data_17273 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17273 _Entry.Title ; Solution Structures of human PIWI-like 1 PAZ domain with ssRNA (5'-pUGACA) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-11-01 _Entry.Accession_date 2010-11-01 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Lei Zeng . . . 17273 2 Qiang Zhang . . . 17273 3 Kelley Yan . . . 17273 4 Ming-Ming Zhou . . . 17273 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17273 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID PAZ . 17273 piRNA . 17273 PIWI . 17273 ssRNA . 17273 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17273 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 456 17273 '15N chemical shifts' 138 17273 '1H chemical shifts' 878 17273 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2011-05-13 2010-11-01 update BMRB 'update entry citation' 17273 1 . . 2011-04-08 2010-11-01 original author 'original release' 17273 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17272 'human PIWI-like 1 PAZ domain' 17273 PDB 2L5D 'BMRB Entry Tracking System' 17273 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17273 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21465557 _Citation.Full_citation . _Citation.Title 'Structural insights into piRNA recognition by the human PIWI-like 1 PAZ domain.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Proteins _Citation.Journal_name_full Proteins _Citation.Journal_volume 79 _Citation.Journal_issue 6 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 2004 _Citation.Page_last 2009 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lei Zeng . . . 17273 1 2 Qiang Zhang . . . 17273 1 3 Kelley Yan . . . 17273 1 4 Ming-Ming Zhou . . . 17273 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17273 _Assembly.ID 1 _Assembly.Name 'human PIWI-like 1 PAZ domain with ssRNA (5'-pUGACA)' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 PAZ_domain 1 $PAZ_domain A . yes native no no . . . 17273 1 2 ssRNA 2 $RNA B . no native no no . . . 17273 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PAZ_domain _Entity.Sf_category entity _Entity.Sf_framecode PAZ_domain _Entity.Entry_ID 17273 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PAZ_domain _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; CTDVSHKVLRSETVLDFMFN FYHQTEEHKFQEQVSKELIG LVVLTKYNNKTYRVDDIDWD QNPKSTFKKADGSEVSFLEY YRKQYNQEITDLKQPVLVSQ PKRRRGPGGTLPGPAMLIPE LCYLTGLTDKMRND ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 134 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not available' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15673.891 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 17272 . "Human PIWI-like 1 PAZ domain" . . . . . 100.00 134 100.00 100.00 1.87e-94 . . . . 17273 1 2 no PDB 2L5C . "Solution Structures Of Human Piwi-Like 1 Paz Domain" . . . . . 100.00 134 100.00 100.00 1.87e-94 . . . . 17273 1 3 no PDB 2L5D . "Solution Structures Of Human Piwi-Like 1 Paz Domain With Ssrna (5'- Pugaca)" . . . . . 100.00 134 100.00 100.00 1.87e-94 . . . . 17273 1 4 no PDB 2XFM . "Complex Structure Of The Miwi Paz Domain Bound To Methylated Single Stranded Rna" . . . . . 