81 ? -8.888 45.020 1.510 1.00 16.17 ? 681 ILE D CD1 1 ATOM 3683 N N . THR H 2 82 ? -7.251 47.098 5.383 1.00 13.37 ? 682 THR D N 1 ATOM 3684 C CA . THR H 2 82 ? -6.343 48.238 5.141 1.00 13.79 ? 682 THR D CA 1 ATOM 3685 C C . THR H 2 82 ? -5.224 47.717 4.266 1.00 14.75 ? 682 THR D C 1 ATOM 3686 O O . THR H 2 82 ? -4.610 46.696 4.551 1.00 14.31 ? 682 THR D O 1 ATOM 3687 C CB . THR H 2 82 ? -5.738 48.783 6.459 1.00 15.90 ? 682 THR D CB 1 ATOM 3688 O OG1 . THR H 2 82 ? -6.786 49.269 7.320 1.00 15.67 ? 682 THR D OG1 1 ATOM 3689 C CG2 . THR H 2 82 ? -4.761 49.922 6.135 1.00 16.09 ? 682 THR D CG2 1 ATOM 3690 N N . ASP H 2 83 ? -4.988 48.389 3.145 1.00 11.76 ? 683 ASP D N 1 ATOM 3691 C CA . ASP H 2 83 ? -3.884 48.045 2.258 1.00 15.82 ? 683 ASP D CA 1 ATOM 3692 C C . ASP H 2 83 ? -2.655 48.831 2.637 1.00 14.69 ? 683 ASP D C 1 ATOM 3693 O O . ASP H 2 83 ? -2.726 50.062 2.700 1.00 17.07 ? 683 ASP D O 1 ATOM 3694 C CB . ASP H 2 83 ? -4.221 48.396 0.805 1.00 18.18 ? 683 ASP D CB 1 ATOM 3695 C CG . ASP H 2 83 ? -5.277 47.452 0.207 1.00 24.79 ? 683 ASP D CG 1 ATOM 3696 O OD1 . ASP H 2 83 ? -5.315 46.285 0.639 1.00 24.68 ? 683 ASP D OD1 1 ATOM 3697 O OD2 . ASP H 2 83 ? -6.059 47.862 -0.680 1.00 27.00 ? 683 ASP D OD2 1 ATOM 3698 N N . CYS H 2 84 ? -1.538 48.163 2.900 1.00 12.96 ? 684 CYS D N 1 ATOM 3699 C CA . CYS H 2 84 ? -0.286 48.863 3.257 1.00 13.05 ? 684 CYS D CA 1 ATOM 3700 C C . CYS H 2 84 ? 0.719 48.702 2.113 1.00 14.72 ? 684 CYS D C 1 ATOM 3701 O O . CYS H 2 84 ? 0.974 47.574 1.635 1.00 16.06 ? 684 CYS D O 1 ATOM 3702 C CB . CYS H 2 84 ? 0.292 48.252 4.532 1.00 17.20 ? 684 CYS D CB 1 ATOM 3703 S SG . CYS H 2 84 ? -0.714 48.518 6.055 1.00 19.89 ? 684 CYS D SG 1 ATOM 3704 N N . ARG H 2 85 ? 1.288 49.815 1.647 1.00 15.35 ? 685 ARG D N 1 ATOM 3705 C CA . ARG H 2 85 ? 2.198 49.730 0.515 1.00 14.88 ? 685 ARG D CA 1 ATOM 3706 C C . ARG H 2 85 ? 3.405 50.582 0.840 1.00 15.26 ? 685 ARG D C 1 ATOM 3707 O O . ARG H 2 85 ? 3.273 51.713 1.253 1.00 14.79 ? 685 ARG D O 1 ATOM 3708 C CB . ARG H 2 85 ? 1.554 50.296 -0.757 1.00 20.02 ? 685 ARG D CB 1 ATOM 3709 C CG . ARG H 2 85 ? 0.326 49.581 -1.292 1.00 24.78 ? 685 ARG D CG 1 ATOM 3710 C CD . ARG H 2 85 ? 0.799 48.375 -2.081 1.00 27.74 ? 685 ARG D CD 1 ATOM 3711 N NE . ARG H 2 85 ? -0.310 47.596 -2.624 1.00 28.12 ? 685 ARG D NE 1 ATOM 3712 C CZ . ARG H 2 85 ? -1.166 46.946 -1.856 1.00 30.17 ? 685 ARG D CZ 1 ATOM 3713 N NH1 . ARG H 2 85 ? -1.001 46.999 -0.523 1.00 27.21 ? 685 ARG D NH1 1 ATOM 3714 N NH2 . ARG H 2 85 ? -2.175 46.252 -2.403 1.00 24.04 ? 685 ARG D NH2 1 ATOM 3715 N N . GLU H 2 86 ? 4.577 50.041 0.574 1.00 13.94 ? 686 GLU D N 1 ATOM 3716 C CA . GLU H 2 86 ? 5.809 50.806 0.817 1.00 14.16 ? 686 GLU D CA 1 ATOM 3717 C C . GLU H 2 86 ? 5.842 52.008 -0.163 1.00 18.50 ? 686 GLU D C 1 ATOM 3718 O O . GLU H 2 86 ? 5.495 51.895 -1.346 1.00 16.62 ? 686 GLU D O 1 ATOM 3719 C CB . GLU H 2 86 ? 7.014 49.879 0.654 1.00 15.59 ? 686 GLU D CB 1 ATOM 3720 C CG . GLU H 2 86 ? 8.317 50.612 1.019 1.00 21.03 ? 686 GLU D CG 1 ATOM 3721 C CD . GLU H 2 86 ? 9.559 49.760 0.876 1.00 20.66 ? 686 GLU D CD 1 ATOM 3722 O OE1 . GLU H 2 86 ? 9.539 48.793 0.080 1.00 22.96 ? 686 GLU D OE1 1 ATOM 3723 O OE2 . GLU H 2 86 ? 10.581 50.071 1.561 1.00 22.50 ? 686 GLU D OE2 1 ATOM 3724 N N . THR H 2 87 ? 6.247 53.197 0.319 1.00 14.62 ? 687 THR D N 1 ATOM 3725 C CA . THR H 2 87 ? 6.239 54.358 -0.576 1.00 13.07 ? 687 THR D CA 1 ATOM 3726 C C . THR H 2 87 ? 7.631 54.553 -1.214 1.00 14.74 ? 687 THR D C 1 ATOM 3727 O O . THR H 2 87 ? 8.600 53.864 -0.856 1.00 18.39 ? 687 THR D O 1 ATOM 3728 C CB . THR H 2 87 ? 5.961 55.672 0.181 1.00 19.27 ? 687 THR D CB 1 ATOM 3729 O OG1 . THR H 2 87 ? 7.100 55.986 0.973 1.00 21.73 ? 687 THR D OG1 1 ATOM 3730 C CG2 . THR H 2 87 ? 4.720 55.528 1.168 1.00 19.81 ? 687 THR D CG2 1 ATOM 3731 N N . GLY H 2 88 ? 7.686 55.536 -2.118 1.00 20.52 ? 688 GLY D N 1 ATOM 3732 C CA . GLY H 2 88 ? 8.940 55.902 -2.785 1.00 23.56 ? 688 GLY D CA 1 ATOM 3733 C C . GLY H 2 88 ? 9.985 56.551 -1.887 1.00 27.82 ? 688 GLY D C 1 ATOM 3734 O O . GLY H 2 88 ? 11.149 56.712 -2.269 1.00 29.13 ? 688 GLY D O 1 ATOM 3735 N N . SER H 2 89 ? 9.582 56.933 -0.689 1.00 26.99 ? 689 SER D N 1 ATOM 3736 C CA . SER H 2 89 ? 10.535 57.549 0.240 1.00 27.34 ? 689 SER D CA 1 ATOM 3737 C C . SER H 2 89 ? 11.066 56.551 1.257 1.00 29.09 ? 689 SER D C 1 ATOM 3738 O O . SER H 2 89 ? 11.942 56.888 2.054 1.00 31.41 ? 689 SER D O 1 ATOM 3739 C CB A SER H 2 89 ? 9.871 58.731 0.964 0.54 26.35 ? 689 SER D CB 1 ATOM 3740 C CB B SER H 2 89 ? 9.878 58.683 0.982 0.46 24.10 ? 689 SER D CB 1 ATOM 3741 O OG A SER H 2 89 ? 8.898 58.291 1.905 0.54 26.16 ? 689 SER D OG 1 ATOM 3742 O OG B SER H 2 89 ? 9.196 59.504 0.064 0.46 21.88 ? 689 SER D OG 1 ATOM 3743 N N . SER H 2 90 ? 10.546 55.316 1.236 1.00 25.22 ? 690 SER D N 1 ATOM 3744 C CA . SER H 2 90 ? 10.943 54.262 2.165 1.00 25.53 ? 690 SER D CA 1 ATOM 3745 C C . SER H 2 90 ? 12.382 53.730 2.002 1.00 24.72 ? 690 SER D C 1 ATOM 3746 O O . SER H 2 90 ? 12.858 53.693 0.924 1.00 31.49 ? 690 SER D O 1 ATOM 3747 C CB . SER H 2 90 ? 9.941 53.093 2.009 1.00 18.31 ? 690 SER D CB 1 ATOM 3748 O OG . SER H 2 90 ? 10.144 52.100 3.005 1.00 22.49 ? 690 SER D OG 1 ATOM 3749 N N . LYS H 2 91 ? 13.052 53.354 3.094 1.00 31.80 ? 691 LYS D N 1 ATOM 3750 C CA . LYS H 2 91 ? 14.429 52.792 3.047 1.00 33.42 ? 691 LYS D CA 1 ATOM 3751 C C . LYS H 2 91 ? 14.776 52.128 4.380 1.00 35.79 ? 691 LYS D C 1 ATOM 3752 O O . LYS H 2 91 ? 14.915 52.802 5.419 1.00 38.33 ? 691 LYS D O 1 ATOM 3753 C CB A LYS H 2 91 ? 15.438 53.894 2.747 0.65 39.80 ? 691 LYS D CB 1 ATOM 3754 C CB B LYS H 2 91 ? 15.411 53.874 2.725 0.35 39.54 ? 691 LYS D CB 1 ATOM 3755 C CG A LYS H 2 91 ? 16.836 53.383 2.481 0.65 40.46 ? 691 LYS D CG 1 ATOM 3756 C CG B LYS H 2 91 ? 16.004 53.761 1.321 0.35 42.80 ? 691 LYS D CG 1 ATOM 3757 C CD A LYS H 2 91 ? 17.839 54.435 2.852 0.65 40.97 ? 691 LYS D CD 1 ATOM 3758 C CD B LYS H 2 91 ? 17.498 54.057 1.314 0.35 46.43 ? 691 LYS D CD 1 ATOM 3759 C CE A LYS H 2 91 ? 17.893 54.643 4.371 0.65 42.62 ? 691 LYS D CE 1 ATOM 3760 C CE B LYS H 2 91 ? 18.106 53.790 -0.048 0.35 48.74 ? 691 LYS D CE 1 ATOM 3761 N NZ A LYS H 2 91 ? 16.678 55.225 4.986 0.65 39.42 ? 691 LYS D NZ 1 ATOM 3762 N NZ B LYS H 2 91 ? 19.574 54.022 -0.069 0.35 51.16 ? 691 LYS D NZ 1 ATOM 3763 N N . TYR H 2 92 ? 14.867 50.802 4.361 1.00 32.60 ? 692 TYR D N 1 ATOM 3764 C CA . TYR H 2 92 ? 15.150 50.030 5.570 1.00 34.06 ? 692 TYR D CA 1 ATOM 3765 C C . TYR H 2 92 ? 16.343 50.627 6.362 1.00 33.69 ? 692 TYR D C 1 ATOM 3766 O O . TYR H 2 92 ? 17.295 51.018 5.766 1.00 30.96 ? 692 TYR D O 1 ATOM 3767 C CB . TYR H 2 92 ? 15.417 48.583 5.165 1.00 30.99 ? 692 TYR D CB 1 ATOM 3768 C CG . TYR H 2 92 ? 15.848 47.738 6.309 1.00 38.27 ? 692 TYR D CG 1 ATOM 3769 C CD1 . TYR H 2 92 ? 14.928 47.261 7.225 1.00 34.76 ? 692 TYR D CD1 1 ATOM 3770 C CD2 . TYR H 2 92 ? 17.208 47.432 6.500 1.00 36.52 ? 692 TYR D CD2 1 ATOM 3771 C CE1 . TYR H 2 92 ? 15.332 46.499 8.308 1.00 41.07 ? 692 TYR D CE1 1 ATOM 3772 C CE2 . TYR H 2 92 ? 17.622 46.677 7.564 1.00 40.60 ? 692 TYR D CE2 1 ATOM 3773 C CZ . TYR H 2 92 ? 16.691 46.210 8.467 1.00 41.96 ? 692 TYR D CZ 1 ATOM 3774 O OH . TYR H 2 92 ? 17.100 45.450 9.530 1.00 45.07 ? 692 TYR D OH 1 ATOM 3775 N N . PRO H 2 93 ? 16.274 50.718 7.704 1.00 34.07 ? 693 PRO D N 1 ATOM 3776 C CA . PRO H 2 93 ? 15.249 50.366 8.683 1.00 33.81 ? 693 PRO D CA 1 ATOM 3777 C C . PRO H 2 93 ? 14.252 51.470 8.877 1.00 31.14 ? 693 PRO D C 1 ATOM 3778 O O . PRO H 2 93 ? 13.487 51.428 9.843 1.00 38.38 ? 693 PRO D O 1 ATOM 3779 C CB . PRO H 2 93 ? 16.058 50.112 9.953 1.00 36.59 ? 693 PRO D CB 1 ATOM 3780 C CG . PRO H 2 93 ? 17.127 51.189 9.838 1.00 35.12 ? 693 PRO D CG 1 ATOM 3781 C CD . PRO H 2 93 ? 17.543 51.067 8.394 1.00 34.39 ? 693 PRO D CD 1 ATOM 3782 N N . ASN H 2 94 ? 14.261 52.453 7.980 1.00 31.29 ? 694 ASN D N 1 ATOM 3783 C CA . ASN H 2 94 ? 13.301 53.558 8.048 1.00 31.57 ? 694 ASN D CA 1 ATOM 3784 C C . ASN H 2 94 ? 12.231 53.380 6.942 1.00 30.60 ? 694 ASN D C 1 ATOM 3785 O O . ASN H 2 94 ? 12.152 54.102 5.925 1.00 33.66 ? 694 ASN D O 1 ATOM 3786 C CB . ASN H 2 94 ? 14.027 54.885 7.930 1.00 37.54 ? 694 ASN D CB 1 ATOM 3787 C CG . ASN H 2 94 ? 14.941 55.125 9.132 1.00 38.23 ? 694 ASN D CG 1 ATOM 3788 O OD1 . ASN H 2 94 ? 14.480 55.146 10.293 1.00 39.37 ? 694 ASN D OD1 1 ATOM 3789 N ND2 . ASN H 2 94 ? 16.221 55.264 8.872 1.00 38.54 ? 694 ASN D ND2 1 ATOM 3790 N N . CYS H 2 95 ? 11.436 52.358 7.171 1.00 30.50 ? 695 CYS D N 1 ATOM 3791 C CA . CYS H 2 95 ? 10.367 51.994 6.260 1.00 26.33 ? 695 CYS D CA 1 ATOM 3792 C C . CYS H 2 95 ? 9.266 53.025 6.302 1.00 28.58 ? 695 CYS D C 1 ATOM 3793 O O . CYS H 2 95 ? 9.010 53.646 7.336 1.00 33.19 ? 695 CYS D O 1 ATOM 3794 C CB . CYS H 2 95 ? 9.848 50.639 6.676 1.00 26.15 ? 695 CYS D CB 1 ATOM 3795 S SG . CYS H 2 95 ? 11.175 49.367 6.686 1.00 26.00 ? 695 CYS D SG 1 ATOM 3796 N N . ALA H 2 96 ? 8.602 53.233 5.175 1.00 20.18 ? 696 ALA D N 1 ATOM 3797 C CA . ALA H 2 96 ? 7.537 54.193 5.154 1.00 19.16 ? 696 ALA D CA 1 ATOM 3798 C C . ALA H 2 96 ? 6.447 53.570 4.301 1.00 18.26 ? 696 ALA D C 1 ATOM 3799 O O . ALA H 2 96 ? 6.736 53.021 3.221 1.00 18.13 ? 696 ALA D O 1 ATOM 3800 C CB . ALA H 2 96 ? 8.026 55.501 4.538 1.00 22.83 ? 696 ALA D CB 1 ATOM 3801 N N . TYR H 2 97 ? 5.213 53.679 4.777 1.00 16.22 ? 697 TYR D N 1 ATOM 3802 C CA . TYR H 2 97 ? 4.053 53.096 4.090 1.00 14.57 ? 697 TYR D CA 1 ATOM 3803 C C . TYR H 2 97 ? 2.903 54.069 3.846 1.00 16.14 ? 697 TYR D C 1 ATOM 3804 O O . TYR H 2 97 ? 2.660 54.983 4.658 1.00 19.30 ? 697 TYR D O 1 ATOM 3805 C CB . TYR H 2 97 ? 3.475 51.985 4.964 1.00 15.25 ? 697 TYR D CB 1 ATOM 3806 C CG . TYR H 2 97 ? 4.374 50.797 5.043 1.00 15.60 ? 697 TYR D CG 1 ATOM 3807 C CD1 . TYR H 2 97 ? 4.331 49.804 4.048 1.00 16.50 ? 697 TYR D CD1 1 ATOM 3808 C CD2 . TYR H 2 97 ? 5.298 50.682 6.049 1.00 17.19 ? 697 TYR D CD2 1 ATOM 3809 C CE1 . TYR H 2 97 ? 5.209 48.719 4.084 1.00 14.84 ? 697 TYR D CE1 1 ATOM 3810 C CE2 . TYR H 2 97 ? 6.172 49.607 6.090 1.00 15.81 ? 697 TYR D CE2 1 ATOM 3811 C CZ . TYR H 2 97 ? 6.126 48.635 5.115 1.00 19.44 ? 697 TYR D CZ 1 ATOM 3812 O OH . TYR H 2 97 ? 6.995 47.582 5.155 1.00 18.55 ? 697 TYR D OH 1 ATOM 3813 N N . LYS H 2 98 ? 2.153 53.804 2.777 1.00 14.62 ? 698 LYS D N 1 ATOM 3814 C CA . LYS H 2 98 ? 0.932 54.523 2.424 1.00 15.72 ? 698 LYS D CA 1 ATOM 3815 C C . LYS H 2 98 ? -0.173 53.580 2.979 1.00 17.72 ? 698 LYS D C 1 ATOM 3816 O O . LYS H 2 98 ? -0.150 52.375 2.748 1.00 17.09 ? 698 LYS D O 1 ATOM 3817 C CB . LYS H 2 98 ? 0.755 54.612 0.900 1.00 15.81 ? 698 LYS D CB 1 ATOM 3818 C CG . LYS H 2 98 ? -0.587 55.117 0.417 1.00 22.56 ? 698 LYS D CG 1 ATOM 3819 C CD . LYS H 2 98 ? -0.669 54.920 -1.136 1.00 26.04 ? 698 LYS D CD 1 ATOM 3820 C CE . LYS H 2 98 ? -1.925 55.559 -1.787 1.00 39.85 ? 698 LYS D CE 1 ATOM 3821 N NZ . LYS H 2 98 ? -3.233 54.743 -1.775 1.00 43.55 ? 698 LYS D NZ 1 ATOM 3822 N N . THR H 2 99 ? -1.096 54.163 3.726 1.00 15.88 ? 699 THR D N 1 ATOM 3823 C CA . THR H 2 99 ? -2.253 53.475 4.305 1.00 15.57 ? 699 THR D CA 1 ATOM 3824 C C . THR H 2 99 ? -3.502 53.756 3.490 1.00 17.64 ? 699 THR D C 1 ATOM 3825 O O . THR H 2 99 ? -3.845 54.921 3.250 1.00 18.68 ? 699 THR D O 1 ATOM 3826 C CB . THR H 2 99 ? -2.492 54.001 5.732 1.00 17.94 ? 699 THR D CB 1 ATOM 3827 O OG1 . THR H 2 99 ? -1.385 53.611 6.569 1.00 16.96 ? 699 THR D OG1 1 ATOM 3828 C CG2 . THR H 2 99 ? -3.815 53.436 6.326 1.00 16.55 ? 699 THR D CG2 1 ATOM 3829 N N . THR H 2 100 ? -4.198 52.721 3.038 1.00 17.01 ? 700 THR D N 1 ATOM 3830 C CA . THR H 2 100 ? -5.433 52.963 2.295 1.00 16.69 ? 700 THR D CA 1 ATOM 3831 C C . THR H 2 100 ? -6.530 52.045 2.847 1.00 16.66 ? 700 THR D C 1 ATOM 3832 O O . THR H 2 100 ? -6.340 50.830 2.857 1.00 16.37 ? 700 THR D O 1 ATOM 3833 C CB . THR H 2 100 ? -5.259 52.641 0.784 1.00 18.20 ? 700 THR D CB 1 ATOM 3834 O OG1 . THR H 2 100 ? -4.106 53.327 0.242 1.00 19.54 ? 700 THR D OG1 1 ATOM 3835 C CG2 . THR H 2 100 ? -6.493 53.065 -0.008 1.00 18.74 ? 700 THR D CG2 1 ATOM 3836 N N . GLN H 2 101 ? -7.664 52.634 3.257 1.00 16.53 ? 701 GLN D N 1 ATOM 3837 C CA . GLN H 2 101 ? -8.811 51.856 3.747 1.00 17.57 ? 701 GLN D CA 1 ATOM 3838 C C . GLN H 2 101 ? -9.570 51.343 2.556 1.00 21.54 ? 701 GLN D C 1 ATOM 3839 O O . GLN H 2 101 ? -9.658 52.013 1.510 1.00 21.87 ? 701 GLN D O 1 ATOM 3840 C CB . GLN H 2 101 ? -9.776 52.738 4.514 1.00 21.60 ? 701 GLN D CB 1 ATOM 3841 C CG . GLN H 2 101 ? -9.182 53.437 5.674 1.00 28.92 ? 701 GLN D CG 1 ATOM 3842 C CD . GLN H 2 101 ? -10.185 54.356 6.406 1.00 34.07 ? 701 GLN D CD 1 ATOM 3843 O OE1 . GLN H 2 101 ? -10.922 55.102 5.781 1.00 40.17 ? 701 GLN D OE1 1 ATOM 3844 N NE2 . GLN H 2 101 ? -10.171 54.317 7.728 1.00 35.34 ? 701 GLN D NE2 1 ATOM 3845 N N . ALA H 2 102 ? -10.170 50.169 2.724 1.00 16.78 ? 702 ALA D N 1 ATOM 3846 C CA . ALA H 2 102 ? -10.956 49.567 1.664 1.00 19.96 ? 702 ALA D CA 1 ATOM 3847 C C . ALA H 2 102 ? -11.999 48.630 2.265 1.00 17.15 ? 702 ALA D C 1 ATOM 3848 O O . ALA H 2 102 ? -11.970 48.342 3.479 1.00 16.45 ? 702 ALA D O 1 ATOM 3849 C CB . ALA H 2 102 ? -10.026 48.811 0.699 1.00 23.05 ? 702 ALA D CB 1 ATOM 3850 N N . ASN H 2 103 ? -12.983 48.252 1.447 1.00 18.42 ? 703 ASN D N 1 ATOM 3851 C CA . ASN H 2 103 ? -14.023 47.285 1.859 1.00 15.67 ? 703 ASN D CA 1 ATOM 3852 C C . ASN H 2 103 ? -14.100 46.396 0.639 1.00 16.51 ? 703 ASN D C 1 ATOM 3853 O O . ASN H 2 103 ? -14.661 46.795 -0.416 1.00 21.03 ? 703 ASN D O 1 ATOM 3854 C CB . ASN H 2 103 ? -15.373 47.976 2.101 1.00 19.74 ? 703 ASN D CB 1 ATOM 3855 C CG . ASN H 2 103 ? -15.414 48.661 3.436 1.00 24.12 ? 703 ASN D CG 1 ATOM 3856 O OD1 . ASN H 2 103 ? -15.628 48.023 4.486 1.00 26.18 ? 703 ASN D OD1 1 ATOM 3857 N ND2 . ASN H 2 103 ? -15.165 49.971 3.424 1.00 25.87 ? 703 ASN D ND2 1 ATOM 3858 N N . LYS H 2 104 ? -13.496 45.218 0.724 1.00 14.04 ? 704 LYS D N 1 ATOM 3859 C CA . LYS H 2 104 ? -13.416 44.344 -0.411 1.00 15.34 ? 704 LYS D CA 1 ATOM 3860 C C . LYS H 2 104 ? -13.571 42.894 0.020 1.00 13.40 ? 704 LYS D C 1 ATOM 3861 O O . LYS H 2 104 ? -13.428 42.580 1.224 1.00 12.58 ? 704 LYS D O 1 ATOM 3862 C CB . LYS H 2 104 ? -12.044 44.510 -1.083 1.00 17.18 ? 704 LYS D CB 1 ATOM 3863 C CG . LYS H 2 104 ? -11.887 45.927 -1.683 1.00 20.64 ? 704 LYS D CG 1 ATOM 3864 C CD . LYS H 2 104 ? -10.530 46.147 -2.334 1.00 26.20 ? 704 LYS D CD 1 ATOM 3865 C CE . LYS H 2 104 ? -10.326 45.281 -3.552 1.00 31.45 ? 704 LYS D CE 1 ATOM 3866 N NZ . LYS H 2 104 ? -8.991 45.602 -4.217 1.00 35.11 ? 704 LYS D NZ 1 ATOM 3867 N N . HIS H 2 105 ? -13.814 42.015 -0.942 1.00 15.16 ? 705 HIS D N 1 ATOM 3868 C CA . HIS H 2 105 ? -13.857 40.582 -0.603 1.00 12.40 ? 705 HIS D CA 1 ATOM 3869 C C . HIS H 2 105 ? -12.374 40.144 -0.468 1.00 14.47 ? 705 HIS D C 1 ATOM 3870 O O . HIS H 2 105 ? -11.545 40.487 -1.303 1.00 17.21 ? 705 HIS D O 1 ATOM 3871 C CB . HIS H 2 105 ? -14.492 39.772 -1.735 1.00 14.77 ? 705 HIS D CB 1 ATOM 3872 C CG . HIS H 2 105 ? -15.852 40.274 -2.100 1.00 12.66 ? 705 HIS D CG 1 ATOM 3873 N ND1 . HIS H 2 105 ? -17.005 39.723 -1.586 1.00 17.94 ? 705 HIS D ND1 1 ATOM 3874 C CD2 . HIS H 2 105 ? -16.235 41.318 -2.877 1.00 16.10 ? 705 HIS D CD2 1 ATOM 3875 C CE1 . HIS H 2 105 ? -18.049 40.404 -2.037 1.00 19.74 ? 705 HIS D CE1 1 ATOM 3876 N NE2 . HIS H 2 105 ? -17.610 41.372 -2.821 1.00 20.51 ? 705 HIS D NE2 1 ATOM 3877 N N . ILE H 2 106 ? -12.031 39.384 0.569 1.00 11.77 ? 706 ILE D N 1 ATOM 3878 C CA . ILE H 2 106 ? -10.632 38.951 0.695 1.00 11.46 ? 706 ILE D CA 1 ATOM 3879 C C . ILE H 2 106 ? -10.433 37.572 0.076 1.00 11.94 ? 706 ILE D C 1 ATOM 3880 O O . ILE H 2 106 ? -11.389 36.764 -0.056 1.00 13.84 ? 706 ILE D O 1 ATOM 3881 C CB . ILE H 2 106 ? -10.156 38.943 2.196 1.00 11.08 ? 706 ILE D CB 1 ATOM 3882 C CG1 . ILE H 2 106 ? -10.854 37.826 2.971 1.00 13.07 ? 706 ILE D CG1 1 ATOM 3883 C CG2 . ILE H 2 106 ? -10.357 40.333 2.833 1.00 15.08 ? 