93.28 150 97.60 98.40 7.30e-85 . . . . 17273 1 5 no PDB 3O3I . "Crystal Structure Of Human Hiwi1 Paz Domain (Residues 277-399) In Complex With 14-Mer Rna (12-Bp + 2-Nt Overhang) Containing 2'" . . . . . 92.54 124 100.00 100.00 3.87e-86 . . . . 17273 1 6 no PDB 3O6E . "Crystal Structure Of Human Hiwi1 Paz Domain (Residues 277-399) In Complex With 14-Mer Rna (12-Bp + 2-Nt Overhang) Containing 2'" . . . . . 92.54 124 98.39 98.39 4.53e-84 . . . . 17273 1 7 no PDB 3O7V . "Crystal Structure Of Human Hiwi1 (V361m) Paz Domain (Residues 277-399) In Complex With 14-Mer Rna (12-Bp + 2-Nt Overhang) Conta" . . . . . 92.54 124 97.58 97.58 3.41e-83 . . . . 17273 1 8 no DBJ BAA93705 . "MIWI [Mus musculus]" . . . . . 100.00 862 97.76 98.51 9.53e-85 . . . . 17273 1 9 no DBJ BAC04068 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 829 100.00 100.00 4.45e-87 . . . . 17273 1 10 no DBJ BAF49084 . "piwi-like 1 [Homo sapiens]" . . . . . 100.00 530 99.25 100.00 2.16e-89 . . . . 17273 1 11 no GB AAC97371 . "HIWI [Homo sapiens]" . . . . . 100.00 861 98.51 98.51 1.18e-84 . . . . 17273 1 12 no GB AAH28581 . "Piwi-like 1 (Drosophila) [Homo sapiens]" . . . . . 100.00 861 100.00 100.00 8.01e-87 . . . . 17273 1 13 no GB AAH66846 . "Piwil1 protein, partial [Mus musculus]" . . . . . 100.00 485 97.01 97.76 2.83e-87 . . . . 17273 1 14 no GB AAI29858 . "Piwi-like homolog 1 (Drosophila) [Mus musculus]" . . . . . 100.00 862 97.76 98.51 9.53e-85 . . . . 17273 1 15 no GB AAI29859 . "Piwil1 protein [Mus musculus]" . . . . . 100.00 835 97.76 98.51 5.77e-85 . . . . 17273 1 16 no REF NP_001102323 . "piwi-like protein 1 [Rattus norvegicus]" . . . . . 100.00 862 97.76 98.51 9.53e-85 . . . . 17273 1 17 no REF NP_001177900 . "piwi-like protein 1 isoform 2 [Homo sapiens]" . . . . . 100.00 829 100.00 100.00 4.45e-87 . . . . 17273 1 18 no REF NP_001181902 . "piwi-like protein 1 [Sus scrofa]" . . . . . 100.00 861 97.76 99.25 6.74e-85 . . . . 17273 1 19 no REF NP_001182640 . "piwi-like protein 1 [Macaca mulatta]" . . . . . 100.00 861 100.00 100.00 8.44e-87 . . . . 17273 1 20 no REF NP_001302505 . "piwi-like protein 1 [Bos taurus]" . . . . . 100.00 861 97.76 99.25 2.22e-85 . . . . 17273 1 21 no SP Q96J94 . "RecName: Full=Piwi-like protein 1" . . . . . 100.00 861 100.00 100.00 8.01e-87 . . . . 17273 1 22 no SP Q9JMB7 . "RecName: Full=Piwi-like protein 1" . . . . . 100.00 862 97.76 98.51 9.53e-85 . . . . 17273 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 266 CYS . 17273 1 2 267 THR . 17273 1 3 268 ASP . 17273 1 4 269 VAL . 17273 1 5 270 SER . 17273 1 6 271 HIS . 17273 1 7 272 LYS . 17273 1 8 273 VAL . 17273 1 9 274 LEU . 17273 1 10 275 ARG . 17273 1 11 276 SER . 17273 1 12 277 GLU . 17273 1 13 278 THR . 17273 1 14 279 VAL . 17273 1 15 280 LEU . 17273 1 16 281 ASP . 17273 1 17 282 PHE . 17273 1 18 283 MET . 17273 1 19 284 PHE . 17273 1 20 285 ASN . 17273 1 21 286 PHE . 17273 1 22 287 TYR . 17273 1 23 288 HIS . 17273 1 24 289 GLN . 17273 1 25 290 THR . 17273 1 26 291 GLU . 17273 1 27 292 GLU . 17273 1 28 293 HIS . 17273 1 29 294 LYS . 17273 1 30 295 PHE . 17273 1 31 296 GLN . 17273 1 32 297 GLU . 17273 1 33 298 GLN . 17273 1 34 299 VAL . 17273 1 35 300 SER . 