706 ILE D CG2 1 ATOM 3884 C CD1 . ILE H 2 106 ? -10.276 37.736 4.435 1.00 12.70 ? 706 ILE D CD1 1 ATOM 3885 N N . ILE H 2 107 ? -9.187 37.270 -0.311 1.00 11.20 ? 707 ILE D N 1 ATOM 3886 C CA . ILE H 2 107 ? -8.864 35.988 -0.902 1.00 11.93 ? 707 ILE D CA 1 ATOM 3887 C C . ILE H 2 107 ? -7.680 35.487 -0.087 1.00 11.79 ? 707 ILE D C 1 ATOM 3888 O O . ILE H 2 107 ? -6.652 36.114 -0.014 1.00 11.92 ? 707 ILE D O 1 ATOM 3889 C CB . ILE H 2 107 ? -8.469 36.101 -2.360 1.00 11.73 ? 707 ILE D CB 1 ATOM 3890 C CG1 . ILE H 2 107 ? -9.689 36.652 -3.148 1.00 14.14 ? 707 ILE D CG1 1 ATOM 3891 C CG2 . ILE H 2 107 ? -8.076 34.772 -2.904 1.00 13.16 ? 707 ILE D CG2 1 ATOM 3892 C CD1 . ILE H 2 107 ? -9.351 37.055 -4.637 1.00 17.50 ? 707 ILE D CD1 1 ATOM 3893 N N . VAL H 2 108 ? -7.861 34.349 0.538 1.00 12.95 ? 708 VAL D N 1 ATOM 3894 C CA . VAL H 2 108 ? -6.798 33.806 1.398 1.00 13.93 ? 708 VAL D CA 1 ATOM 3895 C C . VAL H 2 108 ? -6.494 32.360 1.046 1.00 16.03 ? 708 VAL D C 1 ATOM 3896 O O . VAL H 2 108 ? -7.368 31.656 0.555 1.00 16.47 ? 708 VAL D O 1 ATOM 3897 C CB . VAL H 2 108 ? -7.186 33.852 2.902 1.00 13.94 ? 708 VAL D CB 1 ATOM 3898 C CG1 . VAL H 2 108 ? -7.294 35.311 3.338 1.00 16.30 ? 708 VAL D CG1 1 ATOM 3899 C CG2 . VAL H 2 108 ? -8.498 33.117 3.169 1.00 14.29 ? 708 VAL D CG2 1 ATOM 3900 N N . ALA H 2 109 ? -5.253 31.933 1.285 1.00 11.55 ? 709 ALA D N 1 ATOM 3901 C CA . ALA H 2 109 ? -4.874 30.512 1.068 1.00 13.11 ? 709 ALA D CA 1 ATOM 3902 C C . ALA H 2 109 ? -5.074 29.829 2.430 1.00 13.51 ? 709 ALA D C 1 ATOM 3903 O O . ALA H 2 109 ? -4.626 30.353 3.449 1.00 13.62 ? 709 ALA D O 1 ATOM 3904 C CB . ALA H 2 109 ? -3.410 30.420 0.708 1.00 14.06 ? 709 ALA D CB 1 ATOM 3905 N N . CYS H 2 110 ? -5.691 28.645 2.400 1.00 14.48 ? 710 CYS D N 1 ATOM 3906 C CA . CYS H 2 110 ? -5.980 27.907 3.639 1.00 13.78 ? 710 CYS D CA 1 ATOM 3907 C C . CYS H 2 110 ? -5.334 26.562 3.646 1.00 17.43 ? 710 CYS D C 1 ATOM 3908 O O . CYS H 2 110 ? -5.224 25.890 2.597 1.00 17.38 ? 710 CYS D O 1 ATOM 3909 C CB . CYS H 2 110 ? -7.493 27.705 3.759 1.00 15.46 ? 710 CYS D CB 1 ATOM 3910 S SG . CYS H 2 110 ? -8.454 29.275 3.782 1.00 18.70 ? 710 CYS D SG 1 ATOM 3911 N N . GLU H 2 111 ? -4.930 26.152 4.856 1.00 14.58 ? 711 GLU D N 1 ATOM 3912 C CA . GLU H 2 111 ? -4.309 24.850 5.019 1.00 15.94 ? 711 GLU D CA 1 ATOM 3913 C C . GLU H 2 111 ? -4.722 24.320 6.384 1.00 18.10 ? 711 GLU D C 1 ATOM 3914 O O . GLU H 2 111 ? -4.978 25.077 7.296 1.00 14.70 ? 711 GLU D O 1 ATOM 3915 C CB . GLU H 2 111 ? -2.790 24.955 4.964 1.00 17.99 ? 711 GLU D CB 1 ATOM 3916 C CG . GLU H 2 111 ? -2.229 25.143 3.541 1.00 23.70 ? 711 GLU D CG 1 ATOM 3917 C CD . GLU H 2 111 ? -0.697 25.210 3.518 1.00 29.69 ? 711 GLU D CD 1 ATOM 3918 O OE1 . GLU H 2 111 ? -0.065 24.690 4.449 1.00 33.47 ? 711 GLU D OE1 1 ATOM 3919 O OE2 . GLU H 2 111 ? -0.115 25.756 2.557 1.00 29.06 ? 711 GLU D OE2 1 ATOM 3920 N N . GLY H 2 112 ? -4.712 22.999 6.493 1.00 19.78 ? 712 GLY D N 1 ATOM 3921 C CA . GLY H 2 112 ? -5.051 22.346 7.741 1.00 19.02 ? 712 GLY D CA 1 ATOM 3922 C C . GLY H 2 112 ? -4.574 20.899 7.629 1.00 17.95 ? 712 GLY D C 1 ATOM 3923 O O . GLY H 2 112 ? -3.914 20.508 6.651 1.00 19.45 ? 712 GLY D O 1 ATOM 3924 N N . ASN H 2 113 ? -4.805 20.139 8.679 1.00 16.77 ? 713 ASN D N 1 ATOM 3925 C CA . ASN H 2 113 ? -4.416 18.712 8.644 1.00 19.28 ? 713 ASN D CA 1 ATOM 3926 C C . ASN H 2 113 ? -5.689 17.980 9.016 1.00 15.77 ? 713 ASN D C 1 ATOM 3927 O O . ASN H 2 113 ? -6.132 18.034 10.156 1.00 18.08 ? 713 ASN D O 1 ATOM 3928 C CB . ASN H 2 113 ? -3.306 18.423 9.668 1.00 20.55 ? 713 ASN D CB 1 ATOM 3929 C CG . ASN H 2 113 ? -1.988 19.126 9.333 1.00 22.97 ? 713 ASN D CG 1 ATOM 3930 O OD1 . ASN H 2 113 ? -1.676 20.149 9.921 1.00 26.12 ? 713 ASN D OD1 1 ATOM 3931 N ND2 . ASN H 2 113 ? -1.212 18.566 8.401 1.00 23.97 ? 713 ASN D ND2 1 ATOM 3932 N N . PRO H 2 114 ? -6.305 17.267 8.062 1.00 16.94 ? 714 PRO D N 1 ATOM 3933 C CA . PRO H 2 114 ? -7.551 16.529 8.283 1.00 15.48 ? 714 PRO D CA 1 ATOM 3934 C C . PRO H 2 114 ? -7.462 15.674 9.540 1.00 17.24 ? 714 PRO D C 1 ATOM 3935 O O . PRO H 2 114 ? -6.438 15.065 9.775 1.00 17.23 ? 714 PRO D O 1 ATOM 3936 C CB . PRO H 2 114 ? -7.665 15.663 7.052 1.00 19.09 ? 714 PRO D CB 1 ATOM 3937 C CG . PRO H 2 114 ? -7.069 16.623 5.999 1.00 19.51 ? 714 PRO D CG 1 ATOM 3938 C CD . PRO H 2 114 ? -5.836 17.122 6.671 1.00 19.49 ? 714 PRO D CD 1 ATOM 3939 N N . TYR H 2 115 ? -8.519 15.686 10.332 1.00 18.08 ? 715 TYR D N 1 ATOM 3940 C CA . TYR H 2 115 ? -8.539 14.893 11.578 1.00 16.50 ? 715 TYR D CA 1 ATOM 3941 C C . TYR H 2 115 ? -8.615 13.415 11.253 1.00 13.72 ? 715 TYR D C 1 ATOM 3942 O O . TYR H 2 115 ? -9.475 12.980 10.502 1.00 16.82 ? 715 TYR D O 1 ATOM 3943 C CB . TYR H 2 115 ? -9.731 15.316 12.415 1.00 15.76 ? 715 TYR D CB 1 ATOM 3944 C CG . TYR H 2 115 ? -9.424 16.679 13.019 1.00 17.74 ? 715 TYR D CG 1 ATOM 3945 C CD1 . TYR H 2 115 ? -9.529 17.841 12.259 1.00 21.47 ? 715 TYR D CD1 1 ATOM 3946 C CD2 . TYR H 2 115 ? -8.988 16.776 14.332 1.00 17.40 ? 715 TYR D CD2 1 ATOM 3947 C CE1 . TYR H 2 115 ? -9.188 19.073 12.796 1.00 22.76 ? 715 TYR D CE1 1 ATOM 3948 C CE2 . TYR H 2 115 ? -8.646 18.024 14.908 1.00 17.36 ? 715 TYR D CE2 1 ATOM 3949 C CZ . TYR H 2 115 ? -8.750 19.167 14.101 1.00 21.76 ? 715 TYR D CZ 1 ATOM 3950 O OH . TYR H 2 115 ? -8.348 20.396 14.630 1.00 24.55 ? 715 TYR D OH 1 ATOM 3951 N N . VAL H 2 116 ? -7.688 12.655 11.854 1.00 13.55 ? 716 VAL D N 1 ATOM 3952 C CA . VAL H 2 116 ? -7.634 11.203 11.607 1.00 16.27 ? 716 VAL D CA 1 ATOM 3953 C C . VAL H 2 116 ? -7.407 10.525 12.939 1.00 15.65 ? 716 VAL D C 1 ATOM 3954 O O . VAL H 2 116 ? -6.973 11.120 13.893 1.00 16.05 ? 716 VAL D O 1 ATOM 3955 C CB . VAL H 2 116 ? -6.487 10.815 10.636 1.00 16.30 ? 716 VAL D CB 1 ATOM 3956 C CG1 . VAL H 2 116 ? -6.784 11.338 9.222 1.00 19.61 ? 716 VAL D CG1 1 ATOM 3957 C CG2 . VAL H 2 116 ? -5.160 11.320 11.168 1.00 15.81 ? 716 VAL D CG2 1 ATOM 3958 N N . PRO H 2 117 ? -7.689 9.243 13.008 1.00 14.78 ? 717 PRO D N 1 ATOM 3959 C CA . PRO H 2 117 ? -7.515 8.543 14.282 1.00 13.03 ? 717 PRO D CA 1 ATOM 3960 C C . PRO H 2 117 ? -6.069 8.299 14.648 1.00 14.99 ? 717 PRO D C 1 ATOM 3961 O O . PRO H 2 117 ? -5.251 7.974 13.764 1.00 16.48 ? 717 PRO D O 1 ATOM 3962 C CB . PRO H 2 117 ? -8.248 7.200 14.057 1.00 15.25 ? 717 PRO D CB 1 ATOM 3963 C CG . PRO H 2 117 ? -9.149 7.447 12.927 1.00 17.39 ? 717 PRO D CG 1 ATOM 3964 C CD . PRO H 2 117 ? -8.363 8.412 12.005 1.00 15.69 ? 717 PRO D CD 1 ATOM 3965 N N . VAL H 2 118 ? -5.776 8.458 15.941 1.00 13.33 ? 718 VAL D N 1 ATOM 3966 C CA . VAL H 2 118 ? -4.408 8.204 16.440 1.00 13.44 ? 718 VAL D CA 1 ATOM 3967 C C . VAL H 2 118 ? -4.411 7.220 17.598 1.00 14.82 ? 718 VAL D C 1 ATOM 3968 O O . VAL H 2 118 ? -3.357 6.784 18.045 1.00 17.67 ? 718 VAL D O 1 ATOM 3969 C CB . VAL H 2 118 ? -3.705 9.495 16.862 1.00 14.28 ? 718 VAL D CB 1 ATOM 3970 C CG1 . VAL H 2 118 ? -3.557 10.387 15.587 1.00 16.29 ? 718 VAL D CG1 1 ATOM 3971 C CG2 . VAL H 2 118 ? -4.502 10.228 18.020 1.00 19.32 ? 718 VAL D CG2 1 ATOM 3972 N N . HIS H 2 119 ? -5.580 6.859 18.097 1.00 14.95 ? 719 HIS D N 1 ATOM 3973 C CA . HIS H 2 119 ? -5.581 5.863 19.202 1.00 15.62 ? 719 HIS D CA 1 ATOM 3974 C C . HIS H 2 119 ? -6.940 5.141 19.143 1.00 15.35 ? 719 HIS D C 1 ATOM 3975 O O . HIS H 2 119 ? -7.979 5.755 18.859 1.00 14.62 ? 719 HIS D O 1 ATOM 3976 C CB . HIS H 2 119 ? -5.359 6.572 20.578 1.00 17.64 ? 719 HIS D CB 1 ATOM 3977 C CG . HIS H 2 119 ? -6.080 5.963 21.751 1.00 27.68 ? 719 HIS D CG 1 ATOM 3978 N ND1 . HIS H 2 119 ? -5.622 4.838 22.418 1.00 28.57 ? 719 HIS D ND1 1 ATOM 3979 C CD2 . HIS H 2 119 ? -7.198 6.362 22.418 1.00 23.24 ? 719 HIS D CD2 1 ATOM 3980 C CE1 . HIS H 2 119 ? -6.425 4.571 23.436 1.00 26.75 ? 719 HIS D CE1 1 ATOM 3981 N NE2 . HIS H 2 119 ? -7.390 5.479 23.458 1.00 30.82 ? 719 HIS D NE2 1 ATOM 3982 N N . PHE H 2 120 ? -6.930 3.837 19.401 1.00 14.64 ? 720 PHE D N 1 ATOM 3983 C CA . PHE H 2 120 ? -8.197 3.115 19.448 1.00 15.28 ? 720 PHE D CA 1 ATOM 3984 C C . PHE H 2 120 ? -8.607 3.050 20.951 1.00 15.70 ? 720 PHE D C 1 ATOM 3985 O O . PHE H 2 120 ? -7.865 2.516 21.794 1.00 16.07 ? 720 PHE D O 1 ATOM 3986 C CB . PHE H 2 120 ? -8.028 1.707 18.874 1.00 13.57 ? 720 PHE D CB 1 ATOM 3987 C CG . PHE H 2 120 ? -9.328 0.972 18.772 1.00 14.16 ? 720 PHE D CG 1 ATOM 3988 C CD1 . PHE H 2 120 ? -9.910 0.359 19.918 1.00 12.49 ? 720 PHE D CD1 1 ATOM 3989 C CD2 . PHE H 2 120 ? -10.024 0.945 17.556 1.00 15.58 ? 720 PHE D CD2 1 ATOM 3990 C CE1 . PHE H 2 120 ? -11.182 -0.259 19.789 1.00 16.86 ? 720 PHE D CE1 1 ATOM 3991 C CE2 . PHE H 2 120 ? -11.286 0.334 17.444 1.00 15.92 ? 720 PHE D CE2 1 ATOM 3992 C CZ . PHE H 2 120 ? -11.852 -0.264 18.564 1.00 19.67 ? 720 PHE D CZ 1 ATOM 3993 N N . ASP H 2 121 ? -9.764 3.637 21.281 1.00 15.70 ? 721 ASP D N 1 ATOM 3994 C CA . ASP H 2 121 ? -10.163 3.741 22.685 1.00 18.41 ? 721 ASP D CA 1 ATOM 3995 C C . ASP H 2 121 ? -11.018 2.579 23.197 1.00 17.30 ? 721 ASP D C 1 ATOM 3996 O O . ASP H 2 121 ? -10.716 2.022 24.269 1.00 17.45 ? 721 ASP D O 1 ATOM 3997 C CB . ASP H 2 121 ? -10.907 5.054 22.928 1.00 19.79 ? 721 ASP D CB 1 ATOM 3998 C CG . ASP H 2 121 ? -10.738 5.579 24.348 1.00 19.97 ? 721 ASP D CG 1 ATOM 3999 O OD1 . ASP H 2 121 ? -9.591 5.584 24.877 1.00 20.78 ? 721 ASP D OD1 1 ATOM 4000 O OD2 . ASP H 2 121 ? -11.744 6.035 24.903 1.00 20.96 ? 721 ASP D OD2 1 ATOM 4001 N N . ALA H 2 122 ? -12.035 2.182 22.435 1.00 18.22 ? 722 ALA D N 1 ATOM 4002 C CA . ALA H 2 122 ? -12.917 1.069 22.847 1.00 18.69 ? 722 ALA D CA 1 ATOM 4003 C C . ALA H 2 122 ? -13.917 0.789 21.778 1.00 20.38 ? 722 ALA D C 1 ATOM 4004 O O . ALA H 2 122 ? -13.916 1.439 20.770 1.00 16.70 ? 722 ALA D O 1 ATOM 4005 C CB . ALA H 2 122 ? -13.677 1.448 24.103 1.00 19.77 ? 722 ALA D CB 1 ATOM 4006 N N . SER H 2 123 ? -14.744 -0.240 21.975 1.00 17.66 ? 723 SER D N 1 ATOM 4007 C CA . SER H 2 123 ? -15.826 -0.492 21.037 1.00 16.20 ? 723 SER D CA 1 ATOM 4008 C C . SER H 2 123 ? -17.064 -0.576 21.902 1.00 19.24 ? 723 SER D C 1 ATOM 4009 O O . SER H 2 123 ? -16.957 -0.820 23.118 1.00 21.30 ? 723 SER D O 1 ATOM 4010 C CB A SER H 2 123 ? -15.643 -1.811 20.282 0.51 17.85 ? 723 SER D CB 1 ATOM 4011 C CB B SER H 2 123 ? -15.558 -1.861 20.384 0.49 24.62 ? 723 SER D CB 1 ATOM 4012 O OG A SER H 2 123 ? -15.298 -2.866 21.154 0.51 15.44 ? 723 SER D OG 1 ATOM 4013 O OG B SER H 2 123 ? -14.631 -1.652 19.328 0.49 30.68 ? 723 SER D OG 1 ATOM 4014 N N . VAL H 2 124 ? -18.219 -0.382 21.317 1.00 17.52 ? 724 VAL D N 1 ATOM 4015 C CA . VAL H 2 124 ? -19.458 -0.434 22.117 1.00 20.49 ? 724 VAL D CA 1 ATOM 4016 C C . VAL H 2 124 ? -20.650 -0.834 21.250 1.00 25.38 ? 724 VAL D C 1 ATOM 4017 O O . VAL H 2 124 ? -20.578 -0.736 20.000 1.00 26.02 ? 724 VAL D O 1 ATOM 4018 C CB A VAL H 2 124 ? -19.740 0.931 22.793 0.61 23.93 ? 724 VAL D CB 1 ATOM 4019 C CB B VAL H 2 124 ? -19.851 1.098 22.887 0.39 25.39 ? 724 VAL D CB 1 ATOM 4020 C CG1 A VAL H 2 124 ? -20.095 2.014 21.730 0.61 22.62 ? 724 VAL D CG1 1 ATOM 4021 C CG1 B VAL H 2 124 ? -21.195 1.002 23.609 0.39 30.53 ? 724 VAL D CG1 1 ATOM 4022 C CG2 A VAL H 2 124 ? -20.831 0.749 23.846 0.61 31.60 ? 724 VAL D CG2 1 ATOM 4023 C CG2 B VAL H 2 124 ? -18.752 1.509 23.857 0.39 22.72 ? 724 VAL D CG2 1 ATOM 4024 O OXT . VAL H 2 124 ? -21.684 -1.257 21.865 1.00 29.18 ? 724 VAL D OXT 1 HETATM 4025 P P . PO4 I 3 . ? 1.629 36.536 3.184 1.00 15.56 ? 804 PO4 P P 1 HETATM 4026 O O1 . PO4 I 3 . ? 2.852 36.174 3.985 1.00 22.47 ? 804 PO4 P O1 1 HETATM 4027 O O2 . PO4 I 3 . ? 0.391 36.161 3.937 1.00 14.08 ? 804 PO4 P O2 1 HETATM 4028 O O3 . PO4 I 3 . ? 1.706 35.782 1.860 1.00 22.96 ? 804 PO4 P O3 1 HETATM 4029 O O4 . PO4 I 3 . ? 1.606 37.983 2.923 1.00 14.31 ? 804 PO4 P O4 1 HETATM 4030 P P . PO4 J 3 . ? 38.276 1.355 2.282 1.00 15.53 ? 801 PO4 A P 1 HETATM 4031 O O1 . PO4 J 3 . ? 38.743 2.084 1.101 1.00 24.46 ? 801 PO4 A O1 1 HETATM 4032 O O2 . PO4 J 3 . ? 38.927 1.896 3.523 1.00 13.28 ? 801 PO4 A O2 1 HETATM 4033 O O3 . PO4 J 3 . ? 38.563 -0.120 2.092 1.00 14.13 ? 801 PO4 A O3 1 HETATM 4034 O O4 . PO4 J 3 . ? 36.788 1.550 2.400 1.00 19.91 ? 801 PO4 A O4 1 HETATM 4035 C C1 . GOL K 4 . ? 42.113 16.020 -1.032 1.00 50.36 ? 904 GOL A C1 1 HETATM 4036 O O1 . GOL K 4 . ? 41.263 14.820 -0.346 1.00 49.96 ? 904 GOL A O1 1 HETATM 4037 C C2 . GOL K 4 . ? 43.787 15.815 -0.955 1.00 50.18 ? 904 GOL A C2 1 HETATM 4038 O O2 . GOL K 4 . ? 44.468 16.018 -2.287 1.00 40.23 ? 904 GOL A O2 1 HETATM 4039 C C3 . GOL K 4 . ? 44.473 16.550 0.304 1.00 52.64 ? 904 GOL A C3 1 HETATM 4040 O O3 . GOL K 4 . ? 44.548 18.068 0.110 1.00 58.10 ? 904 GOL A O3 1 HETATM 4041 C C1 . GOL L 4 . ? 52.317 0.317 22.503 1.00 50.77 ? 908 GOL A C1 1 HETATM 4042 O O1 . GOL L 4 . ? 53.172 1.184 21.554 1.00 57.77 ? 908 GOL A O1 1 HETATM 4043 C C2 . GOL L 4 . ? 50.746 0.334 21.988 1.00 46.83 ? 908 GOL A C2 1 HETATM 4044 O O2 . GOL L 4 . ? 49.912 -0.428 22.974 1.00 46.32 ? 908 GOL A O2 1 HETATM 4045 C C3 . GOL L 4 . ? 50.153 1.809 21.635 1.00 38.41 ? 908 GOL A C3 1 HETATM 4046 O O3 . GOL L 4 . ? 48.930 2.009 22.284 1.00 39.49 ? 908 GOL A O3 1 HETATM 4047 C C1 . GOL M 4 . ? 58.953 -8.008 12.717 1.00 54.27 ? 911 GOL A C1 1 HETATM 4048 O O1 . GOL M 4 . ? 58.333 -8.562 11.467 1.00 56.98 ? 911 GOL A O1 1 HETATM 4049 C C2 . GOL M 4 . ? 58.038 -6.852 13.205 1.00 52.79 ? 911 GOL A C2 1 HETATM 4050 O O2 . GOL M 4 . ? 56.891 -7.497 13.888 1.00 55.53 ? 911 GOL A O2 1 HETATM 4051 C C3 . GOL M 4 . ? 58.848 -5.656 14.056 1.00 51.90 ? 911 GOL A C3 1 HETATM 4052 O O3 . GOL M 4 . ? 59.368 -6.102 15.627 1.00 44.83 ? 911 GOL A O3 1 HETATM 4053 C C1 . GOL N 4 . ? 33.677 -2.876 -4.978 1.00 51.30 ? 915 GOL A C1 1 HETATM 4054 O O1 . GOL N 4 . ? 34.134 -2.102 -3.882 1.00 47.55 ? 915 GOL A O1 1 HETATM 4055 C C2 . GOL N 4 . ? 34.266 -2.225 -6.321 1.00 53.16 ? 915 GOL A C2 1 HETATM 4056 O O2 . GOL N 4 . ? 35.678 -2.669 -6.403 1.00 44.93 ? 915 GOL A O2 1 HETATM 4057 C C3 . GOL N 4 . ? 33.324 -2.639 -7.613 1.00 52.57 ? 915 GOL A C3 1 HETATM 4058 O O3 . GOL N 4 . ? 34.104 -2.755 -8.954 1.00 53.79 ? 915 GOL A O3 1 HETATM 4059 C C1 . GOL O 4 . ? 45.555 -18.219 6.309 1.00 49.77 ? 918 GOL A C1 1 HETATM 4060 O O1 . GOL O 4 . ? 45.068 -18.710 5.146 1.00 39.44 ? 918 GOL A O1 1 HETATM 4061 C C2 . GOL O 4 . ? 46.258 -19.296 7.120 1.00 52.84 ? 918 GOL A C2 1 HETATM 4062 O O2 . GOL O 4 . ? 46.830 -20.446 6.062 1.00 54.51 ? 918 GOL A O2 1 HETATM 4063 C C3 . GOL O 4 . ? 47.164 -18.604 8.267 1.00 51.49 ? 918 GOL A C3 1 HETATM 4064 O O3 . GOL O 4 . ? 47.677 -17.195 7.768 1.00 53.57 ? 918 GOL A O3 1 HETATM 4065 C C1 . GOL P 4 . ? 57.025 -0.216 17.746 1.00 46.96 ? 923 GOL A C1 1 HETATM 4066 O O1 . GOL P 4 . ? 57.824 -1.592 18.169 1.00 53.02 ? 923 GOL A O1 1 HETATM 4067 C C2 . GOL P 4 . ? 56.618 -0.050 16.128 1.00 45.89 ? 923 GOL A C2 1 HETATM 4068 O O2 . GOL P 4 . ? 57.260 1.241 15.428 1.00 40.98 ? 923 GOL A O2 1 HETATM 4069 C C3 . GOL P 4 . ? 56.909 -1.184 15.255 1.00 45.45 ? 923 GOL A C3 1 HETATM 4070 O O3 . GOL P 4 . ? 56.348 -2.474 15.592 1.00 47.32 ? 923 GOL A O3 1 HETATM 4071 P P . PO4 Q 3 . ? 33.381 35.469 19.808 1.00 16.18 ? 802 PO4 B P 1 HETATM 4072 O O1 . PO4 Q 3 . ? 33.320 36.951 20.005 1.00 12.91 ? 802 PO4 B O1 1 HETATM 4073 O O2 . PO4 Q 3 . ? 32.165 35.008 19.087 1.00 21.98 ? 802 PO4 B O2 1 HETATM 4074 O O3 . PO4 Q 3 . ? 33.406 34.758 21.158 1.00 22.46 ? 802 PO4 B O3 1 HETATM 4075 O O4 . PO4 Q 3 . ? 34.602 35.111 19.012 1.00 14.38 ? 802 PO4 B O4 1 HETATM 4076 C C1 . GOL R 4 . ? 46.823 53.407 24.291 1.00 52.66 ? 902 GOL B C1 1 HETATM 4077 O O1 . GOL R 4 . ? 47.755 54.033 23.269 1.00 55.81 ? 902 GOL B O1 1 HETATM 4078 C C2 . GOL R 4 . ? 46.384 51.882 23.879 1.00 50.41 ? 902 GOL B C2 1 HETATM 4079 O O2 . GOL R 4 . ? 44.800 51.667 23.776 1.00 47.92 ? 902 GOL B O2 1 HETATM 4080 C C3 . GOL R 4 . ? 47.436 50.981 23.007 1.00 47.33 ? 902 GOL B C3 1 HETATM 4081 O O3 . GOL R 4 . ? 47.560 49.454 23.658 1.00 36.19 ? 902 GOL B O3 1 HETATM 4082 C C1 . GOL S 4 . ? 34.982 34.015 6.959 1.00 27.88 ? 905 GOL B C1 1 HETATM 4083 O O1 . GOL S 4 . ? 36.294 33.870 5.894 1.00 30.78 ? 905 GOL B O1 1 HETATM 4084 C C2 . GOL S 4 . ? 33.518 34.396 6.490 1.00 34.35 ? 905 GOL B C2 1 HETATM 4085 O O2 . GOL S 4 . ? 32.380 33.512 6.837 1.00 36.05 ? 905 GOL B O2 1 HETATM 4086 C C3 . GOL S 4 . ? 33.146 35.901 6.499 1.00 38.77 ? 905 GOL B C3 1 HETATM 4087 O O3 . GOL S 4 . ? 32.225 36.341 5.498 1.00 36.41 ? 905 GOL B O3 1 HETATM 4088 C C1 . GOL T 4 . ? 41.202 54.825 18.519 1.00 45.18 ? 906 GOL B C1 1 HETATM 4089 O O1 . GOL T 4 . ? 41.932 54.862 19.817 1.00 28.96 ? 906 GOL B O1 1 HETATM 4090 C C2 . GOL T 4 . ? 40.958 56.204 17.919 1.00 45.68 ? 906 GOL B C2 1 HETATM 4091 O O2 . GOL T 4 . ? 42.266 56.526 17.184 1.00 51.86 ? 906 GOL B O2 1 HETATM 4092 C C3 . GOL T 4 . ? 39.740 56.202 16.995 1.00 42.88 ? 906 GOL B C3 1 HETATM 4093 O O3 . GOL T 4 . ? 38.392 56.303 17.821 1.00 33.41 ? 906 GOL B O3 1 HETATM 4094 C C1 . GOL U 4 . ? 44.154 36.289 31.532 1.00 44.24 ? 907 GOL B C1 1 HETATM 4095 O O1 . GOL U 4 . ? 45.150 37.337 31.801 1.00 44.82 ? 907 GOL B O1 1 HETATM 4096 C C2 . GOL U 4 . ? 44.929 34.887 31.321 1.00 48.53 ? 907 GOL B C2 1 HETATM 4097 O O2 . GOL U 4 . ? 45.713 34.972 30.127 1.00 37.05 ? 907 GOL B O2 1 HETATM 4098 C C3 . GOL U 4 . ? 43.982 33.596 31.359 1.00 42.48 ? 907 GOL B C3 1 HETATM 4099 O O3 . GOL U 4 . ? 42.987 33.906 30.248 1.00 34.94 ? 907 GOL B O3 1 HETATM 4100 C C1 . GOL V 4 . ? 38.970 24.544 12.847 1.00 37.70 ? 910 GOL B C1 1 HETATM 4101 O O1 . GOL V 4 . ? 39.796 23.827 11.607 1.00 15.86 ? 910 GOL B O1 1 HETATM 4102 C C2 . GOL V 4 . ? 38.182 23.889 14.026 1.00 26.52 ? 910 GOL B C2 1 HETATM 4103 O O2 . GOL V 4 . ? 36.835 24.140 13.731 1.00 45.92 ? 910 GOL B O2 1 HETATM 4104 C C3 . GOL V 4 . ? 38.171 22.392 13.908 1.00 44.63 ? 910 GOL B C3 1 HETATM 4105 O O3 . GOL V 4 . ? 37.207 21.803 14.948 1.00 40.06 ? 910 GOL B O3 1 HETATM 4106 C C1 . GOL W 4 . ? 24.127 40.211 22.899 1.00 45.70 ? 914 GOL B C1 1 HETATM 4107 O O1 . GOL W 4 . ? 23.233 41.356 22.093 1.00 50.92 ? 914 GOL B O1 1 HETATM 4108 C C2 . GOL W 4 . ? 25.403 39.448 22.032 1.00 45.04 ? 914 GOL B C2 1 HETATM 4109 O O2 . GOL W 4 . ? 25.513 40.016 20.758 1.00 42.77 ? 914 GOL B O2 1 HETATM 4110 C C3 . GOL W 4 . ? 26.815 39.385 22.931 1.00 36.62 ? 914 GOL B C3 1 HETATM 4111 O O3 . GOL W 4 . ? 28.113 38.600 22.433 1.00 43.13 ? 914 GOL B O3 1 HETATM 4112 C C1 . GOL X 4 . ? 33.561 21.300 14.364 1.00 44.86 ? 920 GOL B C1 1 HETATM 4113 O O1 . GOL X 4 . ? 34.474 20.683 13.106 1.00 45.37 ? 920 GOL B O1 1 HETATM 4114 C C2 . GOL X 4 . ? 33.877 22.993 14.568 1.00 41.17 ? 920 GOL B C2 1 HETATM 4115 O O2 . GOL X 4 . ? 32.599 23.669 14.627 1.00 42.44 ? 920 GOL B O2 1 HETATM 4116 C C3 . GOL X 4 . ? 34.725 23.215 15.899 1.00 42.81 ? 920 GOL B C3 1 HETATM 4117 O O3 . GOL X 4 . ? 34.699 24.728 16.606 1.00 37.14 ? 920 GOL B O3 1 HETATM 4118 C C1 . GOL Y 4 . ? 55.517 33.520 15.106 1.00 41.36 ? 921 GOL B C1 1 HETATM 4119 O O1 . GOL Y 4 . ? 54.132 33.799 14.503 1.00 34.49 ? 921 GOL B O1 1 HETATM 4120 C C2 . GOL Y 4 . ? 55.390 32.479 16.327 1.00 42.63 ? 921 GOL B C2 1 HETATM 4121 O O2 . GOL Y 4 . ? 56.519 32.696 17.225 1.00 43.77 ? 921 GOL B O2 1 HETATM 4122 C C3 . GOL Y 4 . ? 55.080 30.982 15.949 1.00 40.12 ? 921 GOL B C3 1 HETATM 4123 O O3 . GOL Y 4 . ? 53.793 30.134 16.890 1.00 23.00 ? 921 GOL B O3 1 HETATM 4124 C C1 . GOL Z 4 . ? 28.307 34.697 6.987 1.00 54.32 ? 922 GOL B C1 1 HETATM 4125 O O1 . GOL Z 4 . ? 29.294 35.057 5.752 1.00 57.90 ? 922 GOL B O1 1 HETATM 4126 C C2 . GOL Z 4 . ? 27.221 35.969 7.359 1.00 52.26 ? 922 GOL B C2 1 HETATM 4127 O O2 . GOL Z 4 . ? 26.625 35.881 8.844 1.00 49.02 ? 922 GOL B O2 1 HETATM 4128 C C3 . GOL Z 4 . ? 27.801 37.253 7.176 1.00 50.47 ? 922 GOL B C3 1 HETATM 4129 O O3 . GOL Z 4 . ? 27.766 37.799 5.728 1.00 51.49 ? 922 GOL B O3 1 HETATM 4130 P P . PO4 AA 3 . ? -3.613 2.195 20.904 1.00 17.42 ? 803 PO4 C P 1 HETATM 4131 O O1 . PO4 AA 3 . ? -4.055 2.946 22.120 1.00 24.42 ? 803 PO4 C O1 1 HETATM 4132 O O2 . PO4 AA 3 . ? -3.964 0.706 21.057 1.00 14.61 ? 803 PO4 C O2 1 HETATM 4133 O O3 . PO4 AA 3 . ? -2.105 2.320 20.774 1.00 19.52 ? 803 PO4 C O3 1 HETATM 4134 O O4 . PO4 AA 3 . ? -4.245 2.781 19.694 1.00 15.55 ? 803 PO4 C O4 1 HETATM 4135 C C1 . GOL BA 4 . ? 0.456 -2.259 29.123 1.00 53.26 ? 903 GOL C C1 1 HETATM 4136 O O1 . GOL BA 4 . ? -1.023 -2.059 28.947 1.00 46.79 ? 903 GOL C O1 1 HETATM 4137 C C2 . GOL BA 4 . ? 0.849 -1.835 30.781 1.00 52.83 ? 903 GOL C C2 1 HETATM 4138 O O2 . GOL BA 4 . ? -0.289 -1.238 31.386 1.00 54.64 ? 903 GOL C O2 1 HETATM 4139 C C3 . GOL BA 4 . ? 1.415 -2.961 31.697 1.00 53.98 ? 903 GOL C C3 1 HETATM 4140 O O3 . GOL BA 4 . ? 0.392 -3.229 32.892 1.00 48.85 ? 903 GOL C O3 1 HETATM 4141 C C1 . GOL CA 4 . ? -22.409 -7.598 8.868 1.00 59.47 ? 912 GOL C C1 1 HETATM 4142 O O1 . GOL CA 4 . ? -22.746 -8.521 10.097 1.00 64.15 ? 912 GOL C O1 1 HETATM 4143 C C2 . GOL CA 4 . ? -23.487 -6.333 8.635 1.00 57.48 ? 912 GOL C C2 1 HETATM 4144 O O2 . GOL CA 4 . ? -24.629 -6.443 9.519 1.00 52.69 ? 912 GOL C O2 1 HETATM 4145 C C3 . GOL CA 4 . ? -22.807 -4.888 8.626 1.00 56.26 ? 912 GOL C C3 1 HETATM 4146 O O3 . GOL CA 4 . ? -22.731 -4.303 10.034 1.00 51.84 ? 912 GOL C O3 1 HETATM 4147 C C1 . GOL DA 4 . ? -14.811 -16.792 14.637 1.00 51.67 ? 917 GOL C C1 1 HETATM 4148 O O1 . GOL DA 4 . ? -14.354 -17.679 13.458 1.00 57.87 ? 917 GOL C O1 1 HETATM 4149 C C2 . GOL DA 4 . ? -13.538 -16.319 15.363 1.00 49.09 ? 917 GOL C C2 1 HETATM 4150 O O2 . GOL DA 4 . ? -12.492 -16.138 14.427 1.00 51.23 ? 917 GOL C O2 1 HETATM 4151 C C3 . GOL DA 4 . ? -13.687 -15.227 16.467 1.00 47.42 ? 917 GOL C C3 1 HETATM 4152 O O3 . GOL DA 4 . ? -15.241 -14.968 17.069 1.00 37.90 ? 917 GOL C O3 1 HETATM 4153 C C1 . GOL EA 4 . ? -15.281 1.403 0.488 1.00 38.57 ? 919 GOL C C1 1 HETATM 4154 O O1 . GOL EA 4 . ? -16.749 1.206 1.033 1.00 43.60 ? 919 GOL C O1 1 HETATM 4155 C C2 . GOL EA 4 . ? -14.762 2.965 0.480 1.00 43.87 ? 919 GOL C C2 1 HETATM 4156 O O2 . GOL EA 4 . ? -15.091 3.553 1.672 1.00 37.26 ? 919 GOL C O2 1 HETATM 4157 C C3 . GOL EA 4 . ? -13.314 2.826 0.499 1.00 44.84 ? 919 GOL C C3 1 HETATM 4158 O O3 . GOL EA 4 . ? -12.523 3.861 0.065 1.00 46.22 ? 919 GOL C O3 1 HETATM 4159 C C1 . GOL FA 4 . ? -3.796 14.939 9.411 1.00 38.66 ? 901 GOL D C1 1 HETATM 4160 O O1 . GOL FA 4 . ? -4.415 14.310 8.091 1.00 28.44 ? 901 GOL D O1 1 HETATM 4161 C C2 . GOL FA 4 . ? -2.820 14.195 10.467 1.00 42.15 ? 901 GOL D C2 1 HETATM 4162 O O2 . GOL FA 4 . ? -3.317 14.415 12.045 1.00 37.26 ? 901 GOL D O2 1 HETATM 4163 C C3 . GOL FA 4 . ? -1.974 12.922 10.029 1.00 39.29 ? 901 GOL D C3 1 HETATM 4164 O O3 . GOL FA 4 . ? -2.573 12.144 8.574 1.00 32.03 ? 901 GOL D O3 1 HETATM 4165 C C1 . GOL GA 4 . ? -0.486 22.762 9.096 1.00 56.13 ? 909 GOL D C1 1 HETATM 4166 O O1 . GOL GA 4 . ? -1.860 22.870 8.776 1.00 49.08 ? 909 GOL D O1 1 HETATM 4167 C C2 . GOL GA 4 . ? 0.342 22.177 7.886 1.00 56.99 ? 909 GOL D C2 1 HETATM 4168 O O2 . GOL GA 4 . ? 1.735 22.740 8.074 1.00 59.31 ? 909 GOL D O2 1 HETATM 4169 C C3 . GOL GA 4 . ? -0.363 22.526 6.450 1.00 55.22 ? 909 GOL D C3 1 HETATM 4170 O O3 . GOL GA 4 . ? 0.315 21.906 5.255 1.00 55.35 ? 909 GOL D O3 1 HETATM 4171 C C1 . GOL HA 4 . ? -12.224 52.918 -0.659 1.00 48.82 ? 913 GOL D C1 1 HETATM 4172 O O1 . GOL HA 4 . ? -10.589 52.504 -0.904 1.00 47.05 ? 913 GOL D O1 1 HETATM 4173 C C2 . GOL HA 4 . ? -13.006 51.599 -0.117 1.00 48.02 ? 913 GOL D C2 1 HETATM 4174 O O2 . GOL HA 4 . ? -14.550 51.657 0.564 1.00 44.13 ? 913 GOL D O2 1 HETATM 4175 C C3 . GOL HA 4 . ? -12.639 50.383 -0.989 1.00 45.89 ? 913 GOL D C3 1 HETATM 4176 O O3 . GOL HA 4 . ? -13.589 49.640 -1.105 1.00 40.43 ? 913 GOL D O3 1 HETATM 4177 C C1 . GOL IA 4 . ? -5.741 57.504 5.510 1.00 48.12 ? 916 GOL D C1 1 HETATM 4178 O O1 . GOL IA 4 . ? -4.388 57.050 4.989 1.00 36.43 ? 916 GOL D O1 1 HETATM 4179 C C2 . GOL IA 4 . ? -6.944 56.422 5.431 1.00 46.22 ? 916 GOL D C2 1 HETATM 4180 O O2 . GOL IA 4 . ? -7.707 56.752 6.617 1.00 54.21 ? 916 GOL D O2 1 HETATM 4181 C C3 . GOL IA 4 . ? -7.862 56.647 4.196 1.00 46.01 ? 916 GOL D C3 1 HETATM 4182 O O3 . GOL IA 4 . ? -7.730 55.525 3.053 1.00 31.90 ? 916 GOL D O3 1 HETATM 4183 C C1 . GOL JA 4 . ? -20.933 36.162 8.383 1.00 42.79 ? 924 GOL D C1 1 HETATM 4184 O O1 . GOL JA 4 . ? -20.645 37.657 7.366 1.00 30.84 ? 924 GOL D O1 1 HETATM 4185 C C2 . GOL JA 4 . ? -20.129 34.707 7.696 1.00 44.32 ? 924 GOL D C2 1 HETATM 4186 O O2 . GOL JA 4 . ? -18.981 34.231 8.601 1.00 35.27 ? 924 GOL D O2 1 HETATM 4187 C C3 . GOL JA 4 . ? -21.083 33.444 7.519 1.00 47.47 ? 924 GOL D C3 1 HETATM 4188 O O3 . GOL JA 4 . ? -21.209 32.979 5.986 1.00 51.28 ? 924 GOL D O3 1 HETATM 4189 O O . HOH KA 5 . ? 49.111 -4.189 -5.977 1.00 30.16 ? 1214 HOH M O 1 HETATM 4190 O O . HOH KA 5 . ? 44.252 -0.472 -6.895 1.00 29.33 ? 1394 HOH M O 1 HETATM 4191 O O . HOH KA 5 . ? 49.184 -5.056 -1.754 1.00 30.25 ? 1441 HOH M O 1 HETATM 4192 O O . HOH LA 5 . ? 38.775 39.666 30.769 1.00 23.98 ? 1118 HOH N O 1 HETATM 4193 O O . HOH LA 5 . ? 37.097 44.718 32.223 1.00 27.77 ? 1153 HOH N O 1 HETATM 4194 O O . HOH LA 5 . ? 32.791 50.846 27.055 1.00 26.72 ? 1218 HOH N O 1 HETATM 4195 O O . HOH LA 5 . ? 32.096 39.762 25.809 1.00 24.49 ? 1234 HOH N O 1 HETATM 4196 O O . HOH LA 5 . ? 37.665 47.536 28.739 1.00 29.19 ? 1241 HOH N O 1 HETATM 4197 O O . HOH LA 5 . ? 37.922 47.385 31.659 1.00 28.12 ? 1246 HOH N O 1 HETATM 4198 O O . HOH LA 5 . ? 39.224 42.614 29.865 1.00 33.58 ? 1480 HOH N O 1 HETATM 4199 O O . HOH MA 5 . ? -8.157 -4.858 29.062 1.00 24.69 ? 1211 HOH O O 1 HETATM 4200 O O . HOH MA 5 . ? -15.541 -10.169 26.458 1.00 28.78 ? 1284 HOH O O 1 HETATM 4201 O O . HOH MA 5 . ? -14.791 -3.957 24.885 1.00 31.43 ? 1478 HOH O O 1 HETATM 4202 O O . HOH NA 5 . ? 0.447 35.068 6.527 1.00 16.47 ? 1029 HOH P O 1 HETATM 4203 O O . HOH NA 5 . ? -3.981 40.278 -7.785 1.00 22.66 ? 1132 HOH P O 1 HETATM 4204 O O . HOH NA 5 . ? -2.934 48.368 -5.859 1.00 33.50 ? 1145 HOH P O 1 HETATM 4205 O O . HOH NA 5 . ? 2.651 40.873 -2.850 1.00 25.97 ? 1160 HOH P O 1 HETATM 4206 O O . HOH NA 5 . ? -2.390 45.511 -9.162 1.00 26.49 ? 1217 HOH P O 1 HETATM 4207 O O . HOH NA 5 . ? 2.733 33.630 4.923 1.00 28.72 ? 1273 HOH P O 1 HETATM 4208 O O . HOH NA 5 . ? -3.500 48.082 -8.814 1.00 28.28 ? 1305 HOH P O 1 HETATM 4209 O O . HOH OA 5 . ? 35.121 -13.251 -6.403 1.00 13.74 ? 1002 HOH A O 1 HETATM 4210 O O . HOH OA 5 . ? 37.575 2.845 5.772 1.00 12.40 ? 1004 HOH A O 1 HETATM 4211 O O . HOH OA 5 . ? 32.847 -8.686 -4.980 1.00 17.26 ? 1008 HOH A O 1 HETATM 4212 O O . HOH OA 5 . ? 36.954 -10.193 -6.118 1.00 17.32 ? 1013 HOH A O 1 HETATM 4213 O O . HOH OA 5 . ? 39.820 31.005 12.323 1.00 15.45 ? 1014 HOH A O 1 HETATM 4214 O O . HOH OA 5 . ? 44.620 -13.024 0.924 1.00 16.23 ? 1016 HOH A O 1 HETATM 4215 O O . HOH OA 5 . ? 55.257 3.456 12.184 1.00 19.49 ? 1017 HOH A O 1 HETATM 4216 O O . HOH OA 5 . ? 39.835 6.457 14.838 1.00 16.37 ? 1019 HOH A O 1 HETATM 4217 O O . HOH OA 5 . ? 39.143 -16.706 5.124 1.00 15.18 ? 1030 HOH A O 1 HETATM 4218 O O . HOH OA 5 . ? 38.530 8.701 15.671 1.00 21.71 ? 1035 HOH A O 1 HETATM 4219 O O . HOH OA 5 . ? 54.249 1.929 14.245 1.00 20.61 ? 1039 HOH A O 1 HETATM 4220 O O . HOH OA 5 . ? 34.518 -8.605 14.583 1.00 15.78 ? 1044 HOH A O 1 HETATM 4221 O O . HOH OA 5 . ? 28.408 -9.054 6.861 1.00 18.35 ? 1049 HOH A O 1 HETATM 4222 O O . HOH OA 5 . ? 50.592 -1.565 18.200 1.00 18.85 ? 1053 HOH A O 1 HETATM 4223 O O . HOH OA 5 . ? 20.789 -7.549 1.579 1.00 18.94 ? 1054 HOH A O 1 HETATM 4224 O O . HOH OA 5 . ? 52.613 4.202 14.605 1.00 19.57 ? 1059 HOH A O 1 HETATM 4225 O O . HOH OA 5 . ? 42.445 -18.583 3.617 1.00 18.49 ? 1062 HOH A O 1 HETATM 4226 O O . HOH OA 5 . ? 37.715 -3.727 -2.047 1.00 18.79 ? 1064 HOH A O 1 HETATM 4227 O O . HOH OA 5 . ? 47.166 -4.887 2.294 1.00 22.36 ? 1065 HOH A O 1 HETATM 4228 O O . HOH OA 5 . ? 28.527 -9.229 -4.079 1.00 20.28 ? 1069 HOH A O 1 HETATM 4229 O O . HOH OA 5 . ? 31.622 -14.039 11.605 1.00 21.27 ? 1075 HOH A O 1 HETATM 4230 O O . HOH OA 5 . ? 35.861 31.767 27.545 1.00 21.46 ? 1076 HOH A O 1 HETATM 4231 O O . HOH OA 5 . ? 26.231 -12.177 3.282 1.00 21.35 ? 1077 HOH A O 1 HETATM 4232 O O . HOH OA 5 . ? 31.699 28.989 16.381 1.00 27.96 ? 1084 HOH A O 1 HETATM 4233 O O . HOH OA 5 . ? 53.857 9.113 14.796 1.00 22.63 ? 1085 HOH A O 1 HETATM 4234 O O . HOH OA 5 . ? 35.061 10.903 10.917 1.00 23.57 ? 1089 HOH A O 1 HETATM 4235 O O . HOH OA 5 . ? 28.811 -11.923 -5.017 1.00 19.31 ? 1094 HOH A O 1 HETATM 4236 O O . HOH OA 5 . ? 29.921 6.580 14.160 1.00 27.32 ? 1095 HOH A O 1 HETATM 4237 O O . HOH OA 5 . ? 41.548 -15.199 -3.781 1.00 20.39 ? 1096 HOH A O 1 HETATM 4238 O O . HOH OA 5 . ? 40.512 5.421 -3.834 1.00 41.79 ? 1097 HOH A O 1 HETATM 4239 O O . HOH OA 5 . ? 60.430 4.312 7.521 1.00 25.19 ? 1099 HOH A O 1 HETATM 4240 O O . HOH OA 5 . ? 39.753 -5.408 18.084 1.00 22.23 ? 1101 HOH A O 1 HETATM 4241 O O . HOH OA 5 . ? 33.250 -6.744 -6.822 1.00 23.28 ? 1105 HOH A O 1 HETATM 4242 O O . HOH OA 5 . ? 33.573 30.762 15.599 1.00 19.57 ? 1106 HOH A O 1 HETATM 4243 O O . HOH OA 5 . ? 39.822 -18.704 -6.236 1.00 22.47 ? 1115 HOH A O 1 HETATM 4244 O O . HOH OA 5 . ? 29.639 -13.432 4.802 1.00 24.52 ? 1119 HOH A O 1 HETATM 4245 O O . HOH OA 5 . ? 48.478 11.262 14.113 1.00 27.46 ? 1121 HOH A O 1 HETATM 4246 O O . HOH OA 5 . ? 32.338 -14.030 4.874 1.00 22.70 ? 1126 HOH A O 1 HETATM 4247 O O . HOH OA 5 . ? 31.455 -12.405 -5.634 1.00 27.31 ? 1127 HOH A O 1 HETATM 4248 O O . HOH OA 5 . ? 60.608 -0.008 7.988 1.00 22.95 ? 1128 HOH A O 1 HETATM 4249 O O . HOH OA 5 . ? 37.402 -20.588 -5.424 1.00 24.88 ? 1133 HOH A O 1 HETATM 4250 O O . HOH OA 5 . ? 57.728 -2.898 13.056 1.00 28.29 ? 1140 HOH A O 1 HETATM 4251 O O . HOH OA 5 . ? 36.517 32.371 23.935 1.00 26.89 ? 1142 HOH A O 1 HETATM 4252 O O . HOH OA 5 . ? 47.136 13.752 8.433 1.00 25.94 ? 1149 HOH A O 1 HETATM 4253 O O . HOH OA 5 . ? 41.065 16.676 6.031 1.00 24.43 ? 1156 HOH A O 1 HETATM 4254 O O . HOH OA 5 . ? 59.492 5.696 5.509 1.00 28.28 ? 1164 HOH A O 1 HETATM 4255 O O . HOH OA 5 . ? 40.016 21.157 7.069 1.00 28.12 ? 1171 HOH A O 1 HETATM 4256 O O . HOH OA 5 . ? 36.402 22.550 8.258 1.00 27.49 ? 1172 HOH A O 1 HETATM 4257 O O . HOH OA 5 . ? 48.565 8.167 18.204 1.00 26.90 ? 1173 HOH A O 1 HETATM 4258 O O . HOH OA 5 . ? 41.722 3.608 -6.523 1.00 50.60 ? 1176 HOH A O 1 HETATM 4259 O O . HOH OA 5 . ? 40.114 41.895 27.262 1.00 25.79 ? 1181 HOH A O 1 HETATM 4260 O O . HOH OA 5 . ? 36.016 30.131 25.290 1.00 25.92 ? 1188 HOH A O 1 HETATM 4261 O O . HOH OA 5 . ? 43.865 19.071 14.435 1.00 25.46 ? 1197 HOH A O 1 HETATM 4262 O O . HOH OA 5 . ? 35.298 -5.685 -8.194 1.00 29.14 ? 1199 HOH A O 1 HETATM 4263 O O . HOH OA 5 . ? 57.679 3.655 5.430 1.00 23.28 ? 1201 HOH A O 1 HETATM 4264 O O . HOH OA 5 . ? 42.460 21.789 23.095 1.00 26.65 ? 1205 HOH A O 1 HETATM 4265 O O . HOH OA 5 . ? 39.446 -7.394 22.876 1.00 23.37 ? 1213 HOH A O 1 HETATM 4266 O O . HOH OA 5 . ? 54.122 9.185 -3.123 1.00 34.08 ? 1229 HOH A O 1 HETATM 4267 O O . HOH OA 5 . ? 38.121 5.826 18.493 1.00 27.42 ? 1236 HOH A O 1 HETATM 4268 O O . HOH OA 5 . ? 31.331 -3.465 1.985 1.00 43.03 ? 1238 HOH A O 1 HETATM 4269 O O . HOH OA 5 . ? 56.123 13.428 5.342 1.00 30.55 ? 1240 HOH A O 1 HETATM 4270 O O . HOH OA 5 . ? 25.760 -8.545 -4.231 1.00 25.23 ? 1242 HOH A O 1 HETATM 4271 O O . HOH OA 5 . ? 45.895 9.430 18.524 1.00 24.29 ? 1245 HOH A O 1 HETATM 4272 O O . HOH OA 5 . ? 43.267 -13.948 14.838 1.00 29.31 ? 1251 HOH A O 1 HETATM 4273 O O . HOH OA 5 . ? 35.132 0.445 1.019 1.00 32.50 ? 1252 HOH A O 1 HETATM 4274 O O . HOH OA 5 . ? 29.151 -12.765 12.549 1.00 26.81 ? 1258 HOH A O 1 HETATM 4275 O O . HOH OA 5 . ? 37.729 11.268 14.882 1.00 30.40 ? 1264 HOH A O 1 HETATM 4276 O O . HOH OA 5 . ? 40.794 12.073 17.636 1.00 31.60 ? 1265 HOH A O 1 HETATM 4277 O O . HOH OA 5 . ? 46.359 15.761 -6.204 1.00 35.79 ? 1279 HOH A O 1 HETATM 4278 O O . HOH OA 5 . ? 