17273 1 36 301 LYS . 17273 1 37 302 GLU . 17273 1 38 303 LEU . 17273 1 39 304 ILE . 17273 1 40 305 GLY . 17273 1 41 306 LEU . 17273 1 42 307 VAL . 17273 1 43 308 VAL . 17273 1 44 309 LEU . 17273 1 45 310 THR . 17273 1 46 311 LYS . 17273 1 47 312 TYR . 17273 1 48 313 ASN . 17273 1 49 314 ASN . 17273 1 50 315 LYS . 17273 1 51 316 THR . 17273 1 52 317 TYR . 17273 1 53 318 ARG . 17273 1 54 319 VAL . 17273 1 55 320 ASP . 17273 1 56 321 ASP . 17273 1 57 322 ILE . 17273 1 58 323 ASP . 17273 1 59 324 TRP . 17273 1 60 325 ASP . 17273 1 61 326 GLN . 17273 1 62 327 ASN . 17273 1 63 328 PRO . 17273 1 64 329 LYS . 17273 1 65 330 SER . 17273 1 66 331 THR . 17273 1 67 332 PHE . 17273 1 68 333 LYS . 17273 1 69 334 LYS . 17273 1 70 335 ALA . 17273 1 71 336 ASP . 17273 1 72 337 GLY . 17273 1 73 338 SER . 17273 1 74 339 GLU . 17273 1 75 340 VAL . 17273 1 76 341 SER . 17273 1 77 342 PHE . 17273 1 78 343 LEU . 17273 1 79 344 GLU . 17273 1 80 345 TYR . 17273 1 81 346 TYR . 17273 1 82 347 ARG . 17273 1 83 348 LYS . 17273 1 84 349 GLN . 17273 1 85 350 TYR . 17273 1 86 351 ASN . 17273 1 87 352 GLN . 17273 1 88 353 GLU . 17273 1 89 354 ILE . 17273 1 90 355 THR . 17273 1 91 356 ASP . 17273 1 92 357 LEU . 17273 1 93 358 LYS . 17273 1 94 359 GLN . 17273 1 95 360 PRO . 17273 1 96 361 VAL . 17273 1 97 362 LEU . 17273 1 98 363 VAL . 17273 1 99 364 SER . 17273 1 100 365 GLN . 17273 1 101 366 PRO . 17273 1 102 367 LYS . 17273 1 103 368 ARG . 17273 1 104 369 ARG . 17273 1 105 370 ARG . 17273 1 106 371 GLY . 17273 1 107 372 PRO . 17273 1 108 373 GLY . 17273 1 109 374 GLY . 17273 1 110 375 THR . 17273 1 111 376 LEU . 17273 1 112 377 PRO . 17273 1 113 378 GLY . 17273 1 114 379 PRO . 17273 1 115 380 ALA . 17273 1 116 381 MET . 17273 1 117 382 LEU . 17273 1 118 383 ILE . 17273 1 119 384 PRO . 17273 1 120 385 GLU . 17273 1 121 386 LEU . 17273 1 122 387 CYS . 17273 1 123 388 TYR . 17273 1 124 389 LEU . 17273 1 125 390 THR . 17273 1 126 391 GLY . 17273 1 127 392 LEU . 17273 1 128 393 THR . 17273 1 129 394 ASP . 17273 1 130 395 LYS . 17273 1 131 396 MET . 17273 1 132 397 ARG . 17273 1 133 398 ASN . 17273 1 134 399 ASP . 17273 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . CYS 1 1 17273 1 . THR 2 2 17273 1 . ASP 3 3 17273 1 . VAL 4 4 17273 1 . SER 5 5 17273 1 . HIS 6 6 17273 1 . LYS 7 7 17273 1 . VAL 8 8 17273 1 . LEU 9 9 17273 1 . ARG 10 10 17273 1 . SER 11 11 17273 1 . GLU 12 12 17273 1 . THR 13 13 17273 1 . VAL 14 14 17273 1 . LEU 15 15 17273 1 . ASP 16 16 17273 1 . PHE 17 17 17273 1 . MET 18 18 17273 1 . PHE 19 19 17273 1 . ASN 20 20 17273 1 . PHE 21 21 17273 1 . TYR 22 22 17273 1 . HIS 23 23 17273 1 . GLN 24 24 17273 1 . THR 25 25 17273 1 . GLU 26 26 17273 1 . GLU 27 27 17273 1 . HIS 28 28 17273 1 . LYS 29 29 17273 1 . PHE 30 30 17273 1 . GLN 31 31 17273 1 . GLU 32 32 17273 1 . GLN 33 33 17273 1 . VAL 34 34 17273 1 . SER 35 35 17273 1 . LYS 36 36 17273 1 . GLU 37 37 17273 1 . LEU 38 38 17273 1 . ILE 39 39 17273 1 . GLY 40 40 17273 1 . LEU 41 41 17273 1 . VAL 42 42 17273 1 . VAL 43 43 17273 1 . LEU 44 44 17273 1 . THR 45 45 17273 1 . LYS 46 46 17273 1 . TYR 47 47 17273 1 . ASN 48 48 17273 1 . ASN 49 49 17273 1 . LYS 50 50 17273 1 . THR 51 51 