54.204 -5.120 14.227 1.00 31.97 ? 1280 HOH A O 1 HETATM 4279 O O . HOH OA 5 . ? 32.384 -1.068 3.069 1.00 28.13 ? 1282 HOH A O 1 HETATM 4280 O O . HOH OA 5 . ? 60.401 8.396 5.751 1.00 30.38 ? 1283 HOH A O 1 HETATM 4281 O O . HOH OA 5 . ? 39.867 9.363 18.030 1.00 32.29 ? 1290 HOH A O 1 HETATM 4282 O O . HOH OA 5 . ? 40.407 -13.726 15.173 1.00 29.39 ? 1299 HOH A O 1 HETATM 4283 O O . HOH OA 5 . ? 38.800 13.609 11.640 1.00 30.82 ? 1309 HOH A O 1 HETATM 4284 O O . HOH OA 5 . ? 39.671 -10.988 15.420 1.00 28.53 ? 1313 HOH A O 1 HETATM 4285 O O . HOH OA 5 . ? 37.245 15.987 10.692 1.00 32.67 ? 1316 HOH A O 1 HETATM 4286 O O . HOH OA 5 . ? 29.334 4.078 14.566 1.00 36.61 ? 1317 HOH A O 1 HETATM 4287 O O . HOH OA 5 . ? 29.795 -4.454 12.259 1.00 34.10 ? 1318 HOH A O 1 HETATM 4288 O O . HOH OA 5 . ? 34.924 33.987 23.862 1.00 31.88 ? 1323 HOH A O 1 HETATM 4289 O O . HOH OA 5 . ? 48.215 15.568 9.652 1.00 38.77 ? 1325 HOH A O 1 HETATM 4290 O O . HOH OA 5 . ? 40.414 23.792 7.207 1.00 30.71 ? 1326 HOH A O 1 HETATM 4291 O O . HOH OA 5 . ? 44.187 -22.354 9.587 1.00 31.44 ? 1329 HOH A O 1 HETATM 4292 O O . HOH OA 5 . ? 36.106 -2.032 -2.453 1.00 39.30 ? 1330 HOH A O 1 HETATM 4293 O O . HOH OA 5 . ? 33.960 6.992 4.597 1.00 27.17 ? 1333 HOH A O 1 HETATM 4294 O O . HOH OA 5 . ? 38.094 -19.676 2.294 1.00 35.10 ? 1336 HOH A O 1 HETATM 4295 O O . HOH OA 5 . ? 40.295 11.061 1.870 1.00 28.80 ? 1338 HOH A O 1 HETATM 4296 O O . HOH OA 5 . ? 42.087 10.712 -0.330 1.00 27.49 ? 1342 HOH A O 1 HETATM 4297 O O . HOH OA 5 . ? 43.903 -6.911 1.109 1.00 26.64 ? 1345 HOH A O 1 HETATM 4298 O O . HOH OA 5 . ? 33.835 9.284 15.016 1.00 32.42 ? 1352 HOH A O 1 HETATM 4299 O O . HOH OA 5 . ? 32.276 11.486 9.030 1.00 28.23 ? 1353 HOH A O 1 HETATM 4300 O O . HOH OA 5 . ? 46.822 22.173 13.437 1.00 29.27 ? 1359 HOH A O 1 HETATM 4301 O O . HOH OA 5 . ? 29.097 4.196 6.884 1.00 37.73 ? 1365 HOH A O 1 HETATM 4302 O O . HOH OA 5 . ? 62.403 -1.133 6.811 1.00 30.03 ? 1376 HOH A O 1 HETATM 4303 O O . HOH OA 5 . ? 50.499 -7.322 16.529 1.00 36.73 ? 1377 HOH A O 1 HETATM 4304 O O . HOH OA 5 . ? 37.462 -8.219 16.359 1.00 34.28 ? 1378 HOH A O 1 HETATM 4305 O O . HOH OA 5 . ? 27.390 -4.741 2.287 1.00 22.66 ? 1380 HOH A O 1 HETATM 4306 O O . HOH OA 5 . ? 43.033 11.119 17.687 1.00 33.57 ? 1388 HOH A O 1 HETATM 4307 O O . HOH OA 5 . ? 47.999 25.223 15.670 1.00 32.48 ? 1389 HOH A O 1 HETATM 4308 O O . HOH OA 5 . ? 35.958 -20.240 -1.445 1.00 29.10 ? 1392 HOH A O 1 HETATM 4309 O O . HOH OA 5 . ? 53.891 13.998 8.381 1.00 32.14 ? 1403 HOH A O 1 HETATM 4310 O O . HOH OA 5 . ? 31.148 1.796 13.333 1.00 27.23 ? 1404 HOH A O 1 HETATM 4311 O O . HOH OA 5 . ? 41.014 -17.152 12.699 1.00 29.99 ? 1405 HOH A O 1 HETATM 4312 O O . HOH OA 5 . ? 34.477 -19.896 9.862 1.00 31.08 ? 1406 HOH A O 1 HETATM 4313 O O . HOH OA 5 . ? 54.821 -9.660 4.750 1.00 36.56 ? 1408 HOH A O 1 HETATM 4314 O O . HOH OA 5 . ? 55.424 -5.695 11.756 1.00 30.93 ? 1412 HOH A O 1 HETATM 4315 O O . HOH OA 5 . ? 35.932 7.977 16.237 1.00 32.59 ? 1414 HOH A O 1 HETATM 4316 O O . HOH OA 5 . ? 30.944 -19.468 -1.502 1.00 35.28 ? 1421 HOH A O 1 HETATM 4317 O O . HOH OA 5 . ? 36.410 12.977 8.212 1.00 36.02 ? 1427 HOH A O 1 HETATM 4318 O O . HOH OA 5 . ? 48.743 -15.510 10.690 1.00 35.75 ? 1429 HOH A O 1 HETATM 4319 O O . HOH OA 5 . ? 59.604 2.028 4.305 1.00 36.68 ? 1432 HOH A O 1 HETATM 4320 O O . HOH OA 5 . ? 23.456 -12.133 3.758 1.00 35.24 ? 1433 HOH A O 1 HETATM 4321 O O . HOH OA 5 . ? 48.674 -11.061 0.105 1.00 33.24 ? 1448 HOH A O 1 HETATM 4322 O O . HOH OA 5 . ? 52.864 -11.517 10.560 1.00 42.15 ? 1454 HOH A O 1 HETATM 4323 O O . HOH OA 5 . ? 48.487 15.462 12.201 1.00 43.33 ? 1458 HOH A O 1 HETATM 4324 O O . HOH OA 5 . ? 33.746 -21.362 -8.475 1.00 32.56 ? 1467 HOH A O 1 HETATM 4325 O O . HOH OA 5 . ? 48.867 23.113 17.187 1.00 34.16 ? 1471 HOH A O 1 HETATM 4326 O O . HOH OA 5 . ? 34.281 -19.987 7.258 1.00 34.73 ? 1472 HOH A O 1 HETATM 4327 O O . HOH OA 5 . ? 24.140 -10.423 -5.769 1.00 34.39 ? 1474 HOH A O 1 HETATM 4328 O O . HOH OA 5 . ? 24.990 -13.457 -5.869 1.00 32.37 ? 1485 HOH A O 1 HETATM 4329 O O . HOH OA 5 . ? 25.834 -18.181 -2.878 1.00 34.37 ? 1486 HOH A O 1 HETATM 4330 O O . HOH OA 5 . ? 33.779 5.327 2.673 1.00 35.48 ? 1496 HOH A O 1 HETATM 4331 O O . HOH OA 5 . ? 49.667 10.638 17.035 1.00 34.67 ? 1499 HOH A O 1 HETATM 4332 O O . HOH OA 5 . ? 51.072 14.806 9.105 1.00 29.74 ? 1513 HOH A O 1 HETATM 4333 O O . HOH OA 5 . ? 33.302 29.424 24.155 1.00 38.43 ? 1518 HOH A O 1 HETATM 4334 O O . HOH OA 5 . ? 57.127 12.314 11.653 1.00 42.18 ? 1519 HOH A O 1 HETATM 4335 O O . HOH OA 5 . ? 34.984 18.764 8.770 1.00 34.95 ? 1523 HOH A O 1 HETATM 4336 O O . HOH OA 5 . ? 27.702 -1.577 10.381 1.00 38.83 ? 1524 HOH A O 1 HETATM 4337 O O . HOH OA 5 . ? 36.219 11.824 17.252 1.00 34.99 ? 1537 HOH A O 1 HETATM 4338 O O . HOH OA 5 . ? 40.443 13.395 20.021 1.00 44.31 ? 1538 HOH A O 1 HETATM 4339 O O . HOH OA 5 . ? 36.184 -10.486 15.988 1.00 34.45 ? 1539 HOH A O 1 HETATM 4340 O O . HOH OA 5 . ? 45.533 12.022 17.285 1.00 39.82 ? 1540 HOH A O 1 HETATM 4341 O O . HOH OA 5 . ? 36.573 -13.115 15.492 1.00 41.95 ? 1541 HOH A O 1 HETATM 4342 O O . HOH OA 5 . ? 32.169 -18.071 10.352 1.00 52.32 ? 1542 HOH A O 1 HETATM 4343 O O . HOH OA 5 . ? 53.450 5.137 17.019 1.00 37.58 ? 1543 HOH A O 1 HETATM 4344 O O . HOH OA 5 . ? 56.729 6.934 15.457 1.00 38.72 ? 1544 HOH A O 1 HETATM 4345 O O . HOH OA 5 . ? 51.391 5.470 19.076 1.00 35.74 ? 1545 HOH A O 1 HETATM 4346 O O . HOH OA 5 . ? 52.408 10.289 16.795 1.00 33.28 ? 1546 HOH A O 1 HETATM 4347 O O . HOH OA 5 . ? 49.902 -7.059 1.330 1.00 39.09 ? 1547 HOH A O 1 HETATM 4348 O O . HOH OA 5 . ? 62.217 1.036 5.724 1.00 46.78 ? 1548 HOH A O 1 HETATM 4349 O O . HOH OA 5 . ? 38.333 5.584 -1.835 1.00 44.84 ? 1549 HOH A O 1 HETATM 4350 O O . HOH OA 5 . ? 39.560 7.789 -0.745 1.00 45.62 ? 1550 HOH A O 1 HETATM 4351 O O . HOH OA 5 . ? 36.940 3.535 -0.714 1.00 37.29 ? 1553 HOH A O 1 HETATM 4352 O O . HOH OA 5 . ? 27.985 8.275 14.944 1.00 50.01 ? 1569 HOH A O 1 HETATM 4353 O O . HOH OA 5 . ? 42.755 24.759 6.167 1.00 38.55 ? 1574 HOH A O 1 HETATM 4354 O O . HOH OA 5 . ? 50.647 -2.641 20.627 1.00 38.64 ? 1577 HOH A O 1 HETATM 4355 O O . HOH OA 5 . ? 47.938 -3.524 20.995 1.00 39.54 ? 1578 HOH A O 1 HETATM 4356 O O . HOH OA 5 . ? 54.189 -1.002 14.025 1.00 40.62 ? 1579 HOH A O 1 HETATM 4357 O O . HOH OA 5 . ? 47.977 15.874 3.844 1.00 39.50 ? 1588 HOH A O 1 HETATM 4358 O O . HOH OA 5 . ? 50.753 15.120 14.508 1.00 48.80 ? 1589 HOH A O 1 HETATM 4359 O O . HOH OA 5 . ? 32.090 -16.815 4.324 1.00 46.99 ? 1590 HOH A O 1 HETATM 4360 O O . HOH OA 5 . ? 31.957 -18.464 6.333 1.00 41.76 ? 1591 HOH A O 1 HETATM 4361 O O . HOH OA 5 . ? 59.022 0.789 2.022 1.00 40.14 ? 1594 HOH A O 1 HETATM 4362 O O . HOH OA 5 . ? 23.760 -13.732 -8.177 1.00 43.96 ? 1597 HOH A O 1 HETATM 4363 O O . HOH PA 5 . ? 51.102 40.204 11.156 1.00 13.32 ? 1000 HOH B O 1 HETATM 4364 O O . HOH PA 5 . ? 39.677 5.984 12.078 1.00 13.59 ? 1009 HOH B O 1 HETATM 4365 O O . HOH PA 5 . ? 52.041 34.854 15.893 1.00 15.35 ? 1010 HOH B O 1 HETATM 4366 O O . HOH PA 5 . ? 36.336 26.880 22.329 1.00 21.76 ? 1020 HOH B O 1 HETATM 4367 O O . HOH PA 5 . ? 40.980 27.898 8.926 1.00 18.50 ? 1024 HOH B O 1 HETATM 4368 O O . HOH PA 5 . ? 52.998 36.321 19.063 1.00 16.19 ? 1033 HOH B O 1 HETATM 4369 O O . HOH PA 5 . ? 52.999 37.379 16.521 1.00 17.80 ? 1037 HOH B O 1 HETATM 4370 O O . HOH PA 5 . ? 42.050 19.311 6.324 1.00 22.25 ? 1040 HOH B O 1 HETATM 4371 O O . HOH PA 5 . ? 41.326 30.405 10.073 1.00 17.12 ? 1046 HOH B O 1 HETATM 4372 O O . HOH PA 5 . ? 34.408 35.567 32.517 1.00 20.25 ? 1047 HOH B O 1 HETATM 4373 O O . HOH PA 5 . ? 52.643 36.740 8.129 1.00 20.73 ? 1050 HOH B O 1 HETATM 4374 O O . HOH PA 5 . ? 39.785 20.914 19.541 1.00 21.30 ? 1055 HOH B O 1 HETATM 4375 O O . HOH PA 5 . ? 39.884 25.322 9.379 1.00 19.10 ? 1056 HOH B O 1 HETATM 4376 O O . HOH PA 5 . ? 31.043 52.001 25.333 1.00 23.14 ? 1063 HOH B O 1 HETATM 4377 O O . HOH PA 5 . ? 23.682 50.680 24.576 1.00 17.20 ? 1066 HOH B O 1 HETATM 4378 O O . HOH PA 5 . ? 52.145 36.759 26.350 1.00 20.96 ? 1070 HOH B O 1 HETATM 4379 O O . HOH PA 5 . ? 43.573 49.907 15.756 1.00 19.30 ? 1073 HOH B O 1 HETATM 4380 O O . HOH PA 5 . ? 34.581 33.928 16.503 1.00 13.77 ? 1074 HOH B O 1 HETATM 4381 O O . HOH PA 5 . ? 36.775 26.912 7.202 1.00 24.45 ? 1078 HOH B O 1 HETATM 4382 O O . HOH PA 5 . ? 40.066 49.279 25.192 1.00 33.13 ? 1086 HOH B O 1 HETATM 4383 O O . HOH PA 5 . ? 32.915 53.394 15.601 1.00 23.57 ? 1111 HOH B O 1 HETATM 4384 O O . HOH PA 5 . ? 35.656 5.722 6.213 1.00 23.56 ? 1113 HOH B O 1 HETATM 4385 O O . HOH PA 5 . ? 55.349 42.392 21.872 1.00 19.82 ? 1114 HOH B O 1 HETATM 4386 O O . HOH PA 5 . ? 36.285 50.838 22.368 1.00 20.38 ? 1122 HOH B O 1 HETATM 4387 O O . HOH PA 5 . ? 36.159 25.357 11.846 1.00 23.56 ? 1123 HOH B O 1 HETATM 4388 O O . HOH PA 5 . ? 40.492 43.077 23.161 1.00 17.58 ? 1134 HOH B O 1 HETATM 4389 O O . HOH PA 5 . ? 45.948 49.169 16.782 1.00 19.76 ? 1138 HOH B O 1 HETATM 4390 O O . HOH PA 5 . ? 34.903 55.925 18.140 1.00 21.74 ? 1141 HOH B O 1 HETATM 4391 O O . HOH PA 5 . ? 44.155 49.212 3.635 1.00 25.82 ? 1144 HOH B O 1 HETATM 4392 O O . HOH PA 5 . ? 25.077 47.825 25.438 1.00 23.38 ? 1148 HOH B O 1 HETATM 4393 O O . HOH PA 5 . ? 41.184 30.952 5.726 1.00 26.12 ? 1161 HOH B O 1 HETATM 4394 O O . HOH PA 5 . ? 46.343 15.366 14.153 1.00 22.80 ? 1163 HOH B O 1 HETATM 4395 O O . HOH PA 5 . ? 56.042 36.708 25.487 1.00 30.41 ? 1167 HOH B O 1 HETATM 4396 O O . HOH PA 5 . ? 52.013 26.904 26.745 1.00 26.01 ? 1175 HOH B O 1 HETATM 4397 O O . HOH PA 5 . ? 51.928 44.435 15.681 1.00 28.44 ? 1182 HOH B O 1 HETATM 4398 O O . HOH PA 5 . ? 32.732 28.458 5.956 1.00 25.99 ? 1186 HOH B O 1 HETATM 4399 O O . HOH PA 5 . ? 42.826 1.119 -2.463 1.00 24.33 ? 1187 HOH B O 1 HETATM 4400 O O . HOH PA 5 . ? 41.048 35.310 29.053 1.00 24.88 ? 1192 HOH B O 1 HETATM 4401 O O . HOH PA 5 . ? 55.503 37.492 15.654 1.00 28.83 ? 1193 HOH B O 1 HETATM 4402 O O . HOH PA 5 . ? 52.179 41.199 8.879 1.00 22.81 ? 1194 HOH B O 1 HETATM 4403 O O . HOH PA 5 . ? 28.701 55.558 26.160 1.00 25.25 ? 1195 HOH B O 1 HETATM 4404 O O . HOH PA 5 . ? 41.510 48.205 4.961 1.00 27.94 ? 1196 HOH B O 1 HETATM 4405 O O . HOH PA 5 . ? 40.448 37.185 30.878 1.00 33.78 ? 1206 HOH B O 1 HETATM 4406 O O . HOH PA 5 . ? 49.237 27.229 15.440 1.00 28.13 ? 1208 HOH B O 1 HETATM 4407 O O . HOH PA 5 . ? 46.087 20.668 8.567 1.00 29.41 ? 1215 HOH B O 1 HETATM 4408 O O . HOH PA 5 . ? 39.667 13.414 15.236 1.00 23.93 ? 1216 HOH B O 1 HETATM 4409 O O . HOH PA 5 . ? 36.991 24.777 9.458 1.00 33.61 ? 1221 HOH B O 1 HETATM 4410 O O . HOH PA 5 . ? 36.558 27.438 25.042 1.00 25.38 ? 1224 HOH B O 1 HETATM 4411 O O . HOH PA 5 . ? 37.689 15.134 16.218 1.00 29.37 ? 1226 HOH B O 1 HETATM 4412 O O . HOH PA 5 . ? 41.039 42.487 5.965 1.00 24.74 ? 1228 HOH B O 1 HETATM 4413 O O . HOH PA 5 . ? 49.044 4.243 -2.010 1.00 28.09 ? 1235 HOH B O 1 HETATM 4414 O O . HOH PA 5 . ? 21.095 44.981 20.758 1.00 26.84 ? 1243 HOH B O 1 HETATM 4415 O O . HOH PA 5 . ? 27.084 49.729 13.053 1.00 32.35 ? 1253 HOH B O 1 HETATM 4416 O O . HOH PA 5 . ? 54.497 43.257 18.400 1.00 31.45 ? 1255 HOH B O 1 HETATM 4417 O O . HOH PA 5 . ? 41.747 18.934 18.946 1.00 26.81 ? 1256 HOH B O 1 HETATM 4418 O O . HOH PA 5 . ? 28.333 36.889 16.275 1.00 27.20 ? 1259 HOH B O 1 HETATM 4419 O O . HOH PA 5 . ? 43.421 27.045 7.703 1.00 30.87 ? 1260 HOH B O 1 HETATM 4420 O O . HOH PA 5 . ? 40.284 22.534 21.754 1.00 24.72 ? 1262 HOH B O 1 HETATM 4421 O O . HOH PA 5 . ? 45.561 31.109 32.830 1.00 24.02 ? 1266 HOH B O 1 HETATM 4422 O O . HOH PA 5 . ? 43.208 19.439 16.917 1.00 28.98 ? 1267 HOH B O 1 HETATM 4423 O O . HOH PA 5 . ? 29.569 39.697 6.682 1.00 31.79 ? 1269 HOH B O 1 HETATM 4424 O O . HOH PA 5 . ? 25.246 43.916 10.414 1.00 23.36 ? 1271 HOH B O 1 HETATM 4425 O O . HOH PA 5 . ? 38.426 22.854 28.282 1.00 33.27 ? 1274 HOH B O 1 HETATM 4426 O O . HOH PA 5 . ? 17.567 42.772 19.060 1.00 34.93 ? 1278 HOH B O 1 HETATM 4427 O O . HOH PA 5 . ? 53.967 39.482 8.215 1.00 38.32 ? 1293 HOH B O 1 HETATM 4428 O O . HOH PA 5 . ? 32.007 38.982 6.266 1.00 33.25 ? 1307 HOH B O 1 HETATM 4429 O O . HOH PA 5 . ? 37.153 20.094 19.578 1.00 42.21 ? 1327 HOH B O 1 HETATM 4430 O O . HOH PA 5 . ? 51.758 39.246 14.928 1.00 25.15 ? 1328 HOH B O 1 HETATM 4431 O O . HOH PA 5 . ? 32.877 24.350 12.160 1.00 33.15 ? 1332 HOH B O 1 HETATM 4432 O O . HOH PA 5 . ? 27.785 34.568 17.861 1.00 34.74 ? 1344 HOH B O 1 HETATM 4433 O O . HOH PA 5 . ? 30.004 30.645 18.090 1.00 36.18 ? 1347 HOH B O 1 HETATM 4434 O O . HOH PA 5 . ? 53.893 28.810 14.404 1.00 51.38 ? 1348 HOH B O 1 HETATM 4435 O O . HOH PA 5 . ? 38.636 59.613 12.904 1.00 30.43 ? 1356 HOH B O 1 HETATM 4436 O O . HOH PA 5 . ? 51.671 45.370 18.319 1.00 30.48 ? 1358 HOH B O 1 HETATM 4437 O O . HOH PA 5 . ? 21.243 47.935 21.495 1.00 33.15 ? 1364 HOH B O 1 HETATM 4438 O O . HOH PA 5 . ? 53.223 33.194 11.534 1.00 32.48 ? 1370 HOH B O 1 HETATM 4439 O O . HOH PA 5 . ? 29.754 49.033 6.733 1.00 34.04 ? 1371 HOH B O 1 HETATM 4440 O O . HOH PA 5 . ? 55.441 45.155 22.563 1.00 38.53 ? 1372 HOH B O 1 HETATM 4441 O O . HOH PA 5 . ? 41.039 45.429 25.487 1.00 36.78 ? 1373 HOH B O 1 HETATM 4442 O O . HOH PA 5 . ? 54.280 35.067 26.913 1.00 26.96 ? 1374 HOH B O 1 HETATM 4443 O O . HOH PA 5 . ? 50.596 30.093 11.335 1.00 23.49 ? 1384 HOH B O 1 HETATM 4444 O O . HOH PA 5 . ? 37.292 44.256 22.535 1.00 31.77 ? 1387 HOH B O 1 HETATM 4445 O O . HOH PA 5 . ? 48.758 28.282 10.315 1.00 27.88 ? 1391 HOH B O 1 HETATM 4446 O O . HOH PA 5 . ? 26.898 57.495 24.551 1.00 32.04 ? 1393 HOH B O 1 HETATM 4447 O O . HOH PA 5 . ? 32.296 32.458 18.234 1.00 29.74 ? 1396 HOH B O 1 HETATM 4448 O O . HOH PA 5 . ? 46.348 27.645 13.802 1.00 29.36 ? 1407 HOH B O 1 HETATM 4449 O O . HOH PA 5 . ? 39.089 43.605 25.514 1.00 30.67 ? 1409 HOH B O 1 HETATM 4450 O O . HOH PA 5 . ? 42.698 22.156 25.889 1.00 33.80 ? 1426 HOH B O 1 HETATM 4451 O O . HOH PA 5 . ? 54.951 28.634 18.875 1.00 32.97 ? 1431 HOH B O 1 HETATM 4452 O O . HOH PA 5 . ? 33.777 33.372 27.368 1.00 30.55 ? 1435 HOH B O 1 HETATM 4453 O O . HOH PA 5 . ? 38.133 22.250 23.712 1.00 37.40 ? 1436 HOH B O 1 HETATM 4454 O O . HOH PA 5 . ? 56.204 -3.746 -1.149 1.00 38.75 ? 1438 HOH B O 1 HETATM 4455 O O . HOH PA 5 . ? 42.842 50.435 25.332 1.00 43.89 ? 1442 HOH B O 1 HETATM 4456 O O . HOH PA 5 . ? 51.962 25.837 23.221 1.00 36.72 ? 1444 HOH B O 1 HETATM 4457 O O . HOH PA 5 . ? 21.284 47.020 12.811 1.00 34.74 ? 1451 HOH B O 1 HETATM 4458 O O . HOH PA 5 . ? 43.273 43.991 29.195 1.00 30.51 ? 1465 HOH B O 1 HETATM 4459 O O . HOH PA 5 . ? 33.303 26.162 20.382 1.00 33.85 ? 1475 HOH B O 1 HETATM 4460 O O . HOH PA 5 . ? 54.310 28.650 25.931 1.00 32.28 ? 1479 HOH B O 1 HETATM 4461 O O . HOH PA 5 . ? 52.688 41.380 16.264 1.00 29.77 ? 1483 HOH B O 1 HETATM 4462 O O . HOH PA 5 . ? 51.255 27.695 29.371 1.00 35.14 ? 1489 HOH B O 1 HETATM 4463 O O . HOH PA 5 . ? 32.734 26.763 17.600 1.00 36.31 ? 1494 HOH B O 1 HETATM 4464 O O . HOH PA 5 . ? 31.965 31.113 5.207 1.00 35.22 ? 1514 HOH B O 1 HETATM 4465 O O . HOH PA 5 . ? 31.642 39.628 23.163 1.00 34.06 ? 1517 HOH B O 1 HETATM 4466 O O . HOH PA 5 . ? 22.873 49.385 13.360 1.00 35.78 ? 1529 HOH B O 1 HETATM 4467 O O . HOH PA 5 . ? 22.416 55.065 17.388 1.00 42.80 ? 1530 HOH B O 1 HETATM 4468 O O . HOH PA 5 . ? 52.889 38.933 28.042 1.00 36.00 ? 1533 HOH B O 1 HETATM 4469 O O . HOH PA 5 . ? 49.041 23.960 20.181 1.00 32.13 ? 1534 HOH B O 1 HETATM 4470 O O . HOH PA 5 . ? 46.235 12.753 14.677 1.00 31.81 ? 1535 HOH B O 1 HETATM 4471 O O . HOH PA 5 . ? 46.017 19.657 18.140 1.00 43.14 ? 1536 HOH B O 1 HETATM 4472 O O . HOH PA 5 . ? 30.031 36.114 19.560 1.00 34.99 ? 1554 HOH B O 1 HETATM 4473 O O . HOH PA 5 . ? 31.533 32.617 21.836 1.00 39.19 ? 1555 HOH B O 1 HETATM 4474 O O . HOH PA 5 . ? 49.628 45.619 12.093 1.00 34.59 ? 1557 HOH B O 1 HETATM 4475 O O . HOH PA 5 . ? 49.690 51.172 12.789 1.00 44.00 ? 1558 HOH B O 1 HETATM 4476 O O . HOH PA 5 . ? 54.370 43.743 15.729 1.00 45.85 ? 1559 HOH B O 1 HETATM 4477 O O . HOH PA 5 . ? 47.140 50.437 7.193 1.00 38.41 ? 1560 HOH B O 1 HETATM 4478 O O . HOH PA 5 . ? 45.737 52.426 9.347 1.00 44.81 ? 1561 HOH B O 1 HETATM 4479 O O . HOH PA 5 . ? 33.459 48.250 6.774 1.00 38.12 ? 1562 HOH B O 1 HETATM 4480 O O . HOH PA 5 . ? 25.284 37.661 12.778 1.00 49.19 ? 1563 HOH B O 1 HETATM 4481 O O . HOH PA 5 . ? 27.349 36.441 13.662 1.00 39.93 ? 1564 HOH B O 1 HETATM 4482 O O . HOH PA 5 . ? 56.668 27.844 14.283 1.00 45.44 ? 1565 HOH B O 1 HETATM 4483 O O . HOH PA 5 . ? 49.082 29.412 31.504 1.00 39.54 ? 1566 HOH B O 1 HETATM 4484 O O . HOH PA 5 . ? 48.574 31.607 32.741 1.00 43.13 ? 1567 HOH B O 1 HETATM 4485 O O . HOH PA 5 . ? 44.322 54.075 21.643 1.00 42.43 ? 1568 HOH B O 1 HETATM 4486 O O . HOH PA 5 . ? 23.085 45.511 23.163 1.00 47.51 ? 1580 HOH B O 1 HETATM 4487 O O . HOH PA 5 . ? 50.062 49.093 14.937 1.00 41.29 ? 1592 HOH B O 1 HETATM 4488 O O . HOH PA 5 . ? 58.257 -2.123 2.324 1.00 40.52 ? 1593 HOH B O 1 HETATM 4489 O O . HOH PA 5 . ? 17.071 52.383 17.467 1.00 38.80 ? 1596 HOH B O 1 HETATM 4490 O O . HOH PA 5 . ? 47.415 26.519 11.941 1.00 44.52 ? 1598 HOH B O 1 HETATM 4491 O O . HOH PA 5 . ? 35.306 48.020 4.651 1.00 40.65 ? 1599 HOH B O 1 HETATM 4492 O O . HOH QA 5 . ? -4.710 31.939 10.725 1.00 13.33 ? 1003 HOH C O 1 HETATM 4493 O O . HOH QA 5 . ? -15.991 -0.128 4.906 1.00 18.18 ? 1005 HOH C O 1 HETATM 4494 O O . HOH QA 5 . ? 1.383 -8.164 28.069 1.00 16.36 ? 1006 HOH C O 1 HETATM 4495 O O . HOH QA 5 . ? -0.219 -7.826 8.456 1.00 14.69 ? 1007 HOH C O 1 HETATM 4496 O O . HOH QA 5 . ? -2.823 -9.479 29.235 1.00 15.79 ? 1011 HOH C O 1 HETATM 4497 O O . HOH QA 5 . ? -17.702 5.926 8.550 1.00 20.34 ? 1012 HOH C O 1 HETATM 4498 O O . HOH QA 5 . ? -1.079 -12.629 29.376 1.00 16.16 ? 1018 HOH C O 1 HETATM 4499 O O . HOH QA 5 . ? -7.550 -14.277 26.837 1.00 20.49 ? 1022 HOH C O 1 HETATM 4500 O O . HOH QA 5 . ? -4.963 7.501 8.550 1.00 16.66 ? 1026 HOH C O 1 HETATM 4501 O O . HOH QA 5 . ? 5.708 -8.983 27.116 1.00 20.93 ? 1027 HOH C O 1 HETATM 4502 O O . HOH QA 5 . ? -13.697 -10.460 12.880 1.00 18.52 ? 1031 HOH C O 1 HETATM 4503 O O . HOH QA 5 . ? -21.972 6.141 9.247 1.00 21.88 ? 1036 HOH C O 1 HETATM 4504 O O . HOH QA 5 . ? -10.583 -11.849 22.079 1.00 18.33 ? 1041 HOH C O 1 HETATM 4505 O O . HOH QA 5 . ? -0.715 32.655 -4.470 1.00 18.37 ? 1042 HOH C O 1 HETATM 4506 O O . HOH QA 5 . ? -19.980 5.100 11.017 1.00 18.42 ? 1043 HOH C O 1 HETATM 4507 O O . HOH QA 5 . ? -2.877 3.665 17.421 1.00 16.82 ? 1045 HOH C O 1 HETATM 4508 O O . HOH QA 5 . ? -5.131 -15.825 17.770 1.00 16.83 ? 1052 HOH C O 1 HETATM 4509 O O . HOH QA 5 . ? 5.824 -8.594 16.209 1.00 17.91 ? 1057 HOH C O 1 HETATM 4510 O O . HOH QA 5 . ? 13.480 -7.573 21.488 1.00 20.60 ? 1058 HOH C O 1 HETATM 4511 O O . HOH QA 5 . ? -5.851 -17.858 29.234 1.00 23.27 ? 1068 HOH C O 1 HETATM 4512 O O . HOH QA 5 . ? -0.859 6.433 17.033 1.00 24.41 ? 1071 HOH C O 1 HETATM 4513 O O . HOH QA 5 . ? -8.582 -17.499 19.327 1.00 18.87 ? 1083 HOH C O 1 HETATM 4514 O O . HOH QA 5 . ? -15.923 -9.113 12.570 1.00 23.63 ? 1087 HOH C O 1 HETATM 4515 O O . HOH QA 5 . ? -5.248 -6.116 0.155 1.00 25.35 ? 1088 HOH C O 1 HETATM 4516 O O . HOH QA 5 . ? 2.431 -13.371 11.363 1.00 24.35 ? 1093 HOH C O 1 HETATM 4517 O O . HOH QA 5 . ? 1.118 -6.096 29.910 1.00 24.40 ? 1098 HOH C O 1 HETATM 4518 O O . HOH QA 5 . ? -12.740 -3.810 20.857 1.00 24.26 ? 1103 HOH C O 1 HETATM 4519 O O . HOH QA 5 . ? -4.426 24.776 11.564 1.00 19.24 ? 1104 HOH C O 1 HETATM 4520 O O . HOH QA 5 . ? 1.512 31.871 7.435 1.00 22.62 ? 1108 HOH C O 1 HETATM 4521 O O . HOH QA 5 . ? 7.089 -4.381 20.819 1.00 24.55 ? 1109 HOH C O 1 HETATM 4522 O O . HOH QA 5 . ? -3.277 -2.883 25.081 1.00 20.72 ? 1110 HOH C O 1 HETATM 4523 O O . HOH QA 5 . ? -4.509 26.349 13.789 1.00 21.37 ? 1112 HOH C O 1 HETATM 4524 O O . HOH QA 5 . ? 5.244 -11.539 28.027 1.00 20.49 ? 1117 HOH C O 1 HETATM 4525 O O . HOH QA 5 . ? -7.309 8.881 24.533 1.00 24.78 ? 1125 HOH C O 1 HETATM 4526 O O . HOH QA 5 . ? -3.523 -19.793 28.322 1.00 26.41 ? 1130 HOH C O 1 HETATM 4527 O O . HOH QA 5 . ? -21.491 8.318 7.813 1.00 23.38 ? 1131 HOH C O 1 HETATM 4528 O O . HOH QA 5 . ? -5.745 17.645 17.313 1.00 23.07 ? 1135 HOH C O 1 HETATM 4529 O O . HOH QA 5 . ? 3.031 -6.547 31.916 1.00 21.22 ? 1136 HOH C O 1 HETATM 4530 O O . HOH QA 5 . ? -26.542 4.956 13.951 1.00 25.27 ? 1139 HOH C O 1 HETATM 4531 O O . HOH QA 5 . ? -5.566 42.538 -4.334 1.00 26.45 ? 1146 HOH C O 1 HETATM 4532 O O . HOH QA 5 . ? 3.677 30.185 6.682 1.00 31.28 ? 1147 HOH C O 1 HETATM 4533 O O . HOH QA 5 . ? -0.718 30.988 -2.277 1.00 25.93 ? 1150 HOH C O 1 HETATM 4534 O O . HOH QA 5 . ? 0.053 11.782 12.385 1.00 26.27 ? 1151 HOH C O 1 HETATM 4535 O O . HOH QA 5 . ? -19.140 3.572 8.653 1.00 22.69 ? 1152 HOH C O 1 HETATM 4536 O O . HOH QA 5 . ? 7.719 -11.856 19.758 1.00 22.99 ? 1155 HOH C O 1 HETATM 4537 O O . HOH QA 5 . ? -23.862 -2.029 10.131 1.00 21.16 ? 1157 HOH C O 1 HETATM 4538 O O . HOH QA 5 . ? 11.797 -7.274 25.671 1.00 27.13 ? 1159 HOH C O 1 HETATM 4539 O O . HOH QA 5 . ? 4.553 -3.887 10.709 1.00 28.12 ? 1162 HOH C O 1 HETATM 4540 O O . HOH QA 5 . ? -17.952 1.205 8.139 1.00 22.14 ? 1165 HOH C O 1 HETATM 4541 O O . HOH QA 5 . ? -8.549 19.987 8.892 1.00 23.58 ? 1166 HOH C O 1 HETATM 4542 O O . HOH QA 5 . ? -13.357 12.652 9.211 1.00 27.65 ? 1168 HOH C O 1 HETATM 4543 O O . HOH QA 5 . ? 4.551 -12.973 18.169 1.00 22.46 ? 1169 HOH C O 1 HETATM 4544 O O . HOH QA 5 . ? 4.939 7.235 9.051 1.00 24.33 ? 1170 HOH C O 1 HETATM 4545 O O . HOH QA 5 . ? -9.143 -12.761 8.066 1.00 27.36 ? 1174 HOH C O 1 HETATM 4546 O O . HOH QA 5 . ? -13.427 9.752 5.087 1.00 26.24 ? 1178 HOH C O 1 HETATM 4547 O O . HOH QA 5 . ? -0.950 -5.131 31.265 1.00 27.10 ? 1179 HOH C O 1 HETATM 4548 O O . HOH QA 5 . ? 1.726 -13.559 18.090 1.00 24.57 ? 1183 HOH C O 1 HETATM 4549 O O . HOH QA 5 . ? -4.668 22.055 16.264 1.00 29.74 ? 1184 HOH C O 1 HETATM 4550 O O . HOH QA 5 . ? -1.566 3.712 4.335 1.00 24.43 ? 1185 HOH C O 1 HETATM 4551 O O . HOH QA 5 . ? 2.647 -12.109 28.778 1.00 29.95 ? 1191 HOH C O 1 HETATM 4552 O O . HOH QA 5 . ? -5.393 -4.436 5.064 1.00 27.70 ? 1198 HOH C O 1 HETATM 4553 O O . HOH QA 5 . ? -19.697 -0.824 8.680 1.00 27.34 ? 1209 HOH C O 1 HETATM 4554 O O . HOH QA 5 . ? -18.998 7.260 6.514 1.00 27.18 ? 1233 HOH C O 1 HETATM 4555 O O . HOH QA 5 . ? -6.164 35.918 -6.020 1.00 27.02 ? 1237 HOH C O 1 HETATM 4556 O O . HOH QA 5 . ? -10.914 10.729 4.827 1.00 24.39 ? 1248 HOH C O 1 HETATM 4557 O O . HOH QA 5 . ? -5.255 -10.005 7.595 1.00 30.38 ? 1250 HOH C O 1 HETATM 4558 O O . HOH QA 5 . ? 7.867 -18.166 25.616 1.00 30.77 ? 1257 HOH C O 1 HETATM 4559 O O . HOH QA 5 . ? 8.535 -8.336 27.309 1.00 28.26 ? 1263 HOH C O 1 HETATM 4560 O O . HOH QA 5 . ? -20.695 -8.165 18.187 1.00 30.31 ? 1268 HOH C O 1 HETATM 4561 O O . HOH QA 5 . ? -1.435 -1.240 25.746 1.00 37.97 ? 1275 HOH C O 1 HETATM 4562 O O . HOH QA 5 . ? -16.003 16.254 14.083 1.00 29.24 ? 1285 HOH C O 1 HETATM 4563 O O . HOH QA 5 . ? -3.257 6.844 4.724 1.00 26.93 ? 1286 HOH C O 1 HETATM 4564 O O . HOH QA 5 . ? -19.484 5.159 4.815 1.00 31.90 ? 1291 HOH C O 1 HETATM 4565 O O . HOH QA 5 . ? 5.059 -12.157 10.480 1.00 29.31 ? 1294 HOH C O 1 HETATM 4566 O O . HOH QA 5 . ? -24.808 7.854 16.957 1.00 40.19 ? 1296 HOH C O 1 HETATM 4567 O O . HOH QA 5 . ? -10.277 -21.315 13.244 1.00 31.75 ? 1297 HOH C O 1 HETATM 4568 O O . HOH QA 5 . ? -7.018 -15.917 10.146 1.00 28.43 ? 1298 HOH C O 1 HETATM 4569 O O . HOH QA 5 . ? 1.084 10.019 8.221 1.00 33.34 ? 1300 HOH C O 1 HETATM 4570 O O . HOH QA 5 . ? -0.731 -19.126 12.988 1.00 30.84 ? 1306 HOH C O 1 HETATM 4571 O O . HOH QA 5 . ? -18.881 10.783 8.379 1.00 37.12 ? 1310 HOH C O 1 HETATM 4572 O O . HOH QA 5 . ? -4.777 24.688 15.812 1.00 29.80 ? 1319 HOH C O 1 HETATM 4573 O O . HOH QA 5 . ? -5.427 37.814 -8.008 1.00 32.06 ? 1322 HOH C O 1 HETATM 4574 O O . HOH QA 5 . ? -5.179 12.018 21.383 1.00 34.62 ? 1324 HOH C O 1 HETATM 4575 O O . HOH QA 5 . ? 3.521 2.393 9.846 1.00 30.74 ? 1335 HOH C O 1 HETATM 4576 O O . HOH QA 5 . ? -11.486 22.999 9.810 1.00 34.00 ? 1339 HOH C O 1 HETATM 4577 O O . HOH QA 5 . ? 2.325 -0.621 20.095 1.00 36.47 ? 1343 HOH C O 1 HETATM 4578 O O . HOH QA 5 . ? 2.138 27.292 2.842 1.00 34.75 ? 1354 HOH C O 1 HETATM 4579 O O . HOH QA 5 . ? -6.224 -12.491 7.823 1.00 32.13 ? 1361 HOH C O 1 HETATM 4580 O O . HOH QA 5 . ? -21.898 13.910 11.502 1.00 40.37 ? 1362 HOH C O 1 HETATM 4581 O O . HOH QA 5 . ? -18.810 15.655 14.671 1.00 38.47 ? 1363 HOH C O 1 HETATM 4582 O O . HOH QA 5 . ? -2.382 -19.556 24.463 1.00 37.04 ? 1367 HOH C O 1 HETATM 4583 O O . HOH QA 5 . ? 3.243 8.356 7.382 1.00 37.45 ? 1379 HOH C O 1 HETATM 4584 O O . HOH QA 5 . ? -6.999 11.602 23.704 1.00 30.80 ? 1381 HOH C O 1 HETATM 4585 O O . HOH QA 5 . ? -20.697 3.447 6.541 1.00 27.67 ? 1385 HOH C O 1 HETATM 4586 O O . HOH QA 5 . ? -4.664 10.592 5.164 1.00 31.57 ? 1390 HOH C O 1 HETATM 4587 O O . HOH QA 5 . ? -6.856 22.405 0.222 1.00 31.19 ? 1398 HOH C O 1 HETATM 4588 O O . HOH QA 5 . ? -18.507 -9.892 12.241 1.00 38.34 ? 1402 HOH C O 1 HETATM 4589 O O . HOH QA 5 . ? -9.164 16.874 25.195 1.00 44.76 ? 1411 HOH C O 1 HETATM 4590 O O . HOH QA 5 . ? -3.108 -7.265 6.800 1.00 30.93 ? 1416 HOH C O 1 HETATM 4591 O O . HOH QA 5 . ? -18.965 18.112 21.057 1.00 42.77 ? 1419 HOH C O 1 HETATM 4592 O O . HOH QA 5 . ? -20.530 12.611 9.392 1.00 37.68 ? 1424 HOH C O 1 HETATM 4593 O O . HOH QA 5 . ? -19.018 -1.756 5.616 1.00 34.35 ? 1425 HOH C O 1 HETATM 4594 O O . HOH QA 5 . ? -15.785 -1.097 2.428 1.00 40.87 ? 1437 HOH C O 1 HETATM 4595 O O . HOH QA 5 . ? 1.021 7.776 18.624 1.00 31.68 ? 1443 HOH C O 1 HETATM 4596 O O . HOH QA 5 . ? -11.982 15.048 14.953 1.00 26.83 ? 1446 HOH C O 1 HETATM 4597 O O . HOH QA 5 . ? -15.202 1.764 29.980 1.00 34.13 ? 1455 HOH C O 1 HETATM 4598 O O . HOH QA 5 . ? -9.892 -13.202 27.186 1.00 27.96 ? 1460 HOH C O 1 HETATM 4599 O O . HOH QA 5 . ? -1.364 13.710 14.828 1.00 35.62 ? 1464 HOH C O 1 HETATM 4600 O O . HOH QA 5 . ? 3.143 -2.749 21.268 1.00 35.58 ? 1466 HOH C O 1 HETATM 4601 O O . HOH QA 5 . ? -19.642 -3.923 8.638 1.00 42.88 ? 1481 HOH C O 1 HETATM 4602 O O . HOH QA 5 . ? -7.630 -7.675 -0.228 1.00 35.23 ? 1487 HOH C O 1 HETATM 4603 O O . HOH QA 5 . ? -9.631 -5.901 21.868 1.00 31.10 ? 1503 HOH C O 1 HETATM 4604 O O . HOH QA 5 . ? 9.777 -10.244 28.696 1.00 36.90 ? 1504 HOH C O 1 HETATM 4605 O O . HOH QA 5 . ? 2.533 1.727 21.897 1.00 43.61 ? 1515 HOH C O 1 HETATM 4606 O O . HOH QA 5 . ? -14.651 12.134 6.292 1.00 38.97 ? 1516 HOH C O 1 HETATM 4607 O O . HOH QA 5 . ? 10.651 -11.955 19.149 1.00 36.85 ? 1526 HOH C O 1 HETATM 4608 O O . HOH QA 5 . ? -7.947 12.304 5.678 1.00 38.59 ? 1527 HOH C O 1 HETATM 4609 O O . HOH QA 5 . ? -21.111 14.968 17.891 1.00 35.32 ? 1532 HOH C O 1 HETATM 4610 O O . HOH QA 5 . ? 3.206 8.455 17.809 1.00 40.75 ? 1570 HOH C O 1 HETATM 4611 O O . HOH QA 5 . ? -2.466 3.790 24.266 1.00 39.31 ? 1571 HOH C O 1 HETATM 4612 O O . HOH QA 5 . ? 1.742 6.105 20.488 1.00 49.56 ? 1572 HOH C O 1 HETATM 4613 O O . HOH QA 5 . ? 8.346 -9.326 15.591 1.00 41.00 ? 1573 HOH C O 1 HETATM 4614 O O . HOH QA 5 . ? -11.489 -17.454 17.612 1.00 32.99 ? 1586 HOH C O 1 HETATM 4615 O O . HOH QA 5 . ? -12.971 -16.352 20.864 1.00 40.73 ? 1587 HOH C O 1 HETATM 4616 O O . HOH QA 5 . ? -22.932 5.637 17.415 1.00 33.67 ? 1601 HOH C O 1 HETATM 4617 O O . HOH QA 5 . ? -25.621 7.561 19.541 1.00 39.38 ? 1602 HOH C O 1 HETATM 4618 O O . HOH QA 5 . ? -17.413 11.853 6.577 1.00 37.17 ? 1603 HOH C O 1 HETATM 4619 O O . HOH QA 5 . ? -12.868 16.960 13.408 1.00 41.69 ? 1604 HOH C O 1 HETATM 4620 O O . HOH QA 5 . ? -10.536 15.666 17.260 1.00 41.69 ? 1605 HOH C O 1 HETATM 4621 O O . HOH QA 5 . ? 0.563 -20.421 24.172 1.00 39.86 ? 1609 HOH C O 1 HETATM 4622 O O . HOH QA 5 . ? 3.191 -18.714 24.586 1.00 40.58 ? 1610 HOH C O 1 HETATM 4623 O O . HOH QA 5 . ? -0.469 -20.041 20.271 1.00 44.92 ? 1611 HOH C O 1 HETATM 4624 O O . HOH RA 5 . ? -16.365 40.673 11.827 1.00 15.21 ? 1001 HOH D O 1 HETATM 4625 O O . HOH RA 5 . ? 10.603 52.021 -1.753 1.00 16.30 ? 1015 HOH D O 1 HETATM 4626 O O . HOH RA 5 . ? -17.094 35.228 7.134 1.00 15.66 ? 1021 HOH D O 1 HETATM 4627 O O . HOH RA 5 . ? -18.030 36.467 3.952 1.00 16.18 ? 1023 HOH D O 1 HETATM 4628 O O . HOH RA 5 . ? -18.077 37.740 6.419 1.00 17.79 ? 1028 HOH D O 1 HETATM 4629 O O . HOH RA 5 . ? -4.808 6.982 11.238 1.00 15.90 ? 1032 HOH D O 1 HETATM 4630 O O . HOH RA 5 . ? 0.459 36.358 -9.495 1.00 20.08 ? 1034 HOH D O 1 HETATM 4631 O O . HOH RA 5 . ? -6.116 31.287 12.991 1.00 18.54 ? 1038 HOH D O 1 HETATM 4632 O O . HOH RA 5 . ? -5.735 28.800 14.130 1.00 22.60 ? 1048 HOH D O 1 HETATM 4633 O O . HOH RA 5 . ? -3.583 9.685 7.513 1.00 23.58 ? 1051 HOH D O 1 HETATM 4634 O O . HOH RA 5 . ? -2.023 51.781 0.362 1.00 20.03 ? 1060 HOH D O 1 HETATM 4635 O O . HOH RA 5 . ? -20.685 42.421 1.048 1.00 19.64 ? 1067 HOH D O 1 HETATM 4636 O O . HOH RA 5 . ? -9.180 50.612 7.022 1.00 17.97 ? 1079 HOH D O 1 HETATM 4637 O O . HOH RA 5 . ? -1.051 27.734 0.914 1.00 22.85 ? 1080 HOH D O 1 HETATM 4638 O O . HOH RA 5 . ? -17.290 36.900 -3.341 1.00 20.84 ? 1081 HOH D O 1 HETATM 4639 O O . HOH RA 5 . ? -11.006 16.695 9.186 1.00 22.68 ? 1082 HOH D O 1 HETATM 4640 O O . HOH RA 5 . ? -17.702 37.029 14.903 1.00 20.34 ? 1090 HOH D O 1 HETATM 4641 O O . HOH RA 5 . ? 9.183 49.205 -2.642 1.00 24.84 ? 1092 HOH D O 1 HETATM 4642 O O . HOH RA 5 . ? 1.162 54.515 7.043 1.00 22.30 ? 1102 HOH D O 1 HETATM 4643 O O . HOH RA 5 . ? -11.542 49.764 6.005 1.00 20.96 ? 1107 HOH D O 1 HETATM 4644 O O . HOH RA 5 . ? 3.186 53.080 -2.468 1.00 26.38 ? 1116 HOH D O 1 HETATM 4645 O O . HOH RA 5 . ? -0.710 26.412 11.287 1.00 25.20 ? 1120 HOH D O 1 HETATM 4646 O O . HOH RA 5 . ? -9.709 49.979 19.227 1.00 27.50 ? 1124 HOH D O 1 HETATM 4647 O O . HOH RA 5 . ? -5.792 43.817 -0.282 1.00 19.24 ? 1129 HOH D O 1 HETATM 4648 O O . HOH RA 5 . ? -0.811 56.942 4.484 1.00 20.30 ? 1137 HOH D O 1 HETATM 4649 O O . HOH RA 5 . ? -4.176 21.753 3.766 1.00 20.95 ? 1143 HOH D O 1 HETATM 4650 O O . HOH RA 5 . ? 0.175 45.381 16.876 1.00 30.34 ? 1158 HOH D O 1 HETATM 4651 O O . HOH RA 5 . ? -19.918 43.299 4.465 1.00 25.97 ? 1177 HOH D O 1 HETATM 4652 O O . HOH RA 5 . ? -6.257 19.771 4.189 1.00 29.97 ? 1180 HOH D O 1 HETATM 4653 O O . HOH RA 5 . ? 5.480 56.785 -3.422 1.00 28.15 ? 1189 HOH D O 1 HETATM 4654 O O . HOH RA 5 . ? -7.989 28.015 15.505 1.00 33.38 ? 1190 HOH D O 1 HETATM 4655 O O . HOH RA 5 . ? -1.327 28.334 -1.858 1.00 27.74 ? 1200 HOH D O 1 HETATM 4656 O O . HOH RA 5 . ? -15.441 30.524 11.732 1.00 21.51 ? 1202 HOH D O 1 HETATM 4657 O O . HOH RA 5 . ? -14.007 27.768 7.727 1.00 25.71 ? 1203 HOH D O 1 HETATM 4658 O O . HOH RA 5 . ? 7.157 58.639 -1.781 1.00 30.58 ? 1204 HOH D O 1 HETATM 4659 O O . HOH RA 5 . ? -22.415 40.912 2.641 1.00 24.91 ? 1207 HOH D O 1 HETATM 4660 O O . HOH RA 5 . ? 9.238 45.458 12.537 1.00 26.92 ? 1210 HOH D O 1 HETATM 4661 O O . HOH RA 5 . ? -8.524 7.522 26.482 1.00 25.48 ? 1212 HOH D O 1 HETATM 4662 O O . HOH RA 5 . ? -6.168 31.918 17.334 1.00 22.65 ? 1219 HOH D O 1 HETATM 4663 O O . HOH RA 5 . ? -16.952 39.630 7.974 1.00 23.40 ? 1220 HOH D O 1 HETATM 4664 O O . HOH RA 5 . ? -17.436 44.651 7.206 1.00 27.10 ? 1222 HOH D O 1 HETATM 4665 O O . HOH RA 5 . ? -10.736 35.265 -7.214 1.00 33.32 ? 1223 HOH D O 1 HETATM 4666 O O . HOH RA 5 . ? -4.772 48.762 15.883 1.00 30.34 ? 1225 HOH D O 1 HETATM 4667 O O . HOH RA 5 . ? -19.620 28.519 4.275 1.00 36.05 ? 1227 HOH D O 1 HETATM 4668 O O . HOH RA 5 . ? -21.051 36.392 -2.479 1.00 28.49 ? 1230 HOH D O 1 HETATM 4669 O O . HOH RA 5 . ? -6.941 49.139 17.912 1.00 30.66 ? 1231 HOH D O 1 HETATM 4670 O O . HOH RA 5 . ? 2.548 29.924 17.174 1.00 29.90 ? 1239 HOH D O 1 HETATM 4671 O O . HOH RA 5 . ? -16.552 27.095 -3.560 1.00 25.85 ? 1249 HOH D O 1 HETATM 4672 O O . HOH RA 5 . ? -2.168 16.023 7.472 1.00 24.55 ? 