17273 1 . TYR 52 52 17273 1 . ARG 53 53 17273 1 . VAL 54 54 17273 1 . ASP 55 55 17273 1 . ASP 56 56 17273 1 . ILE 57 57 17273 1 . ASP 58 58 17273 1 . TRP 59 59 17273 1 . ASP 60 60 17273 1 . GLN 61 61 17273 1 . ASN 62 62 17273 1 . PRO 63 63 17273 1 . LYS 64 64 17273 1 . SER 65 65 17273 1 . THR 66 66 17273 1 . PHE 67 67 17273 1 . LYS 68 68 17273 1 . LYS 69 69 17273 1 . ALA 70 70 17273 1 . ASP 71 71 17273 1 . GLY 72 72 17273 1 . SER 73 73 17273 1 . GLU 74 74 17273 1 . VAL 75 75 17273 1 . SER 76 76 17273 1 . PHE 77 77 17273 1 . LEU 78 78 17273 1 . GLU 79 79 17273 1 . TYR 80 80 17273 1 . TYR 81 81 17273 1 . ARG 82 82 17273 1 . LYS 83 83 17273 1 . GLN 84 84 17273 1 . TYR 85 85 17273 1 . ASN 86 86 17273 1 . GLN 87 87 17273 1 . GLU 88 88 17273 1 . ILE 89 89 17273 1 . THR 90 90 17273 1 . ASP 91 91 17273 1 . LEU 92 92 17273 1 . LYS 93 93 17273 1 . GLN 94 94 17273 1 . PRO 95 95 17273 1 . VAL 96 96 17273 1 . LEU 97 97 17273 1 . VAL 98 98 17273 1 . SER 99 99 17273 1 . GLN 100 100 17273 1 . PRO 101 101 17273 1 . LYS 102 102 17273 1 . ARG 103 103 17273 1 . ARG 104 104 17273 1 . ARG 105 105 17273 1 . GLY 106 106 17273 1 . PRO 107 107 17273 1 . GLY 108 108 17273 1 . GLY 109 109 17273 1 . THR 110 110 17273 1 . LEU 111 111 17273 1 . PRO 112 112 17273 1 . GLY 113 113 17273 1 . PRO 114 114 17273 1 . ALA 115 115 17273 1 . MET 116 116 17273 1 . LEU 117 117 17273 1 . ILE 118 118 17273 1 . PRO 119 119 17273 1 . GLU 120 120 17273 1 . LEU 121 121 17273 1 . CYS 122 122 17273 1 . TYR 123 123 17273 1 . LEU 124 124 17273 1 . THR 125 125 17273 1 . GLY 126 126 17273 1 . LEU 127 127 17273 1 . THR 128 128 17273 1 . ASP 129 129 17273 1 . LYS 130 130 17273 1 . MET 131 131 17273 1 . ARG 132 132 17273 1 . ASN 133 133 17273 1 . ASP 134 134 17273 1 stop_ save_ save_RNA _Entity.Sf_category entity _Entity.Sf_framecode RNA _Entity.Entry_ID 17273 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name RNA _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code UGAXA _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer yes _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 5 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . U . 17273 2 2 . G . 17273 2 3 . A . 17273 2 4 . CYT . 17273 2 5 . A . 17273 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . U 1 1 17273 2 . G 2 2 17273 2 . A 3 3 17273 2 . CYT 4 4 17273 2 . A 5 5 17273 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 17273 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $PAZ_domain . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens BL21(DE3) . . . . . . . . . . . . . . . . . . . . 17273 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 17273 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $PAZ_domain . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pGEX4T-1 . . . . . . 17273 1 2 2 $RNA . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 17273 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CYT _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CYT _Chem_comp.Entry_ID 17273 _Chem_comp.ID CYT _Chem_comp.Provenance . _Chem_comp.Name 6-AMINOPYRIMIDIN-2(1H)-ONE _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code CYT _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CYT _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic no _Chem_comp.Aromatic yes _Chem_comp.Formula 'C4 H5 N3 O' _Chem_comp.Formula_weight 111.102 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Jun 9 13:38:00 2009 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID C1=C(NC(=O)N=C1)N SMILES 'OpenEye OEToolkits' 1.5.0 17273 CYT C1=C(NC(=O)N=C1)N SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 17273 CYT InChI=1/C4H5N3O/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8)/f/h7H,5H2 InChI InChI 1.02b 17273 CYT NC1=CC=NC(=O)N1 SMILES CACTVS 3.341 17273 CYT NC1=CC=NC(=O)N1 SMILES_CANONICAL CACTVS 3.341 17273 CYT O=C1N=CC=C(N)N1 SMILES ACDLabs 10.04 17273 CYT OPTASPLRGRRNAP-PTAWIYCUCW InChIKey InChI 1.02b 17273 CYT stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID 4-amino-3H-pyrimidin-2-one 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 17273 CYT 6-aminopyrimidin-2(1H)-one 'SYSTEMATIC NAME' ACDLabs 10.04 17273 CYT stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID C2 . C2 . . C . . N 0 . . . . . . . . . . 115.431 . 16.978 . 5.082 . -0.931 -2.520 -1.928 . . 17273 CYT C4 . C4 . . C . . N 0 . . . . . . . . . . 113.623 . 18.547 . 5.241 . 0.341 -0.883 -3.202 . . 17273 CYT C5 . C5 . . C . . N 0 . . . . . . . . . . 113.285 . 18.354 . 3.864 . 0.498 -0.109 -2.124 . . 17273 CYT C6 . C6 . . C . . N 0 . . . . . . . . . . 114.046 . 17.457 . 3.137 . -0.124 -0.631 -0.895 . . 17273 CYT H5 . H5 . . H . . N 0 . . . . . . . . . . 112.465 . 18.890 . 3.409 . 1.030 0.832 -2.104 . . 17273 CYT H6 . H6 . . H . . N 0 . . . . . . . . . . 113.812 . 17.278 . 2.098 . 0.001 -0.001 0.000 . . 17273 CYT HN3 . HN3 . . H . . N 0 . . . . . . . . . . 114.911 . 18.028 . 6.763 . -0.452 -2.618 -3.955 . . 17273 CYT HN41 . HN41 . . H . . N 0 . . . . . . . . . . 112.705 . 19.037 . 6.904 . 1.766 -0.078 -4.418 . . 17273 CYT HN42 . HN42 . . H . . N 0 . . . . . . . . . . 113.396 . 20.288 . 6.115 . 0.341 -0.687 -5.232 . . 17273 CYT N1 . N1 . . N . . N 0 . . . . . . . . . . 115.137 . 16.765 . 3.744 . -0.784 -1.739 -0.794 . . 17273 CYT N3 . N3 . . N . . N 0 . . . . . . . . . . 114.683 . 17.867 . 5.803 . -0.356 -2.061 -3.112 . . 17273 CYT N4 . N4 . . N . . N 0 . . . . . . . . . . 112.883 . 19.437 . 6.005 . 0.871 -0.510 -4.410 . . 17273 CYT O2 . O2 . . O . . N 0 . . . . . . . . . . 116.381 . 16.375 . 5.630 . -1.546 -3.587 -1.909 . . 17273 CYT stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N3 C4 . . . . 17273 CYT 2 . SING N3 C2 . . . . 17273 CYT 3 . SING N3 HN3 . . . . 17273 CYT 4 . SING C4 N4 . . . . 17273 CYT 5 . DOUB C4 C5 . . . . 17273 CYT 6 . SING N1 C2 . . . . 17273 CYT 7 . DOUB N1 C6 . . . . 17273 CYT 8 . DOUB C2 O2 . . . . 17273 CYT 9 . SING N4 HN41 . . . . 17273 CYT 10 . SING N4 HN42 . . . . 17273 CYT 11 . SING C5 C6 . . . . 17273 CYT 12 . SING C5 H5 . . . . 17273 CYT 13 . SING C6 H6 . . . . 17273 CYT stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17273 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 100 . . mM . . . . 17273 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17273 1 3 DTT '[U-100% 2H]' . . . . . . 5 . . mM . . . . 17273 1 4 D2O 'natural abundance' . . . . . . 