1254 HOH D O 1 HETATM 4673 O O . HOH RA 5 . ? -19.249 34.991 -3.870 1.00 26.57 ? 1270 HOH D O 1 HETATM 4674 O O . HOH RA 5 . ? -2.915 58.513 3.764 1.00 55.04 ? 1281 HOH D O 1 HETATM 4675 O O . HOH RA 5 . ? -17.065 45.638 4.473 1.00 25.94 ? 1288 HOH D O 1 HETATM 4676 O O . HOH RA 5 . ? -18.622 30.358 6.213 1.00 24.31 ? 1289 HOH D O 1 HETATM 4677 O O . HOH RA 5 . ? 7.344 51.221 9.763 1.00 26.70 ? 1292 HOH D O 1 HETATM 4678 O O . HOH RA 5 . ? -6.820 20.352 16.902 1.00 30.99 ? 1295 HOH D O 1 HETATM 4679 O O . HOH RA 5 . ? -10.322 13.053 6.333 1.00 38.61 ? 1301 HOH D O 1 HETATM 4680 O O . HOH RA 5 . ? 7.067 35.906 5.182 1.00 35.63 ? 1302 HOH D O 1 HETATM 4681 O O . HOH RA 5 . ? -2.723 25.163 9.426 1.00 34.05 ? 1303 HOH D O 1 HETATM 4682 O O . HOH RA 5 . ? -11.045 13.855 8.646 1.00 31.00 ? 1308 HOH D O 1 HETATM 4683 O O . HOH RA 5 . ? 2.684 37.774 17.409 1.00 33.52 ? 1311 HOH D O 1 HETATM 4684 O O . HOH RA 5 . ? 2.920 34.835 16.388 1.00 37.97 ? 1314 HOH D O 1 HETATM 4685 O O . HOH RA 5 . ? 5.154 40.978 16.140 1.00 31.24 ? 1321 HOH D O 1 HETATM 4686 O O . HOH RA 5 . ? 2.330 36.291 -7.591 1.00 34.29 ? 1331 HOH D O 1 HETATM 4687 O O . HOH RA 5 . ? -15.114 46.405 10.773 1.00 29.68 ? 1334 HOH D O 1 HETATM 4688 O O . HOH RA 5 . ? -4.772 60.493 9.667 1.00 31.07 ? 1341 HOH D O 1 HETATM 4689 O O . HOH RA 5 . ? -13.343 24.229 3.224 1.00 32.30 ? 1346 HOH D O 1 HETATM 4690 O O . HOH RA 5 . ? 2.264 25.543 10.990 1.00 33.12 ? 1349 HOH D O 1 HETATM 4691 O O . HOH RA 5 . ? 13.373 46.881 1.976 1.00 30.03 ? 1350 HOH D O 1 HETATM 4692 O O . HOH RA 5 . ? 5.384 31.953 4.850 1.00 39.46 ? 1351 HOH D O 1 HETATM 4693 O O . HOH RA 5 . ? -5.340 13.139 5.574 1.00 32.93 ? 1355 HOH D O 1 HETATM 4694 O O . HOH RA 5 . ? -7.853 20.199 6.305 1.00 27.96 ? 1357 HOH D O 1 HETATM 4695 O O . HOH RA 5 . ? -2.865 45.192 0.397 1.00 28.78 ? 1360 HOH D O 1 HETATM 4696 O O . HOH RA 5 . ? -14.421 5.338 25.244 1.00 35.37 ? 1369 HOH D O 1 HETATM 4697 O O . HOH RA 5 . ? -8.351 1.967 25.644 1.00 26.38 ? 1382 HOH D O 1 HETATM 4698 O O . HOH RA 5 . ? -8.689 44.425 -6.416 1.00 33.94 ? 1386 HOH D O 1 HETATM 4699 O O . HOH RA 5 . ? 0.795 35.381 16.053 1.00 30.73 ? 1395 HOH D O 1 HETATM 4700 O O . HOH RA 5 . ? -3.598 29.556 16.128 1.00 33.65 ? 1399 HOH D O 1 HETATM 4701 O O . HOH RA 5 . ? -1.555 25.750 13.759 1.00 36.57 ? 1400 HOH D O 1 HETATM 4702 O O . HOH RA 5 . ? -4.592 23.246 1.629 1.00 29.65 ? 1401 HOH D O 1 HETATM 4703 O O . HOH RA 5 . ? -5.744 49.975 -2.324 1.00 33.85 ? 1410 HOH D O 1 HETATM 4704 O O . HOH RA 5 . ? 6.668 38.106 6.719 1.00 33.01 ? 1415 HOH D O 1 HETATM 4705 O O . HOH RA 5 . ? -9.973 37.584 -8.597 1.00 31.17 ? 1417 HOH D O 1 HETATM 4706 O O . HOH RA 5 . ? -10.639 31.183 -9.742 1.00 28.40 ? 1422 HOH D O 1 HETATM 4707 O O . HOH RA 5 . ? -1.415 28.097 15.929 1.00 32.58 ? 1423 HOH D O 1 HETATM 4708 O O . HOH RA 5 . ? -10.214 27.394 14.501 1.00 42.67 ? 1430 HOH D O 1 HETATM 4709 O O . HOH RA 5 . ? -19.026 28.507 -2.820 1.00 33.69 ? 1434 HOH D O 1 HETATM 4710 O O . HOH RA 5 . ? 4.863 47.109 19.433 1.00 43.54 ? 1445 HOH D O 1 HETATM 4711 O O . HOH RA 5 . ? 0.642 25.844 6.415 1.00 36.51 ? 1447 HOH D O 1 HETATM 4712 O O . HOH RA 5 . ? -7.120 51.988 13.409 1.00 35.92 ? 1449 HOH D O 1 HETATM 4713 O O . HOH RA 5 . ? -13.346 23.745 5.933 1.00 30.28 ? 1450 HOH D O 1 HETATM 4714 O O . HOH RA 5 . ? -4.507 17.466 3.627 1.00 38.80 ? 1457 HOH D O 1 HETATM 4715 O O . HOH RA 5 . ? -4.504 44.287 -2.734 1.00 29.08 ? 1462 HOH D O 1 HETATM 4716 O O . HOH RA 5 . ? -13.484 28.846 12.769 1.00 32.85 ? 1468 HOH D O 1 HETATM 4717 O O . HOH RA 5 . ? -17.987 38.651 -5.055 1.00 35.14 ? 1469 HOH D O 1 HETATM 4718 O O . HOH RA 5 . ? -16.552 26.048 0.229 1.00 38.12 ? 1476 HOH D O 1 HETATM 4719 O O . HOH RA 5 . ? 7.618 37.811 9.150 1.00 33.08 ? 1477 HOH D O 1 HETATM 4720 O O . HOH RA 5 . ? -16.003 27.663 -6.228 1.00 35.84 ? 1482 HOH D O 1 HETATM 4721 O O . HOH RA 5 . ? -5.864 6.162 26.934 1.00 37.76 ? 1492 HOH D O 1 HETATM 4722 O O . HOH RA 5 . ? 7.208 32.217 11.185 1.00 35.93 ? 1497 HOH D O 1 HETATM 4723 O O . HOH RA 5 . ? 9.763 50.662 10.551 1.00 37.43 ? 1501 HOH D O 1 HETATM 4724 O O . HOH RA 5 . ? -2.852 23.574 -5.242 1.00 30.89 ? 1502 HOH D O 1 HETATM 4725 O O . HOH RA 5 . ? -10.668 21.635 14.533 1.00 34.75 ? 1506 HOH D O 1 HETATM 4726 O O . HOH RA 5 . ? -6.763 46.223 -2.678 1.00 32.52 ? 1507 HOH D O 1 HETATM 4727 O O . HOH RA 5 . ? -10.288 54.799 1.062 1.00 40.72 ? 1509 HOH D O 1 HETATM 4728 O O . HOH RA 5 . ? -13.786 51.294 5.323 1.00 36.34 ? 1511 HOH D O 1 HETATM 4729 O O . HOH RA 5 . ? -12.751 50.974 15.584 1.00 41.59 ? 1520 HOH D O 1 HETATM 4730 O O . HOH RA 5 . ? -19.047 29.624 8.615 1.00 34.07 ? 1521 HOH D O 1 HETATM 4731 O O . HOH RA 5 . ? 2.825 40.283 16.596 1.00 38.19 ? 1525 HOH D O 1 HETATM 4732 O O . HOH RA 5 . ? -2.006 16.844 12.534 1.00 39.04 ? 1575 HOH D O 1 HETATM 4733 O O . HOH RA 5 . ? -1.247 12.933 6.095 1.00 39.14 ? 1576 HOH D O 1 HETATM 4734 O O . HOH RA 5 . ? -1.768 21.087 3.747 1.00 40.14 ? 1581 HOH D O 1 HETATM 4735 O O . HOH RA 5 . ? 2.986 25.043 8.730 1.00 47.00 ? 1582 HOH D O 1 HETATM 4736 O O . HOH RA 5 . ? -2.454 23.057 -0.372 1.00 40.51 ? 1583 HOH D O 1 HETATM 4737 O O . HOH RA 5 . ? -7.044 22.678 -2.440 1.00 36.19 ? 1584 HOH D O 1 HETATM 4738 O O . HOH RA 5 . ? 2.272 57.518 -1.711 1.00 38.89 ? 1585 HOH D O 1 HETATM 4739 O O . HOH RA 5 . ? -19.839 36.771 12.814 1.00 41.81 ? 1595 HOH D O 1 HETATM 4740 O O . HOH RA 5 . ? 13.060 49.334 1.632 1.00 48.45 ? 1606 HOH D O 1 HETATM 4741 O O . HOH RA 5 . ? 17.033 44.908 3.854 1.00 50.07 ? 1607 HOH D O 1 HETATM 4742 O O . HOH RA 5 . ? 15.822 46.095 1.856 1.00 41.11 ? 1608 HOH D 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 DC 1 751 751 DC C M . n A 1 2 DG 2 752 752 DG G M . n B 1 1 DC 1 753 753 DC C N . n B 1 2 DG 2 754 754 DG G N . n C 1 1 DC 1 755 755 DC C O . n C 1 2 DG 2 756 756 DG G O . n D 1 1 DC 1 757 757 DC C P . n D 1 2 DG 2 758 758 DG G P . n E 2 1 LYS 1 1 1 LYS LYS A . n E 2 2 GLU 2 2 2 GLU GLU A . n E 2 3 THR 3 3 3 THR THR A . n E 2 4 ALA 4 4 4 ALA ALA A . n E 2 5 ALA 5 5 5 ALA ALA A . n E 2 6 ALA 6 6 6 ALA ALA A . n E 2 7 LYS 7 7 7 LYS LYS A . n E 2 8 PHE 8 8 8 PHE PHE A . n E 2 9 GLU 9 9 9 GLU GLU A . n E 2 10 ARG 10 10 10 ARG ARG A . n E 2 11 GLN 11 11 11 GLN GLN A . n E 2 12 HIS 12 12 12 HIS HIS A . n E 2 13 MET 13 13 13 MET MET A . n E 2 14 ASP 14 14 14 ASP ASP A . n E 2 15 SER 15 15 15 SER SER A . n E 2 16 SER 16 16 16 SER SER A . n E 2 17 THR 17 17 17 THR THR A . n E 2 18 SER 18 18 18 SER SER A . n E 2 19 ALA 19 19 19 ALA ALA A . n E 2 20 ALA 20 20 20 ALA ALA A . n E 2 21 SER 21 21 21 SER SER A . n E 2 22 SER 22 22 22 SER SER A . n E 2 23 SER 23 23 23 SER SER A . n E 2 24 ASN 24 24 24 ASN ASN A . n E 2 25 TYR 25 25 25 TYR TYR A . n E 2 26 CYS 26 26 26 CYS CYS A . n E 2 27 ASN 27 27 27 ASN ASN A . n E 2 28 GLN 28 28 28 GLN GLN A . n E 2 29 MET 29 29 29 MET MET A . n E 2 30 MET 30 30 30 MET MET A . n E 2 31 LYS 31 31 31 LYS LYS A . n E 2 32 SER 32 32 32 SER SER A . n E 2 33 ARG 33 33 33 ARG ARG A . n E 2 34 ASN 34 34 34 ASN ASN A . n E 2 35 LEU 35 35 35 LEU LEU A . n E 2 36 THR 36 36 36 THR THR A . n E 2 37 LYS 37 37 37 LYS LYS A . n E 2 38 ASP 38 38 38 ASP ASP A . n E 2 39 ARG 39 39 39 ARG ARG A . n E 2 40 CYS 40 40 40 CYS CYS A . n E 2 41 LYS 41 41 41 LYS LYS A . n E 2 42 PRO 42 42 42 PRO PRO A . n E 2 43 VAL 43 43 43 VAL VAL A . n E 2 44 ASN 44 44 44 ASN ASN A . n E 2 45 THR 45 45 45 THR THR A . n E 2 46 PHE 46 46 46 PHE PHE A . n E 2 47 VAL 47 47 47 VAL VAL A . n E 2 48 HIS 48 48 48 HIS HIS A . n E 2 49 GLU 49 49 49 GLU GLU A . n E 2 50 SER 50 50 50 SER SER A . n E 2 51 LEU 51 51 51 LEU LEU A . n E 2 52 ALA 52 52 52 ALA ALA A . n E 2 53 ASP 53 53 53 ASP ASP A . n E 2 54 VAL 54 54 54 VAL VAL A . n E 2 55 GLN 55 55 55 GLN GLN A . n E 2 56 ALA 56 56 56 ALA ALA A . n E 2 57 VAL 57 57 57 VAL VAL A . n E 2 58 CYS 58 58 58 CYS CYS A . n E 2 59 SER 59 59 59 SER SER A . n E 2 60 GLN 60 60 60 GLN GLN A . n E 2 61 LYS 61 61 61 LYS LYS A . n E 2 62 ASN 62 62 62 ASN ASN A . n E 2 63 VAL 63 63 63 VAL VAL A . n E 2 64 ALA 64 64 64 ALA ALA A . n E 2 65 CYS 65 65 65 CYS CYS A . n E 2 66 LYS 66 66 66 LYS LYS A . n E 2 67 ASN 67 67 67 ASN ASN A . n E 2 68 GLY 68 68 68 GLY GLY A . n E 2 69 GLN 69 69 69 GLN GLN A . n E 2 70 THR 70 70 70 THR THR A . n E 2 71 ASN 71 71 71 ASN ASN A . n E 2 72 CYS 72 72 72 CYS CYS A . n E 2 73 TYR 73 73 73 TYR TYR A . n E 2 74 GLN 74 74 74 GLN GLN A . n E 2 75 SER 75 75 75 SER SER A . n E 2 76 TYR 76 76 76 TYR TYR A . n E 2 77 SER 77 77 77 SER SER A . n E 2 78 THR 78 78 78 THR THR A . n E 2 79 MET 79 79 79 MET MET A . n E 2 80 SER 80 80 80 SER SER A . n E 2 81 ILE 81 81 81 ILE ILE A . n E 2 82 THR 82 82 82 THR THR A . n E 2 83 ASP 83 83 83 ASP ASP A . n E 2 84 CYS 84 84 84 CYS CYS A . n E 2 85 ARG 85 85 85 ARG ARG A . n E 2 86 GLU 86 86 86 GLU GLU A . n E 2 87 THR 87 87 87 THR THR A . n E 2 88 GLY 88 88 88 GLY GLY A . n E 2 89 SER 89 89 89 SER SER A . n E 2 90 SER 90 90 90 SER SER A . n E 2 91 LYS 91 91 91 LYS LYS A . n E 2 92 TYR 92 92 92 TYR TYR A . n E 2 93 PRO 93 93 93 PRO PRO A . n E 2 94 ASN 94 94 94 ASN ASN A . n E 2 95 CYS 95 95 95 CYS CYS A . n E 2 96 ALA 96 96 96 ALA ALA A . n E 2 97 TYR 97 97 97 TYR TYR A . n E 2 98 LYS 98 98 98 LYS LYS A . n E 2 99 THR 99 99 99 THR THR A . n E 2 100 THR 100 100 100 THR THR A . n E 2 101 GLN 101 101 101 GLN GLN A . n E 2 102 ALA 102 102 102 ALA ALA A . n E 2 103 ASN 103 103 103 ASN ASN A . n E 2 104 LYS 104 104 104 LYS LYS A . n E 2 105 HIS 105 105 105 HIS HIS A . n E 2 106 ILE 106 106 106 ILE ILE A . n E 2 107 ILE 107 107 107 ILE ILE A . n E 2 108 VAL 108 108 108 VAL VAL A . n E 2 109 ALA 109 109 109 ALA ALA A . n E 2 110 CYS 110 110 110 CYS CYS A . n E 2 111 GLU 111 111 111 GLU GLU A . n E 2 112 GLY 112 112 112 GLY GLY A . n E 2 113 ASN 113 113 113 ASN ASN A . n E 2 114 PRO 114 114 114 PRO PRO A . n E 2 115 TYR 115 115 115 TYR TYR A . n E 2 116 VAL 116 116 116 VAL VAL A . n E 2 117 PRO 117 117 117 PRO PRO A . n E 2 118 VAL 118 118 118 VAL VAL A . n E 2 119 HIS 119 119 119 HIS HIS A . n E 2 120 PHE 120 120 120 PHE PHE A . n E 2 121 ASP 121 121 121 ASP ASP A . n E 2 122 ALA 122 122 122 ALA ALA A . n E 2 123 SER 123 123 123 SER SER A . n E 2 124 VAL 124 124 124 VAL VAL A . n F 2 1 LYS 1 201 201 LYS LYS B . n F 2 2 GLU 2 202 202 GLU GLU B . n F 2 3 THR 3 203 203 THR THR B . n F 2 4 ALA 4 204 204 ALA ALA B . n F 2 5 ALA 5 205 205 ALA ALA B . n F 2 6 ALA 6 206 206 ALA ALA B . n F 2 7 LYS 7 207 207 LYS LYS B . n F 2 8 PHE 8 208 208 PHE PHE B . n F 2 9 GLU 9 209 209 GLU GLU B . n F 2 10 ARG 10 210 210 ARG ARG B . n F 2 11 GLN 11 211 211 GLN GLN B . n F 2 12 HIS 12 212 212 HIS HIS B . n F 2 13 MET 13 213 213 MET MET B . n F 2 14 ASP 14 214 214 ASP ASP B . n F 2 15 SER 15 215 215 SER SER B . n F 2 16 SER 16 216 216 SER SER B . n F 2 17 THR 17 217 217 THR THR B . n F 2 18 SER 18 218 218 SER SER B . n F 2 19 ALA 19 219 219 ALA ALA B . n F 2 20 ALA 20 220 220 ALA ALA B . n F 2 21 SER 21 221 221 SER SER B . n F 2 22 SER 22 222 222 SER SER B . n F 2 23 SER 23 223 223 SER SER B . n F 2 24 ASN 24 224 224 ASN ASN B . n F 2 25 TYR 25 225 225 TYR TYR B . n F 2 26 CYS 26 226 226 CYS CYS B . n F 2 27 ASN 27 227 227 ASN ASN B . n F 2 28 GLN 28 228 228 GLN GLN B . n F 2 29 MET 29 229 229 MET MET B . n F 2 30 MET 30 230 230 MET MET B . n F 2 31 LYS 31 231 231 LYS LYS B . n F 2 32 SER 32 232 232 SER SER B . n F 2 33 ARG 33 233 233 ARG ARG B . n F 2 34 ASN 34 234 234 ASN ASN B . n F 2 35 LEU 35 235 235 LEU LEU B . n F 2 36 THR 36 236 236 THR THR B . n F 2 37 LYS 37 237 237 LYS LYS B . n F 2 38 ASP 38 238 238 ASP ASP B . n F 2 39 ARG 39 239 239 ARG ARG B . n F 2 40 CYS 40 240 240 CYS CYS B . n F 2 41 LYS 41 241 241 LYS LYS B . n F 2 42 PRO 42 242 242 PRO PRO B . n F 2 43 VAL 43 243 243 VAL VAL B . n F 2 44 ASN 44 244 244 ASN ASN B . n F 2 45 THR 45 245 245 THR THR B . n F 2 46 PHE 46 246 246 PHE PHE B . n F 2 47 VAL 47 247 247 VAL VAL B . n F 2 48 HIS 48 248 248 HIS HIS B . n F 2 49 GLU 49 249 249 GLU GLU B . n F 2 50 SER 50 250 250 SER SER B . n F 2 51 LEU 51 251 251 LEU LEU B . n F 2 52 ALA 52 252 252 ALA ALA B . n F 2 53 ASP 53 253 253 ASP ASP B . n F 2 54 VAL 54 254 254 VAL VAL B . n F 2 55 GLN 55 255 255 GLN GLN B . n F 2 56 ALA 56 256 256 ALA ALA B . n F 2 57 VAL 57 257 257 VAL VAL B . n F 2 58 CYS 58 258 258 CYS CYS B . n F 2 59 SER 59 259 259 SER SER B . n F 2 60 GLN 60 260 260 GLN GLN B . n F 2 61 LYS 61 261 261 LYS LYS B . n F 2 62 ASN 62 262 262 ASN ASN B . n F 2 63 VAL 63 263 263 VAL VAL B . n F 2 64 ALA 64 264 264 ALA ALA B . n F 2 65 CYS 65 265 265 CYS CYS B . n F 2 66 LYS 66 266 266 LYS LYS B . n F 2 67 ASN 67 267 267 ASN ASN B . n F 2 68 GLY 68 268 268 GLY GLY B . n F 2 69 GLN 69 269 269 GLN GLN B . n F 2 70 THR 70 270 270 THR THR B . n F 2 71 ASN 71 271 271 ASN ASN B . n F 2 72 CYS 72 272 272 CYS CYS B . n F 2 73 TYR 73 273 273 TYR TYR B . n F 2 74 GLN 74 274 274 GLN GLN B . n F 2 75 SER 75 275 275 SER SER B . n F 2 76 TYR 76 276 276 TYR TYR B . n F 2 77 SER 77 277 277 SER SER B . n F 2 78 THR 78 278 278 THR THR B . n F 2 79 MET 79 279 279 MET MET B . n F 2 80 SER 80 280 280 SER SER B . n F 2 81 ILE 81 281 281 ILE ILE B . n F 2 82 THR 82 282 282 THR THR B . n F 2 83 ASP 83 283 283 ASP ASP B . n F 2 84 CYS 84 284 284 CYS CYS B . n F 2 85 ARG 85 285 285 ARG ARG B . n F 2 86 GLU 86 286 286 GLU GLU B . n F 2 87 THR 87 287 287 THR THR B . n F 2 88 GLY 88 288 288 GLY GLY B . n F 2 89 SER 89 289 289 SER SER B . n F 2 90 SER 90 290 290 SER SER B . n F 2 91 LYS 91 291 291 LYS LYS B . n F 2 92 TYR 92 292 292 TYR TYR B . n F 2 93 PRO 93 293 293 PRO PRO B . n F 2 94 ASN 94 294 294 ASN ASN B . n F 2 95 CYS 95 295 295 CYS CYS B . n F 2 96 ALA 96 296 296 ALA ALA B . n F 2 97 TYR 97 297 297 TYR TYR B . n F 2 98 LYS 98 298 298 LYS LYS B . n F 2 99 THR 99 299 299 THR THR B . n F 2 100 THR 100 300 300 THR THR B . n F 2 101 GLN 101 301 301 GLN GLN B . n F 2 102 ALA 102 302 302 ALA ALA B . n F 2 103 ASN 103 303 303 ASN ASN B . n F 2 104 LYS 104 304 304 LYS LYS B . n F 2 105 HIS 105 305 305 HIS HIS B . n F 2 106 ILE 106 306 306 ILE ILE B . n F 2 107 ILE 107 307 307 ILE ILE B . n F 2 108 VAL 108 308 308 VAL VAL B . n F 2 109 ALA 109 309 309 ALA ALA B . n F 2 110 CYS 110 310 310 CYS CYS B . n F 2 111 GLU 111 311 311 GLU GLU B . n F 2 112 GLY 112 312 312 GLY GLY B . n F 2 113 ASN 113 313 313 ASN ASN B . n F 2 114 PRO 114 314 314 PRO PRO B . n F 2 115 TYR 115 315 315 TYR TYR B . n F 2 116 VAL 116 316 316 VAL VAL B . n F 2 117 PRO 117 317 317 PRO PRO B . n F 2 118 VAL 118 318 318 VAL VAL B . n F 2 119 HIS 119 319 319 HIS HIS B . n F 2 120 PHE 120 320 320 PHE PHE B . n F 2 121 ASP 121 321 321 ASP ASP B . n F 2 122 ALA 122 322 322 ALA ALA B . n F 2 123 SER 123 323 323 SER SER B . n F 2 124 VAL 124 324 324 VAL VAL B . n G 2 1 LYS 1 401 401 LYS LYS C . n G 2 2 GLU 2 402 402 GLU GLU C . n G 2 3 THR 3 403 403 THR THR C . n G 2 4 ALA 4 404 404 ALA ALA C . n G 2 5 ALA 5 405 405 ALA ALA C . n G 2 6 ALA 6 406 406 ALA ALA C . n G 2 7 LYS 7 407 407 LYS LYS C . n G 2 8 PHE 8 408 408 PHE PHE C . n G 2 9 GLU 9 409 409 GLU GLU C . n G 2 10 ARG 10 410 410 ARG ARG C . n G 2 11 GLN 11 411 411 GLN GLN C . n G 2 12 HIS 12 412 412 HIS HIS C . n G 2 13 MET 13 413 413 MET MET C . n G 2 14 ASP 14 414 414 ASP ASP C . n G 2 15 SER 15 415 415 SER SER C . n G 2 16 SER 16 416 416 SER SER C . n G 2 17 THR 17 417 417 THR THR C . n G 2 18 SER 18 418 418 SER SER C . n G 2 19 ALA 19 419 419 ALA ALA C . n G 2 20 ALA 20 420 420 ALA ALA C . n G 2 21 SER 21 421 421 SER SER C . n G 2 22 SER 22 422 422 SER SER C . n G 2 23 SER 23 423 423 SER SER C . n G 2 24 ASN 24 424 424 ASN ASN C . n G 2 25 TYR 25 425 425 TYR TYR C . n G 2 26 CYS 26 426 426 CYS CYS C . n G 2 27 ASN 27 427 427 ASN ASN C . n G 2 28 GLN 28 428 428 GLN GLN C . n G 2 29 MET 29 429 429 MET MET C . n G 2 30 MET 30 430 430 