100 . . % . . . . 17273 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17273 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 100 . . mM . . . . 17273 2 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17273 2 3 DTT '[U-100% 2H]' . . . . . . 5 . . mM . . . . 17273 2 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17273 2 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17273 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17273 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 . pH 17273 1 pressure 1 . atm 17273 1 temperature 298 . K 17273 1 stop_ save_ ############################ # Computer software used # ############################ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 17273 _Software.ID 1 _Software.Name ARIA _Software.Version 2.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Linge, O'Donoghue and Nilges' . . 17273 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17273 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17273 _Software.ID 2 _Software.Name NMRPipe _Software.Version 2.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17273 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift calculation' 17273 2 processing 17273 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 17273 _Software.ID 3 _Software.Name NMRView _Software.Version 5.04 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 17273 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17273 3 'data analysis' 17273 3 'peak picking' 17273 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17273 _Software.ID 4 _Software.Name CNS _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 17273 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17273 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17273 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17273 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 17273 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 17273 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17273 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 17273 1 2 spectrometer_2 Bruker Avance . 600 . . . 17273 1 3 spectrometer_3 Bruker DRX . 500 . . . 17273 1 4 spectrometer_4 Bruker Avance . 500 . . . 17273 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 17273 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17273 1 2 '3D HN(COCA)CB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17273 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17273 1 4 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17273 1 5 '3D 13C-Edited-13C/15N-filtered NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17273 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17273 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 . . . . . . ppm . . . . . . . . . . . . . 17273 1 H 1 water protons . . . . ppm 4.85 internal direct 1 . . . . . . . . . 17273 1 N 15 . . . . . . ppm . . . . . . . . . . . . . 17273 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17273 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.04 _Assigned_chem_shift_list.Chem_shift_13C_err 0.4 _Assigned_chem_shift_list.Chem_shift_15N_err 0.4 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' . . . 