MET MET C . n G 2 31 LYS 31 431 431 LYS LYS C . n G 2 32 SER 32 432 432 SER SER C . n G 2 33 ARG 33 433 433 ARG ARG C . n G 2 34 ASN 34 434 434 ASN ASN C . n G 2 35 LEU 35 435 435 LEU LEU C . n G 2 36 THR 36 436 436 THR THR C . n G 2 37 LYS 37 437 437 LYS LYS C . n G 2 38 ASP 38 438 438 ASP ASP C . n G 2 39 ARG 39 439 439 ARG ARG C . n G 2 40 CYS 40 440 440 CYS CYS C . n G 2 41 LYS 41 441 441 LYS LYS C . n G 2 42 PRO 42 442 442 PRO PRO C . n G 2 43 VAL 43 443 443 VAL VAL C . n G 2 44 ASN 44 444 444 ASN ASN C . n G 2 45 THR 45 445 445 THR THR C . n G 2 46 PHE 46 446 446 PHE PHE C . n G 2 47 VAL 47 447 447 VAL VAL C . n G 2 48 HIS 48 448 448 HIS HIS C . n G 2 49 GLU 49 449 449 GLU GLU C . n G 2 50 SER 50 450 450 SER SER C . n G 2 51 LEU 51 451 451 LEU LEU C . n G 2 52 ALA 52 452 452 ALA ALA C . n G 2 53 ASP 53 453 453 ASP ASP C . n G 2 54 VAL 54 454 454 VAL VAL C . n G 2 55 GLN 55 455 455 GLN GLN C . n G 2 56 ALA 56 456 456 ALA ALA C . n G 2 57 VAL 57 457 457 VAL VAL C . n G 2 58 CYS 58 458 458 CYS CYS C . n G 2 59 SER 59 459 459 SER SER C . n G 2 60 GLN 60 460 460 GLN GLN C . n G 2 61 LYS 61 461 461 LYS LYS C . n G 2 62 ASN 62 462 462 ASN ASN C . n G 2 63 VAL 63 463 463 VAL VAL C . n G 2 64 ALA 64 464 464 ALA ALA C . n G 2 65 CYS 65 465 465 CYS CYS C . n G 2 66 LYS 66 466 466 LYS LYS C . n G 2 67 ASN 67 467 467 ASN ASN C . n G 2 68 GLY 68 468 468 GLY GLY C . n G 2 69 GLN 69 469 469 GLN GLN C . n G 2 70 THR 70 470 470 THR THR C . n G 2 71 ASN 71 471 471 ASN ASN C . n G 2 72 CYS 72 472 472 CYS CYS C . n G 2 73 TYR 73 473 473 TYR TYR C . n G 2 74 GLN 74 474 474 GLN GLN C . n G 2 75 SER 75 475 475 SER SER C . n G 2 76 TYR 76 476 476 TYR TYR C . n G 2 77 SER 77 477 477 SER SER C . n G 2 78 THR 78 478 478 THR THR C . n G 2 79 MET 79 479 479 MET MET C . n G 2 80 SER 80 480 480 SER SER C . n G 2 81 ILE 81 481 481 ILE ILE C . n G 2 82 THR 82 482 482 THR THR C . n G 2 83 ASP 83 483 483 ASP ASP C . n G 2 84 CYS 84 484 484 CYS CYS C . n G 2 85 ARG 85 485 485 ARG ARG C . n G 2 86 GLU 86 486 486 GLU GLU C . n G 2 87 THR 87 487 487 THR THR C . n G 2 88 GLY 88 488 488 GLY GLY C . n G 2 89 SER 89 489 489 SER SER C . n G 2 90 SER 90 490 490 SER SER C . n G 2 91 LYS 91 491 491 LYS LYS C . n G 2 92 TYR 92 492 492 TYR TYR C . n G 2 93 PRO 93 493 493 PRO PRO C . n G 2 94 ASN 94 494 494 ASN ASN C . n G 2 95 CYS 95 495 495 CYS CYS C . n G 2 96 ALA 96 496 496 ALA ALA C . n G 2 97 TYR 97 497 497 TYR TYR C . n G 2 98 LYS 98 498 498 LYS LYS C . n G 2 99 THR 99 499 499 THR THR C . n G 2 100 THR 100 500 500 THR THR C . n G 2 101 GLN 101 501 501 GLN GLN C . n G 2 102 ALA 102 502 502 ALA ALA C . n G 2 103 ASN 103 503 503 ASN ASN C . n G 2 104 LYS 104 504 504 LYS LYS C . n G 2 105 HIS 105 505 505 HIS HIS C . n G 2 106 ILE 106 506 506 ILE ILE C . n G 2 107 ILE 107 507 507 ILE ILE C . n G 2 108 VAL 108 508 508 VAL VAL C . n G 2 109 ALA 109 509 509 ALA ALA C . n G 2 110 CYS 110 510 510 CYS CYS C . n G 2 111 GLU 111 511 511 GLU GLU C . n G 2 112 GLY 112 512 512 GLY GLY C . n G 2 113 ASN 113 513 513 ASN ASN C . n G 2 114 PRO 114 514 514 PRO PRO C . n G 2 115 TYR 115 515 515 TYR TYR C . n G 2 116 VAL 116 516 516 VAL VAL C . n G 2 117 PRO 117 517 517 PRO PRO C . n G 2 118 VAL 118 518 518 VAL VAL C . n G 2 119 HIS 119 519 519 HIS HIS C . n G 2 120 PHE 120 520 520 PHE PHE C . n G 2 121 ASP 121 521 521 ASP ASP C . n G 2 122 ALA 122 522 522 ALA ALA C . n G 2 123 SER 123 523 523 SER SER C . n G 2 124 VAL 124 524 524 VAL VAL C . n H 2 1 LYS 1 601 601 LYS LYS D . n H 2 2 GLU 2 602 602 GLU GLU D . n H 2 3 THR 3 603 603 THR THR D . n H 2 4 ALA 4 604 604 ALA ALA D . n H 2 5 ALA 5 605 605 ALA ALA D . n H 2 6 ALA 6 606 606 ALA ALA D . n H 2 7 LYS 7 607 607 LYS LYS D . n H 2 8 PHE 8 608 608 PHE PHE D . n H 2 9 GLU 9 609 609 GLU GLU D . n H 2 10 ARG 10 610 610 ARG ARG D . n H 2 11 GLN 11 611 611 GLN GLN D . n H 2 12 HIS 12 612 612 HIS HIS D . n H 2 13 MET 13 613 613 MET MET D . n H 2 14 ASP 14 614 614 ASP ASP D . n H 2 15 SER 15 615 615 SER SER D . n H 2 16 SER 16 616 616 SER SER D . n H 2 17 THR 17 617 617 THR THR D . n H 2 18 SER 18 618 618 SER SER D . n H 2 19 ALA 19 619 619 ALA ALA D . n H 2 20 ALA 20 620 620 ALA ALA D . n H 2 21 SER 21 621 621 SER SER D . n H 2 22 SER 22 622 622 SER SER D . n H 2 23 SER 23 623 623 SER SER D . n H 2 24 ASN 24 624 624 ASN ASN D . n H 2 25 TYR 25 625 625 TYR TYR D . n H 2 26 CYS 26 626 626 CYS CYS D . n H 2 27 ASN 27 627 627 ASN ASN D . n H 2 28 GLN 28 628 628 GLN GLN D . n H 2 29 MET 29 629 629 MET MET D . n H 2 30 MET 30 630 630 MET MET D . n H 2 31 LYS 31 631 631 LYS LYS D . n H 2 32 SER 32 632 632 SER SER D . n H 2 33 ARG 33 633 633 ARG ARG D . n H 2 34 ASN 34 634 634 ASN ASN D . n H 2 35 LEU 35 635 635 LEU LEU D . n H 2 36 THR 36 636 636 THR THR D . n H 2 37 LYS 37 637 637 LYS LYS D . n H 2 38 ASP 38 638 638 ASP ASP D . n H 2 39 ARG 39 639 639 ARG ARG D . n H 2 40 CYS 40 640 640 CYS CYS D . n H 2 41 LYS 41 641 641 LYS LYS D . n H 2 42 PRO 42 642 642 PRO PRO D . n H 2 43 VAL 43 643 643 VAL VAL D . n H 2 44 ASN 44 644 644 ASN ASN D . n H 2 45 THR 45 645 645 THR THR D . n H 2 46 PHE 46 646 646 PHE PHE D . n H 2 47 VAL 47 647 647 VAL VAL D . n H 2 48 HIS 48 648 648 HIS HIS D . n H 2 49 GLU 49 649 649 GLU GLU D . n H 2 50 SER 50 650 650 SER SER D . n H 2 51 LEU 51 651 651 LEU LEU D . n H 2 52 ALA 52 652 652 ALA ALA D . n H 2 53 ASP 53 653 653 ASP ASP D . n H 2 54 VAL 54 654 654 VAL VAL D . n H 2 55 GLN 55 655 655 GLN GLN D . n H 2 56 ALA 56 656 656 ALA ALA D . n H 2 57 VAL 57 657 657 VAL VAL D . n H 2 58 CYS 58 658 658 CYS CYS D . n H 2 59 SER 59 659 659 SER SER D . n H 2 60 GLN 60 660 660 GLN GLN D . n H 2 61 LYS 61 661 661 LYS LYS D . n H 2 62 ASN 62 662 662 ASN ASN D . n H 2 63 VAL 63 663 663 VAL VAL D . n H 2 64 ALA 64 664 664 ALA ALA D . n H 2 65 CYS 65 665 665 CYS CYS D . n H 2 66 LYS 66 666 666 LYS LYS D . n H 2 67 ASN 67 667 667 ASN ASN D . n H 2 68 GLY 68 668 668 GLY GLY D . n H 2 69 GLN 69 669 669 GLN GLN D . n H 2 70 THR 70 670 670 THR THR D . n H 2 71 ASN 71 671 671 ASN ASN D . n H 2 72 CYS 72 672 672 CYS CYS D . n H 2 73 TYR 73 673 673 TYR TYR D . n H 2 74 GLN 74 674 674 GLN GLN D . n H 2 75 SER 75 675 675 SER SER D . n H 2 76 TYR 76 676 676 TYR TYR D . n H 2 77 SER 77 677 677 SER SER D . n H 2 78 THR 78 678 678 THR THR D . n H 2 79 MET 79 679 679 MET MET D . n H 2 80 SER 80 680 680 SER SER D . n H 2 81 ILE 81 681 681 ILE ILE D . n H 2 82 THR 82 682 682 THR THR D . n H 2 83 ASP 83 683 683 ASP ASP D . n H 2 84 CYS 84 684 684 CYS CYS D . n H 2 85 ARG 85 685 685 ARG ARG D . n H 2 86 GLU 86 686 686 GLU GLU D . n H 2 87 THR 87 687 687 THR THR D . n H 2 88 GLY 88 688 688 GLY GLY D . n H 2 89 SER 89 689 689 SER SER D . n H 2 90 SER 90 690 690 SER SER D . n H 2 91 LYS 91 691 691 LYS LYS D . n H 2 92 TYR 92 692 692 TYR TYR D . n H 2 93 PRO 93 693 693 PRO PRO D . n H 2 94 ASN 94 694 694 ASN ASN D . n H 2 95 CYS 95 695 695 CYS CYS D . n H 2 96 ALA 96 696 696 ALA ALA D . n H 2 97 TYR 97 697 697 TYR TYR D . n H 2 98 LYS 98 698 698 LYS LYS D . n H 2 99 THR 99 699 699 THR THR D . n H 2 100 THR 100 700 700 THR THR D . n H 2 101 GLN 101 701 701 GLN GLN D . n H 2 102 ALA 102 702 702 ALA ALA D . n H 2 103 ASN 103 703 703 ASN ASN D . n H 2 104 LYS 104 704 704 LYS LYS D . n H 2 105 HIS 105 705 705 HIS HIS D . n H 2 106 ILE 106 706 706 ILE ILE D . n H 2 107 ILE 107 707 707 ILE ILE D . n H 2 108 VAL 108 708 708 VAL VAL D . n H 2 109 ALA 109 709 709 ALA ALA D . n H 2 110 CYS 110 710 710 CYS CYS D . n H 2 111 GLU 111 711 711 GLU GLU D . n H 2 112 GLY 112 712 712 GLY GLY D . n H 2 113 ASN 113 713 713 ASN ASN D . n H 2 114 PRO 114 714 714 PRO PRO D . n H 2 115 TYR 115 715 715 TYR TYR D . n H 2 116 VAL 116 716 716 VAL VAL D . n H 2 117 PRO 117 717 717 PRO PRO D . n H 2 118 VAL 118 718 718 VAL VAL D . n H 2 119 HIS 119 719 719 HIS HIS D . n H 2 120 PHE 120 720 720 PHE PHE D . n H 2 121 ASP 121 721 721 ASP ASP D . n H 2 122 ALA 122 722 722 ALA ALA D . n H 2 123 SER 123 723 723 SER SER D . n H 2 124 VAL 124 724 724 VAL VAL D . n # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_defined_assembly ? dimeric 2 2 author_defined_assembly ? dimeric 2 3 author_defined_assembly ? dimeric 2 4 author_defined_assembly ? dimeric 2 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,E,J,K,L,M,N,O,P,KA,OA 2 1 B,F,Q,R,S,T,U,V,W,X,Y,Z,LA,PA 3 1 C,G,AA,BA,CA,DA,EA,MA,QA 4 1 D,H,I,FA,GA,HA,IA,JA,NA,RA # _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 2001-02-21 2 'Structure model' 1 1 2008-04-27 3 'Structure model' 1 2 2011-07-13 # _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 ? # 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' 'Non-polymer description' 3 3 'Structure model' 'Version format compliance' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal DENZO 'data reduction' . ? 1 SCALEPACK 'data scaling' . ? 2 AMoRE phasing . ? 3 CNS refinement . ? 4 # _pdbx_validate_symm_contact.id 1 _pdbx_validate_symm_contact.PDB_model_num 1 _pdbx_validate_symm_contact.auth_atom_id_1 O _pdbx_validate_symm_contact.auth_asym_id_1 D _pdbx_validate_symm_contact.auth_comp_id_1 SER _pdbx_validate_symm_contact.auth_seq_id_1 690 _pdbx_validate_symm_contact.PDB_ins_code_1 ? _pdbx_validate_symm_contact.label_alt_id_1 ? _pdbx_validate_symm_contact.site_symmetry_1 1_555 _pdbx_validate_symm_contact.auth_atom_id_2 O3 _pdbx_validate_symm_contact.auth_asym_id_2 C _pdbx_validate_symm_contact.auth_comp_id_2 GOL _pdbx_validate_symm_contact.auth_seq_id_2 919 _pdbx_validate_symm_contact.PDB_ins_code_2 ? _pdbx_validate_symm_contact.label_alt_id_2 ? _pdbx_validate_symm_contact.site_symmetry_2 2_555 _pdbx_validate_symm_contact.dist 1.96 # loop_ _pdbx_validate_rmsd_bond.id _pdbx_validate_rmsd_bond.PDB_model_num _pdbx_validate_rmsd_bond.auth_atom_id_1 _pdbx_validate_rmsd_bond.auth_asym_id_1 _pdbx_validate_rmsd_bond.auth_comp_id_1 _pdbx_validate_rmsd_bond.auth_seq_id_1 _pdbx_validate_rmsd_bond.PDB_ins_code_1 _pdbx_validate_rmsd_bond.label_alt_id_1 _pdbx_validate_rmsd_bond.auth_atom_id_2 _pdbx_validate_rmsd_bond.auth_asym_id_2 _pdbx_validate_rmsd_bond.auth_comp_id_2 _pdbx_validate_rmsd_bond.auth_seq_id_2 _pdbx_validate_rmsd_bond.PDB_ins_code_2 _pdbx_validate_rmsd_bond.label_alt_id_2 _pdbx_validate_rmsd_bond.bond_value _pdbx_validate_rmsd_bond.bond_target_value _pdbx_validate_rmsd_bond.bond_deviation _pdbx_validate_rmsd_bond.bond_standard_deviation _pdbx_validate_rmsd_bond.linker_flag 1 1 CA A SER 59 ? ? CB A SER 59 ? B 1.618 1.525 0.093 0.015 N 2 1 CA B SER 259 ? ? CB B SER 259 ? B 1.638 1.525 0.113 0.015 N 3 1 CA C SER 523 ? ? CB C SER 523 ? B 1.656 1.525 0.131 0.015 N 4 1 CA D SER 659 ? ? CB D SER 659 ? B 1.651 1.525 0.126 0.015 N 5 1 CA D VAL 724 ? ? CB D VAL 724 ? B 1.759 1.543 0.216 0.021 N # 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 NE A ARG 85 ? ? CZ A ARG 85 ? ? NH1 A ARG 85 ? ? 124.08 120.30 3.78 0.50 N 2 1 NE A ARG 85 ? ? CZ A ARG 85 ? ? NH2 A ARG 85 ? ? 117.19 120.30 -3.11 0.50 N 3 1 N D SER 659 ? ? CA D SER 659 ? ? CB D SER 659 ? B 100.79 110.50 -9.71 1.50 N # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 HIS A 48 ? ? -100.16 65.48 2 1 GLN A 60 ? ? -108.22 -132.50 3 1 SER B 222 ? ? 170.84 137.41 4 1 HIS B 248 ? ? -104.29 65.25 5 1 GLN B 260 ? ? -103.37 -133.80 6 1 ASN B 271 ? ? -96.82 36.08 7 1 ASN B 294 ? ? -114.83 76.91 8 1 HIS C 448 ? ? -103.64 63.86 9 1 GLN C 460 ? ? -103.06 -133.77 10 1 ASN C 494 ? ? -104.18 72.93 11 1 ASP D 614 ? ? -150.96 72.19 12 1 HIS D 648 ? ? -106.57 68.07 13 1 GLN D 660 ? ? -103.67 -130.33 14 1 ASN D 671 ? ? -95.78 35.67 15 1 LYS D 691 ? ? -165.16 110.05 16 1 ASN D 694 ? ? -105.73 69.21 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 'PHOSPHATE ION' PO4 4 GLYCEROL GOL 5 water HOH # 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 I 3 PO4 1 804 804 PO4 PO4 P . J 3 PO4 1 801 801 PO4 PO4 A . K 4 GOL 1 904 904 GOL GOL A . L 4 GOL 1 908 908 GOL GOL A . M 4 GOL 1 911 911 GOL GOL A . N 4 GOL 1 915 915 GOL GOL A . O 4 GOL 1 918 918 GOL GOL A . P 4 GOL 1 923 923 GOL GOL A . Q 3 PO4 1 802 802 PO4 PO4 B . R 4 GOL 1 902 902 GOL GOL B . S 4 GOL 1 905 905 GOL GOL B . T 4 GOL 1 906 906 GOL GOL B . U 4 GOL 1 907 907 GOL GOL B . V 4 GOL 1 910 910 GOL GOL B . W 4 GOL 1 914 914 GOL GOL B . X 4 GOL 1 920 920 GOL GOL B . Y 4 GOL 1 921 921 GOL GOL B . Z 4 GOL 1 922 922 GOL GOL B . AA 3 PO4 1 803 803 PO4 PO4 C . BA 4 GOL 1 903 903 GOL GOL C . CA 4 GOL 1 912 912 GOL GOL C . DA 4 GOL 1 917 917 GOL GOL C . EA 4 GOL 1 919 919 GOL GOL C . FA 4 GOL 1 901 901 GOL GOL D . GA 4 GOL 1 909 909 GOL GOL D . HA 4 GOL 1 913 913 GOL GOL D . IA 4 GOL 1 916 916 GOL GOL D . JA 4 GOL 1 924 924 GOL GOL D . KA 5 HOH 1 1214 1214 HOH WAT M . KA 5 HOH 2 1394 1394 HOH WAT M . KA 5 HOH 3 1441 1441 HOH WAT M . LA 5 HOH 1 1118 1118 HOH WAT N . LA 5 HOH 2 1153 1153 HOH WAT N . LA 5 HOH 3 1218 1218 HOH WAT N . LA 5 HOH 4 1234 1234 HOH WAT N . LA 5 HOH 5 1241 1241 HOH WAT N . LA 5 HOH 6 1246 1246 HOH WAT N . LA 5 HOH 7 1480 1480 HOH WAT N . MA 5 HOH 1 1211 1211 HOH WAT O . MA 5 HOH 2 1284 1284 HOH WAT O . MA 5 HOH 3 1478 1478 HOH WAT O . NA 5 HOH 1 1029 1029 HOH WAT P . NA 5 HOH 2 1132 1132 HOH WAT P . NA 5 HOH 3 1145 1145 HOH WAT P . NA 5 HOH 4 1160 1160 HOH WAT P . NA 5 HOH 5 1217 1217 HOH WAT P . NA 5 HOH 6 1273 1273 HOH WAT P . NA 5 HOH 7 1305 1305 HOH WAT P . OA 5 HOH 1 1002 1002 HOH WAT A . OA 5 HOH 2 1004 1004 HOH WAT A . OA 5 HOH 3 1008 1008 HOH WAT A . OA 5 HOH 4 1013 1013 HOH WAT A . OA 5 HOH 5 1014 1014 HOH WAT A . OA 5 HOH 6 1016 1016 HOH WAT A . OA 5 HOH 7 1017 1017 HOH WAT A . OA 5 HOH 8 1019 1019 HOH WAT A . OA 5 HOH 9 1030 1030 HOH WAT A . OA 5 HOH 10 1035 1035 HOH WAT A . OA 5 HOH 11 1039 1039 HOH WAT A . OA 5 HOH 12 1044 1044 HOH WAT A . OA 5 HOH 13 1049 1049 HOH WAT A . OA 5 HOH 14 1053 1053 HOH WAT A . OA 5 HOH 15 1054 1054 HOH WAT A . OA 5 HOH 16 1059 1059 HOH WAT A . OA 5 HOH 17 1062 1062 HOH WAT A . OA 5 HOH 18 1064 1064 HOH WAT A . OA 5 HOH 19 1065 1065 HOH WAT A . OA 5 HOH 20 1069 1069 HOH WAT A . OA 5 HOH 21 1075 1075 HOH WAT A . OA 5 HOH 22 1076 1076 HOH WAT A . OA 5 HOH 23 1077 1077 HOH WAT A . OA 5 HOH 24 1084 1084 HOH WAT A . OA 5 HOH 25 1085 1085 HOH WAT A . OA 5 HOH 26 1089 1089 HOH WAT A . OA 5 HOH 27 1094 1094 HOH WAT A . OA 5 HOH 28 1095 1095 HOH WAT A . OA 5 HOH 29 1096 1096 HOH WAT A . OA 5 HOH 30 1097 1097 HOH WAT A . OA 5 HOH 31 1099 1099 HOH WAT A . OA 5 HOH 32 1101 1101 HOH WAT A . OA 5 HOH 33 1105 1105 HOH WAT A . OA 5 HOH 34 1106 1106 HOH WAT A . OA 5 HOH 35 1115 1115 HOH WAT A . OA 5 HOH 36 1119 1119 HOH WAT A . OA 5 HOH 37 1121 1121 HOH WAT A . OA 5 HOH 38 1126 1126 HOH WAT A . OA 5 HOH 39 1127 1127 HOH WAT A . OA 5 HOH 40 1128 1128 HOH WAT A . OA 5 HOH 41 1133 1133 HOH WAT A . OA 5 HOH 42 1140 1140 HOH WAT A . OA 5 HOH 43 1142 1142 HOH WAT A . OA 5 HOH 44 1149 1149 HOH WAT A . OA 5 HOH 45 1156 1156 HOH WAT A . OA 5 HOH 46 1164 1164 HOH WAT A . OA 5 HOH 47 1171 1171 HOH WAT A . OA 5 HOH 48 1172 1172 HOH WAT A . OA 5 HOH 49 1173 1173 HOH WAT A . OA 5 HOH 50 1176 1176 HOH WAT A . OA 5 HOH 51 1181 1181 HOH WAT A . OA 5 HOH 52 1188 1188 HOH WAT A . OA 5 HOH 53 1197 1197 HOH WAT A . OA 5 HOH 54 1199 1199 HOH WAT A . OA 5 HOH 55 1201 1201 HOH WAT A . OA 5 HOH 56 1205 1205 HOH WAT A . OA 5 HOH 57 1213 1213 HOH WAT A . OA 5 HOH 58 1229 1229 HOH WAT A . OA 5 HOH 59 1236 1236 HOH WAT A . OA 5 HOH 60 1238 1238 HOH WAT A . OA 5 HOH 61 1240 1240 HOH WAT A . OA 5 HOH 62 1242 1242 HOH WAT A . OA 5 HOH 63 1245 1245 HOH WAT A . OA 5 HOH 64 1251 1251 HOH WAT A . OA 5 HOH 65 1252 1252 HOH WAT A . OA 5 HOH 66 1258 1258 HOH WAT A . OA 5 HOH 67 1264 1264 HOH WAT A . OA 5 HOH 68 1265 1265 HOH WAT A . OA 5 HOH 69 1279 1279 HOH WAT A . OA 5 HOH 70 1280 1280 HOH WAT A . OA 5 HOH 71 1282 1282 HOH WAT A . OA 5 HOH 72 1283 1283 HOH WAT A . OA 5 HOH 73 1290 1290 HOH WAT A . OA 5 HOH 74 1299 1299 HOH WAT A . OA 5 HOH 75 1309 1309 HOH WAT A . OA 