17273 1 2 '3D HN(COCA)CB' . . . 17273 1 3 '3D 1H-15N NOESY' . . . 17273 1 4 '3D 1H-13C NOESY' . . . 17273 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 THR HA H 1 4.427 0.04 . 1 . . . . 267 T HA . 17273 1 2 . 1 1 2 2 THR HB H 1 4.249 0.04 . 1 . . . . 267 T HB . 17273 1 3 . 1 1 2 2 THR HG21 H 1 1.233 0.04 . 1 . . . . 267 T HG21 . 17273 1 4 . 1 1 2 2 THR HG22 H 1 1.233 0.04 . 1 . . . . 267 T HG21 . 17273 1 5 . 1 1 2 2 THR HG23 H 1 1.233 0.04 . 1 . . . . 267 T HG21 . 17273 1 6 . 1 1 2 2 THR CA C 13 61.870 0.4 . 1 . . . . 267 T CA . 17273 1 7 . 1 1 2 2 THR CB C 13 69.651 0.4 . 1 . . . . 267 T CB . 17273 1 8 . 1 1 2 2 THR CG2 C 13 21.170 0.4 . 1 . . . . 267 T CG2 . 17273 1 9 . 1 1 3 3 ASP H H 1 8.611 0.04 . 1 . . . . 268 D HN . 17273 1 10 . 1 1 3 3 ASP HA H 1 4.710 0.04 . 1 . . . . 268 D HA . 17273 1 11 . 1 1 3 3 ASP HB2 H 1 2.766 0.04 . 2 . . . . 268 D HB1 . 17273 1 12 . 1 1 3 3 ASP HB3 H 1 2.671 0.04 . 2 . . . . 268 D HB2 . 17273 1 13 . 1 1 3 3 ASP CA C 13 54.183 0.4 . 1 . . . . 268 D CA . 17273 1 14 . 1 1 3 3 ASP CB C 13 41.193 0.4 . 1 . . . . 268 D CB . 17273 1 15 . 1 1 3 3 ASP N N 15 123.620 0.4 . 1 . . . . 268 D N . 17273 1 16 . 1 1 4 4 VAL H H 1 8.270 0.04 . 1 . . . . 269 V HN . 17273 1 17 . 1 1 4 4 VAL HA H 1 4.209 0.04 . 1 . . . . 269 V HA . 17273 1 18 . 1 1 4 4 VAL HB H 1 2.193 0.04 . 1 . . . . 269 V HB . 17273 1 19 . 1 1 4 4 VAL HG11 H 1 0.946 0.04 . 2 . . . . 269 V HG11 . 17273 1 20 . 1 1 4 4 VAL HG12 H 1 0.946 0.04 . 2 . . . . 269 V HG11 . 17273 1 21 . 1 1 4 4 VAL HG13 H 1 0.946 0.04 . 2 . . . . 269 V HG11 . 17273 1 22 . 1 1 4 4 VAL HG21 H 1 0.948 0.04 . 2 . . . . 269 V HG21 . 17273 1 23 . 1 1 4 4 VAL HG22 H 1 0.948 0.04 . 2 . . . . 269 V HG21 . 17273 1 24 . 1 1 4 4 VAL HG23 H 1 0.948 0.04 . 2 . . . . 269 V HG21 . 17273 1 25 . 1 1 4 4 VAL CA C 13 62.180 0.4 . 1 . . . . 269 V CA . 17273 1 26 . 1 1 4 4 VAL CB C 13 32.414 0.4 . 1 . . . . 269 V CB . 17273 1 27 . 1 1 4 4 VAL CG1 C 13 21.145 0.4 . 1 . . . . 269 V CG1 . 17273 1 28 . 1 1 4 4 VAL CG2 C 13 19.992 0.4 . 1 . . . . 269 V CG2 . 17273 1 29 . 1 1 4 4 VAL N N 15 120.240 0.4 . 1 . . . . 269 V N . 17273 1 30 . 1 1 5 5 SER H H 1 8.429 0.04 . 1 . . . . 270 S HN . 17273 1 31 . 1 1 5 5 SER HA H 1 4.393 0.04 . 1 . . . . 270 S HA . 17273 1 32 . 1 1 5 5 SER HB2 H 1 3.874 0.04 . 2 . . . . 270 S HB1 . 17273 1 33 . 1 1 5 5 SER CA C 13 58.682 0.4 . 1 . . . . 270 S CA . 17273 1 34 . 1 1 5 5 SER CB C 13 63.700 0.4 . 1 . . . . 270 S CB . 17273 1 35 . 1 1 5 5 SER N N 15 118.761 0.4 . 1 . . . . 270 S N . 17273 1 36 . 1 1 6 6 HIS H H 1 8.654 0.04 . 1 . . . . 271 H HN . 17273 1 37 . 1 1 6 6 HIS HA H 1 4.711 0.04 . 1 . . . . 271 H HA . 17273 1 38 . 1 1 6 6 HIS HB2 H 1 3.261 0.04 . 2 . . . . 271 H HB1 . 17273 1 39 . 1 1 6 6 HIS HB3 H 1 3.149 0.04 . 2 . . . . 271 H HB2 . 17273 1 40 . 1 1 6 6 HIS HD2 H 1 7.195 0.04 . 3 . . . . 271 H HD2 . 17273 1 41 . 1 1 6 6 HIS CA C 13 55.597 0.4 . 1 . . . . 271 H CA . 17273 1 42 . 1 1 6 6 HIS CB C 13 29.660 0.4 . 1 . . . . 271 H CB . 17273 1 43 . 1 1 6 6 HIS CD2 C 13 119.806 0.4 . 1 . . . . 271 H CD2 . 17273 1 44 . 1 1 6 6 HIS N N 15 119.470 0.4 . 1 . . . . 271 H N . 17273 1 45 . 