5 HOH 76 1313 1313 HOH WAT A . OA 5 HOH 77 1316 1316 HOH WAT A . OA 5 HOH 78 1317 1317 HOH WAT A . OA 5 HOH 79 1318 1318 HOH WAT A . OA 5 HOH 80 1323 1323 HOH WAT A . OA 5 HOH 81 1325 1325 HOH WAT A . OA 5 HOH 82 1326 1326 HOH WAT A . OA 5 HOH 83 1329 1329 HOH WAT A . OA 5 HOH 84 1330 1330 HOH WAT A . OA 5 HOH 85 1333 1333 HOH WAT A . OA 5 HOH 86 1336 1336 HOH WAT A . OA 5 HOH 87 1338 1338 HOH WAT A . OA 5 HOH 88 1342 1342 HOH WAT A . OA 5 HOH 89 1345 1345 HOH WAT A . OA 5 HOH 90 1352 1352 HOH WAT A . OA 5 HOH 91 1353 1353 HOH WAT A . OA 5 HOH 92 1359 1359 HOH WAT A . OA 5 HOH 93 1365 1365 HOH WAT A . OA 5 HOH 94 1376 1376 HOH WAT A . OA 5 HOH 95 1377 1377 HOH WAT A . OA 5 HOH 96 1378 1378 HOH WAT A . OA 5 HOH 97 1380 1380 HOH WAT A . OA 5 HOH 98 1388 1388 HOH WAT A . OA 5 HOH 99 1389 1389 HOH WAT A . OA 5 HOH 100 1392 1392 HOH WAT A . OA 5 HOH 101 1403 1403 HOH WAT A . OA 5 HOH 102 1404 1404 HOH WAT A . OA 5 HOH 103 1405 1405 HOH WAT A . OA 5 HOH 104 1406 1406 HOH WAT A . OA 5 HOH 105 1408 1408 HOH WAT A . OA 5 HOH 106 1412 1412 HOH WAT A . OA 5 HOH 107 1414 1414 HOH WAT A . OA 5 HOH 108 1421 1421 HOH WAT A . OA 5 HOH 109 1427 1427 HOH WAT A . OA 5 HOH 110 1429 1429 HOH WAT A . OA 5 HOH 111 1432 1432 HOH WAT A . OA 5 HOH 112 1433 1433 HOH WAT A . OA 5 HOH 113 1448 1448 HOH WAT A . OA 5 HOH 114 1454 1454 HOH WAT A . OA 5 HOH 115 1458 1458 HOH WAT A . OA 5 HOH 116 1467 1467 HOH WAT A . OA 5 HOH 117 1471 1471 HOH WAT A . OA 5 HOH 118 1472 1472 HOH WAT A . OA 5 HOH 119 1474 1474 HOH WAT A . OA 5 HOH 120 1485 1485 HOH WAT A . OA 5 HOH 121 1486 1486 HOH WAT A . OA 5 HOH 122 1496 1496 HOH WAT A . OA 5 HOH 123 1499 1499 HOH WAT A . OA 5 HOH 124 1513 1513 HOH WAT A . OA 5 HOH 125 1518 1518 HOH WAT A . OA 5 HOH 126 1519 1519 HOH WAT A . OA 5 HOH 127 1523 1523 HOH WAT A . OA 5 HOH 128 1524 1524 HOH WAT A . OA 5 HOH 129 1537 1537 HOH WAT A . OA 5 HOH 130 1538 1538 HOH WAT A . OA 5 HOH 131 1539 1539 HOH WAT A . OA 5 HOH 132 1540 1540 HOH WAT A . OA 5 HOH 133 1541 1541 HOH WAT A . OA 5 HOH 134 1542 1542 HOH WAT A . OA 5 HOH 135 1543 1543 HOH WAT A . OA 5 HOH 136 1544 1544 HOH WAT A . OA 5 HOH 137 1545 1545 HOH WAT A . OA 5 HOH 138 1546 1546 HOH WAT A . OA 5 HOH 139 1547 1547 HOH WAT A . OA 5 HOH 140 1548 1548 HOH WAT A . OA 5 HOH 141 1549 1549 HOH WAT A . OA 5 HOH 142 1550 1550 HOH WAT A . OA 5 HOH 143 1553 1553 HOH WAT A . OA 5 HOH 144 1569 1569 HOH WAT A . OA 5 HOH 145 1574 1574 HOH WAT A . OA 5 HOH 146 1577 1577 HOH WAT A . OA 5 HOH 147 1578 1578 HOH WAT A . OA 5 HOH 148 1579 1579 HOH WAT A . OA 5 HOH 149 1588 1588 HOH WAT A . OA 5 HOH 150 1589 1589 HOH WAT A . OA 5 HOH 151 1590 1590 HOH WAT A . OA 5 HOH 152 1591 1591 HOH WAT A . OA 5 HOH 153 1594 1594 HOH WAT A . OA 5 HOH 154 1597 1597 HOH WAT A . PA 5 HOH 1 1000 1000 HOH WAT B . PA 5 HOH 2 1009 1009 HOH WAT B . PA 5 HOH 3 1010 1010 HOH WAT B . PA 5 HOH 4 1020 1020 HOH WAT B . PA 5 HOH 5 1024 1024 HOH WAT B . PA 5 HOH 6 1033 1033 HOH WAT B . PA 5 HOH 7 1037 1037 HOH WAT B . PA 5 HOH 8 1040 1040 HOH WAT B . PA 5 HOH 9 1046 1046 HOH WAT B . PA 5 HOH 10 1047 1047 HOH WAT B . PA 5 HOH 11 1050 1050 HOH WAT B . PA 5 HOH 12 1055 1055 HOH WAT B . PA 5 HOH 13 1056 1056 HOH WAT B . PA 5 HOH 14 1063 1063 HOH WAT B . PA 5 HOH 15 1066 1066 HOH WAT B . PA 5 HOH 16 1070 1070 HOH WAT B . PA 5 HOH 17 1073 1073 HOH WAT B . PA 5 HOH 18 1074 1074 HOH WAT B . PA 5 HOH 19 1078 1078 HOH WAT B . PA 5 HOH 20 1086 1086 HOH WAT B . PA 5 HOH 21 1111 1111 HOH WAT B . PA 5 HOH 22 1113 1113 HOH WAT B . PA 5 HOH 23 1114 1114 HOH WAT B . PA 5 HOH 24 1122 1122 HOH WAT B . PA 5 HOH 25 1123 1123 HOH WAT B . PA 5 HOH 26 1134 1134 HOH WAT B . PA 5 HOH 27 1138 1138 HOH WAT B . PA 5 HOH 28 1141 1141 HOH WAT B . PA 5 HOH 29 1144 1144 HOH WAT B . PA 5 HOH 30 1148 1148 HOH WAT B . PA 5 HOH 31 1161 1161 HOH WAT B . PA 5 HOH 32 1163 1163 HOH WAT B . PA 5 HOH 33 1167 1167 HOH WAT B . PA 5 HOH 34 1175 1175 HOH WAT B . PA 5 HOH 35 1182 1182 HOH WAT B . PA 5 HOH 36 1186 1186 HOH WAT B . PA 5 HOH 37 1187 1187 HOH WAT B . PA 5 HOH 38 1192 1192 HOH WAT B . PA 5 HOH 39 1193 1193 HOH WAT B . PA 5 HOH 40 1194 1194 HOH WAT B . PA 5 HOH 41 1195 1195 HOH WAT B . PA 5 HOH 42 1196 1196 HOH WAT B . PA 5 HOH 43 1206 1206 HOH WAT B . PA 5 HOH 44 1208 1208 HOH WAT B . PA 5 HOH 45 1215 1215 HOH WAT B . PA 5 HOH 46 1216 1216 HOH WAT B . PA 5 HOH 47 1221 1221 HOH WAT B . PA 5 HOH 48 1224 1224 HOH WAT B . PA 5 HOH 49 1226 1226 HOH WAT B . PA 5 HOH 50 1228 1228 HOH WAT B . PA 5 HOH 51 1235 1235 HOH WAT B . PA 5 HOH 52 1243 1243 HOH WAT B . PA 5 HOH 53 1253 1253 HOH WAT B . PA 5 HOH 54 1255 1255 HOH WAT B . PA 5 HOH 55 1256 1256 HOH WAT B . PA 5 HOH 56 1259 1259 HOH WAT B . PA 5 HOH 57 1260 1260 HOH WAT B . PA 5 HOH 58 1262 1262 HOH WAT B . PA 5 HOH 59 1266 1266 HOH WAT B . PA 5 HOH 60 1267 1267 HOH WAT B . PA 5 HOH 61 1269 1269 HOH WAT B . PA 5 HOH 62 1271 1271 HOH WAT B . PA 5 HOH 63 1274 1274 HOH WAT B . PA 5 HOH 64 1278 1278 HOH WAT B . PA 5 HOH 65 1293 1293 HOH WAT B . PA 5 HOH 66 1307 1307 HOH WAT B . PA 5 HOH 67 1327 1327 HOH WAT B . PA 5 HOH 68 1328 1328 HOH WAT B . PA 5 HOH 69 1332 1332 HOH WAT B . PA 5 HOH 70 1344 1344 HOH WAT B . PA 5 HOH 71 1347 1347 HOH WAT B . PA 5 HOH 72 1348 1348 HOH WAT B . PA 5 HOH 73 1356 1356 HOH WAT B . PA 5 HOH 74 1358 1358 HOH WAT B . PA 5 HOH 75 1364 1364 HOH WAT B . PA 5 HOH 76 1370 1370 HOH WAT B . PA 5 HOH 77 1371 1371 HOH WAT B . PA 5 HOH 78 1372 1372 HOH WAT B . PA 5 HOH 79 1373 1373 HOH WAT B . PA 5 HOH 80 1374 1374 HOH WAT B . PA 5 HOH 81 1384 1384 HOH WAT B . PA 5 HOH 82 1387 1387 HOH WAT B . PA 5 HOH 83 1391 1391 HOH WAT B . PA 5 HOH 84 1393 1393 HOH WAT B . PA 5 HOH 85 1396 1396 HOH WAT B . PA 5 HOH 86 1407 1407 HOH WAT B . PA 5 HOH 87 1409 1409 HOH WAT B . PA 5 HOH 88 1426 1426 HOH WAT B . PA 5 HOH 89 1431 1431 HOH WAT B . PA 5 HOH 90 1435 1435 HOH WAT B . PA 5 HOH 91 1436 1436 HOH WAT B . PA 5 HOH 92 1438 1438 HOH WAT B . PA 5 HOH 93 1442 1442 HOH WAT B . PA 5 HOH 94 1444 1444 HOH WAT B . PA 5 HOH 95 1451 1451 HOH WAT B . PA 5 HOH 96 1465 1465 HOH WAT B . PA 5 HOH 97 1475 1475 HOH WAT B . PA 5 HOH 98 1479 1479 HOH WAT B . PA 5 HOH 99 1483 1483 HOH WAT B . PA 5 HOH 100 1489 1489 HOH WAT B . PA 5 HOH 101 1494 1494 HOH WAT B . PA 5 HOH 102 1514 1514 HOH WAT B . PA 5 HOH 103 1517 1517 HOH WAT B . PA 5 HOH 104 1529 1529 HOH WAT B . PA 5 HOH 105 1530 1530 HOH WAT B . PA 5 HOH 106 1533 1533 HOH WAT B . PA 5 HOH 107 1534 1534 HOH WAT B . PA 5 HOH 108 1535 1535 HOH WAT B . PA 5 HOH 109 1536 1536 HOH WAT B . PA 5 HOH 110 1554 1554 HOH WAT B . PA 5 HOH 111 1555 1555 HOH WAT B . PA 5 HOH 112 1557 1557 HOH WAT B . PA 5 HOH 113 1558 1558 HOH WAT B . PA 5 HOH 114 1559 1559 HOH WAT B . PA 5 HOH 115 1560 1560 HOH WAT B . PA 5 HOH 116 1561 1561 HOH WAT B . PA 5 HOH 117 1562 1562 HOH WAT B . PA 5 HOH 118 1563 1563 HOH WAT B . PA 5 HOH 119 1564 1564 HOH WAT B . PA 5 HOH 120 1565 1565 HOH WAT B . PA 5 HOH 121 1566 1566 HOH WAT B . PA 5 HOH 122 1567 1567 HOH WAT B . PA 5 HOH 123 1568 1568 HOH WAT B . PA 5 HOH 124 1580 1580 HOH WAT B . PA 5 HOH 125 1592 1592 HOH WAT B . PA 5 HOH 126 1593 1593 HOH WAT B . PA 5 HOH 127 1596 1596 HOH WAT B . PA 5 HOH 128 1598 1598 HOH WAT B . PA 5 HOH 129 1599 1599 HOH WAT B . QA 5 HOH 1 1003 1003 HOH WAT C . QA 5 HOH 2 1005 1005 HOH WAT C . QA 5 HOH 3 1006 1006 HOH WAT C . QA 5 HOH 4 1007 1007 HOH WAT C . QA 5 HOH 5 1011 1011 HOH WAT C . QA 5 HOH 6 1012 1012 HOH WAT C . QA 5 HOH 7 1018 1018 HOH WAT C . QA 5 HOH 8 1022 1022 HOH WAT C . QA 5 HOH 9 1026 1026 HOH WAT C . QA 5 HOH 10 1027 1027 HOH WAT C . QA 5 HOH 11 1031 1031 HOH WAT C . QA 5 HOH 12 1036 1036 HOH WAT C . QA 5 HOH 13 1041 1041 HOH WAT C . QA 5 HOH 14 1042 1042 HOH WAT C . QA 5 HOH 15 1043 1043 HOH WAT C . QA 5 HOH 16 1045 1045 HOH WAT C . QA 5 HOH 17 1052 1052 HOH WAT C . QA 5 HOH 18 1057 1057 HOH WAT C . QA 5 HOH 19 1058 1058 HOH WAT C . QA 5 HOH 20 1068 1068 HOH WAT C . QA 5 HOH 21 1071 1071 HOH WAT C . QA 5 HOH 22 1083 1083 HOH WAT C . QA 5 HOH 23 1087 1087 HOH WAT C . QA 5 HOH 24 1088 1088 HOH WAT C . QA 5 HOH 25 1093 1093 HOH WAT C . QA 5 HOH 26 1098 1098 HOH WAT C . QA 5 HOH 27 1103 1103 HOH WAT C . QA 5 HOH 28 1104 1104 HOH WAT C . QA 5 HOH 29 1108 1108 HOH WAT C . QA 5 HOH 30 1109 1109 HOH WAT C . QA 5 HOH 31 1110 1110 HOH WAT C . QA 5 HOH 32 1112 1112 HOH WAT C . QA 5 HOH 33 1117 1117 HOH WAT C . QA 5 HOH 34 1125 1125 HOH WAT C . QA 5 HOH 35 1130 1130 HOH WAT C . QA 5 HOH 36 1131 1131 HOH WAT C . QA 5 HOH 37 1135 1135 HOH WAT C . QA 5 HOH 38 1136 1136 HOH WAT C . QA 5 HOH 39 1139 1139 HOH WAT C . QA 5 HOH 40 1146 1146 HOH WAT C . QA 5 HOH 41 1147 1147 HOH WAT C . QA 5 HOH 42 1150 1150 HOH WAT C . QA 5 HOH 43 1151 1151 HOH WAT C . QA 5 HOH 44 1152 1152 HOH WAT C . QA 5 HOH 45 1155 1155 HOH WAT C . QA 5 HOH 46 1157 1157 HOH WAT C . QA 5 HOH 47 1159 1159 HOH WAT C . QA 5 HOH 48 1162 1162 HOH WAT C . QA 5 HOH 49 1165 1165 HOH WAT C . QA 5 HOH 50 1166 1166 HOH WAT C . QA 5 HOH 51 1168 1168 HOH WAT C . QA 5 HOH 52 1169 1169 HOH WAT C . QA 5 HOH 53 1170 1170 HOH WAT C . QA 5 HOH 54 1174 1174 HOH WAT C . QA 5 HOH 55 1178 1178 HOH WAT C . QA 5 HOH 56 1179 1179 HOH WAT C . QA 5 HOH 57 1183 1183 HOH WAT C . QA 5 HOH 58 1184 1184 HOH WAT C . QA 5 HOH 59 1185 1185 HOH WAT C . QA 5 HOH 60 1191 1191 HOH WAT C . QA 5 HOH 61 1198 1198 HOH WAT C . QA 5 HOH 62 1209 1209 HOH WAT C . QA 5 HOH 63 1233 1233 HOH WAT C . QA 5 HOH 64 1237 1237 HOH WAT C . QA 5 HOH 65 1248 1248 HOH WAT C . QA 5 HOH 66 1250 1250 HOH WAT C . QA 5 HOH 67 1257 1257 HOH WAT C . QA 5 HOH 68 1263 1263 HOH WAT C . QA 5 HOH 69 1268 1268 HOH WAT C . QA 5 HOH 70 1275 1275 HOH WAT C . QA 5 HOH 71 1285 1285 HOH WAT C . QA 5 HOH 72 1286 1286 HOH WAT C . QA 5 HOH 73 1291 1291 HOH WAT C . QA 5 HOH 74 1294 1294 HOH WAT C . QA 5 HOH 75 1296 1296 HOH WAT C . QA 5 HOH 76 1297 1297 HOH WAT C . QA 5 HOH 77 1298 1298 HOH WAT C . QA 5 HOH 78 1300 1300 HOH WAT C . QA 5 HOH 79 1306 1306 HOH WAT C . QA 5 HOH 80 1310 1310 HOH WAT C . QA 5 HOH 81 1319 1319 HOH WAT C . QA 5 HOH 82 1322 1322 HOH WAT C . QA 5 HOH 83 1324 1324 HOH WAT C . QA 5 HOH 84 1335 1335 HOH WAT C . QA 5 HOH 85 1339 1339 HOH WAT C . QA 5 HOH 86 1343 1343 HOH WAT C . QA 5 HOH 87 1354 1354 HOH WAT C . QA 5 HOH 88 1361 1361 HOH WAT C . QA 5 HOH 89 1362 1362 HOH WAT C . QA 5 HOH 90 1363 1363 HOH WAT C . QA 5 HOH 91 1367 1367 HOH WAT C . QA 5 HOH 92 1379 1379 HOH WAT C . QA 5 HOH 93 1381 1381 HOH WAT C . QA 5 HOH 94 1385 1385 HOH WAT C . QA 5 HOH 95 1390 1390 HOH WAT C . QA 5 HOH 96 1398 1398 HOH WAT C . QA 5 HOH 97 1402 1402 HOH WAT C . QA 5 HOH 98 1411 1411 HOH WAT C . QA 5 HOH 99 1416 1416 HOH WAT C . QA 5 HOH 100 1419 1419 HOH WAT C . QA 5 HOH 101 1424 1424 HOH WAT C . QA 5 HOH 102 1425 1425 HOH WAT C . QA 5 HOH 103 1437 1437 HOH WAT C . QA 5 HOH 104 1443 1443 HOH WAT C . QA 5 HOH 105 1446 1446 HOH WAT C . QA 5 HOH 106 1455 1455 HOH WAT C . QA 5 HOH 107 1460 1460 HOH WAT C . QA 5 HOH 108 1464 1464 HOH WAT C . QA 5 HOH 109 1466 1466 HOH WAT C . QA 5 HOH 110 1481 1481 HOH WAT C . QA 5 HOH 111 1487 1487 HOH WAT C . QA 5 HOH 112 1503 1503 HOH WAT C . QA 5 HOH 113 1504 1504 HOH WAT C . QA 5 HOH 114 1515 1515 HOH WAT C . QA 5 HOH 115 1516 1516 HOH WAT C . QA 5 HOH 116 1526 1526 HOH WAT C . QA 5 HOH 117 1527 1527 HOH WAT C . QA 5 HOH 118 1532 1532 HOH WAT C . QA 5 HOH 119 1570 1570 HOH WAT C . QA 5 HOH 120 1571 1571 HOH WAT C . QA 5 HOH 121 1572 1572 HOH WAT C . QA 5 HOH 122 1573 1573 HOH WAT C . QA 5 HOH 123 1586 1586 HOH WAT C . QA 5 HOH 124 1587 1587 HOH WAT C . QA 5 HOH 125 1601 1601 HOH WAT C . QA 5 HOH 126 1602 1602 HOH WAT C . QA 5 HOH 127 1603 1603 HOH WAT C . QA 5 HOH 128 1604 1604 HOH WAT C . QA 5 HOH 129 1605 1605 HOH WAT C . QA 5 HOH 130 1609 1609 HOH WAT C . QA 5 HOH 131 1610 1610 HOH WAT C . QA 5 HOH 132 1611 1611 HOH WAT C . RA 5 HOH 1 1001 1001 HOH WAT D . RA 5 HOH 2 1015 1015 HOH WAT D . RA 5 HOH 3 1021 1021 HOH WAT D . RA 5 HOH 4 1023 1023 HOH WAT D . RA 5 HOH 5 1028 1028 HOH WAT D . RA 5 HOH 6 1032 1032 HOH WAT D . RA 5 HOH 7 1034 1034 HOH WAT D . RA 5 HOH 8 1038 1038 HOH WAT D . RA 5 HOH 9 1048 1048 HOH WAT D . RA 5 HOH 10 1051 1051 HOH WAT D . RA 5 HOH 11 1060 1060 HOH WAT D . RA 5 HOH 12 1067 1067 HOH WAT D . RA 5 HOH 13 1079 1079 HOH WAT D . RA 5 HOH 14 1080 1080 HOH WAT D . RA 5 HOH 15 1081 1081 HOH WAT D . RA 5 HOH 16 1082 1082 HOH WAT D . RA 5 HOH 17 1090 1090 HOH WAT D . RA 5 HOH 18 1092 1092 HOH WAT D . RA 5 HOH 19 1102 1102 HOH WAT D . RA 5 HOH 20 1107 1107 HOH WAT D . RA 5 HOH 21 1116 1116 HOH WAT D . RA 5 HOH 22 1120 1120 HOH WAT D . RA 5 HOH 23 1124 1124 HOH WAT D . RA 5 HOH 24 1129 1129 HOH WAT D . RA 5 HOH 25 1137 1137 HOH WAT D . RA 5 HOH 26 1143 1143 HOH WAT D . RA 5 HOH 27 1158 1158 HOH WAT D . RA 5 HOH 28 1177 1177 HOH WAT D . RA 5 HOH 29 1180 1180 HOH WAT D . RA 5 HOH 30 1189 1189 HOH WAT D . RA 5 HOH 31 1190 1190 HOH WAT D . RA 5 HOH 32 1200 1200 HOH WAT D . RA 5 HOH 33 1202 1202 HOH WAT D . RA 5 HOH 34 1203 1203 HOH WAT D . RA 5 HOH 35 1204 1204 HOH WAT D . RA 5 HOH 36 1207 1207 HOH WAT D . RA 5 HOH 37 1210 1210 HOH WAT D . RA 5 HOH 38 1212 1212 HOH WAT D . RA 5 HOH 39 1219 1219 HOH WAT D . RA 5 HOH 40 1220 1220 HOH WAT D . RA 5 HOH 41 1222 1222 HOH WAT D . RA 5 HOH 42 1223 1223 HOH WAT D . RA 5 HOH 43 1225 1225 HOH WAT D . RA 5 HOH 44 1227 1227 HOH WAT D . RA 5 HOH 45 1230 1230 HOH WAT D . RA 5 HOH 46 1231 1231 HOH WAT D . RA 5 HOH 47 1239 1239 HOH WAT D . RA 5 HOH 48 1249 1249 HOH WAT D . RA 5 HOH 49 1254 1254 HOH WAT D . RA 5 HOH 50 1270 1270 HOH WAT D . RA 5 HOH 51 1281 1281 HOH WAT D . RA 5 HOH 52 1288 1288 HOH WAT D . RA 5 HOH 53 1289 1289 HOH WAT D . RA 5 HOH 54 1292 1292 HOH WAT D . RA 5 HOH 55 1295 1295 HOH WAT D . RA 5 HOH 56 1301 1301 HOH WAT D . RA 5 HOH 57 1302 1302 HOH WAT D . RA 5 HOH 58 1303 1303 HOH WAT D . RA 5 HOH 59 1308 1308 HOH WAT D . RA 5 HOH 60 1311 1311 HOH WAT D . RA 5 HOH 61 1314 1314 HOH WAT D . RA 5 HOH 62 1321 1321 HOH WAT D . RA 5 HOH 63 1331 1331 HOH WAT D . RA 5 HOH 64 1334 1334 HOH WAT D . RA 5 HOH 65 1341 1341 HOH WAT D . RA 5 HOH 66 1346 1346 HOH WAT D . RA 5 HOH 67 1349 1349 HOH WAT D . RA 5 HOH 68 1350 1350 HOH WAT D . RA 5 HOH 69 1351 1351 HOH WAT D . RA 5 HOH 70 1355 1355 HOH WAT D . RA 5 HOH 71 1357 1357 HOH WAT D . RA 5 HOH 72 1360 1360 HOH WAT D . RA 5 HOH 73 1369 1369 HOH WAT D . RA 5 HOH 74 1382 1382 HOH WAT D . RA 5 HOH 75 1386 1386 HOH WAT D . RA 5 HOH 76 1395 1395 HOH WAT D . RA 5 HOH 77 1399 1399 HOH WAT D . RA 5 HOH 78 1400 1400 HOH WAT D . RA 5 HOH 79 1401 1401 HOH WAT D . RA 5 HOH 80 1410 1410 HOH WAT D . RA 5 HOH 81 1415 1415 HOH WAT D . RA 5 HOH 82 1417 1417 HOH WAT D . RA 5 HOH 83 1422 1422 HOH WAT D . RA 5 HOH 84 1423 1423 HOH WAT D . RA 5 HOH 85 1430 1430 HOH WAT D . RA 5 HOH 86 1434 1434 HOH WAT D . RA 5 HOH 87 1445 1445 HOH WAT D . RA 5 HOH 88 1447 1447 HOH WAT D . RA 5 HOH 89 1449 1449 HOH WAT D . RA 5 HOH 90 1450 1450 HOH WAT D . RA 5 HOH 91 1457 1457 HOH WAT D . RA 5 HOH 92 1462 1462 HOH WAT D . RA 5 HOH 93 1468 1468 HOH WAT D . RA 5 HOH 94 1469 1469 HOH WAT D . RA 5 HOH 95 1476 1476 HOH WAT D . RA 5 HOH 96 1477 1477 HOH WAT D . RA 5 HOH 97 1482 1482 HOH WAT D . RA 5 HOH 98 1492 1492 HOH WAT D . RA 5 HOH 99 1497 1497 HOH WAT D . RA 5 HOH 100 1501 1501 HOH WAT D . RA 5 HOH 101 1502 1502 HOH WAT D . RA 5 HOH 102 1506 1506 HOH WAT D . RA 5 HOH 103 1507 1507 HOH WAT D . RA 5 HOH 104 1509 1509 HOH WAT D . RA 5 HOH 105 1511 1511 HOH WAT D . RA 5 HOH 106 1520 1520 HOH WAT D . RA 5 HOH 107 1521 1521 HOH WAT D . RA 5 HOH 108 1525 1525 HOH WAT D . RA 5 HOH 109 1575 1575 HOH WAT D . RA 5 HOH 110 1576 1576 HOH WAT D . RA 5 HOH 111 1581 1581 HOH WAT D . RA 5 HOH 112 1582 1582 HOH WAT D . RA 5 HOH 113 1583 1583 HOH WAT D . RA 5 HOH 114 1584 1584 HOH WAT D . RA 5 HOH 115 1585 1585 HOH WAT D . RA 5 HOH 116 1595 1595 HOH WAT D . RA 5 HOH 117 1606 1606 HOH WAT D . RA 5 HOH 118 1607 1607 HOH WAT D . RA 5 HOH 119 1608 1608 HOH WAT D . #