1 1 7 7 LYS H H 1 8.243 0.04 . 1 . . . . 272 K HN . 17273 1 46 . 1 1 7 7 LYS HA H 1 4.330 0.04 . 1 . . . . 272 K HA . 17273 1 47 . 1 1 7 7 LYS HB2 H 1 1.790 0.04 . 2 . . . . 272 K HB1 . 17273 1 48 . 1 1 7 7 LYS HD2 H 1 1.723 0.04 . 2 . . . . 272 K HD1 . 17273 1 49 . 1 1 7 7 LYS HE2 H 1 3.037 0.04 . 2 . . . . 272 K HE1 . 17273 1 50 . 1 1 7 7 LYS HG2 H 1 1.391 0.04 . 2 . . . . 272 K HG1 . 17273 1 51 . 1 1 7 7 LYS CA C 13 56.135 0.4 . 1 . . . . 272 K CA . 17273 1 52 . 1 1 7 7 LYS CB C 13 32.917 0.4 . 1 . . . . 272 K CB . 17273 1 53 . 1 1 7 7 LYS CD C 13 29.043 0.4 . 1 . . . . 272 K CD . 17273 1 54 . 1 1 7 7 LYS CE C 13 42.012 0.4 . 1 . . . . 272 K CE . 17273 1 55 . 1 1 7 7 LYS CG C 13 24.938 0.4 . 1 . . . . 272 K CG . 17273 1 56 . 1 1 7 7 LYS N N 15 122.575 0.4 . 1 . . . . 272 K N . 17273 1 57 . 1 1 8 8 VAL H H 1 8.226 0.04 . 1 . . . . 273 V HN . 17273 1 58 . 1 1 8 8 VAL HA H 1 4.108 0.04 . 1 . . . . 273 V HA . 17273 1 59 . 1 1 8 8 VAL HB H 1 2.074 0.04 . 1 . . . . 273 V HB . 17273 1 60 . 1 1 8 8 VAL HG11 H 1 0.953 0.04 . 2 . . . . 273 V HG11 . 17273 1 61 . 1 1 8 8 VAL HG12 H 1 0.953 0.04 . 2 . . . . 273 V HG11 . 17273 1 62 . 1 1 8 8 VAL HG13 H 1 0.953 0.04 . 2 . . . . 273 V HG11 . 17273 1 63 . 1 1 8 8 VAL HG21 H 1 0.966 0.04 . 2 . . . . 273 V HG21 . 17273 1 64 . 1 1 8 8 VAL HG22 H 1 0.966 0.04 . 2 . . . . 273 V HG21 . 17273 1 65 . 1 1 8 8 VAL HG23 H 1 0.966 0.04 . 2 . . . . 273 V HG21 . 17273 1 66 . 1 1 8 8 VAL CA C 13 62.300 0.4 . 1 . . . . 273 V CA . 17273 1 67 . 1 1 8 8 VAL CB C 13 32.715 0.4 . 1 . . . . 273 V CB . 17273 1 68 . 1 1 8 8 VAL CG1 C 13 21.042 0.4 . 1 . . . . 273 V CG1 . 17273 1 69 . 1 1 8 8 VAL CG2 C 13 20.648 0.4 . 1 . . . . 273 V CG2 . 17273 1 70 . 1 1 8 8 VAL N N 15 122.030 0.4 . 1 . . . . 273 V N . 17273 1 71 . 1 1 9 9 LEU H H 1 8.413 0.04 . 1 . . . . 274 L HN . 17273 1 72 . 1 1 9 9 LEU HA H 1 4.404 0.04 . 1 . . . . 274 L HA . 17273 1 73 . 1 1 9 9 LEU HB2 H 1 1.664 0.04 . 2 . . . . 274 L HB1 . 17273 1 74 . 1 1 9 9 LEU HB3 H 1 1.619 0.04 . 2 . . . . 274 L HB2 . 17273 1 75 . 1 1 9 9 LEU HD11 H 1 0.949 0.04 . 2 . . . . 274 L HD11 . 17273 1 76 . 1 1 9 9 LEU HD12 H 1 0.949 0.04 . 2 . . . . 274 L HD11 . 17273 1 77 . 1 1 9 9 LEU HD13 H 1 0.949 0.04 . 2 . . . . 274 L HD11 . 17273 1 78 . 1 1 9 9 LEU HD21 H 1 0.891 0.04 . 2 . . . . 274 L HD21 . 17273 1 79 . 1 1 9 9 LEU HD22 H 1 0.891 0.04 . 2 . . . . 274 L HD21 . 17273 1 80 . 1 1 9 9 LEU HD23 H 1 0.891 0.04 . 2 . . . . 274 L HD21 . 17273 1 81 . 1 1 9 9 LEU HG H 1 1.656 0.04 . 1 . . . . 274 L HG . 17273 1 82 . 1 1 9 9 LEU CA C 13 54.936 0.4 . 1 . . . . 274 L CA . 17273 1 83 . 1 1 9 9 LEU CB C 13 42.330 0.4 . 1 . . . . 274 L CB . 17273 1 84 . 1 1 9 9 LEU CD1 C 13 24.966 0.4 . 1 . . . . 274 L CD1 . 17273 1 85 . 1 1 9 9 LEU CD2 C 13 23.652 0.4 . 1 . . . . 274 L CD2 . 17273 1 86 . 1 1 9 9 LEU CG C 13 27.276 0.4 . 1 . . . . 274 L CG . 17273 1 87 . 1 1 9 9 LEU N N 15 126.825 0.4 . 1 . . . . 274 L N . 17273 1 88 . 1 1 10 10 ARG H H 1 8.389 0.04 . 1 . . . . 275 R HN . 17273 1 89 . 1 1 10 10 ARG HA H 1 4.401 0.04 . 1 . . . . 275 R HA . 17273 1 90 . 1 1 10 10 ARG HB2 H 1 1.840 0.04 . 2 . . . . 275 R HB1 . 17273 1 91 . 1 1 10 10 ARG HB3 H 1 1.784 0.04 . 2 . . . . 275 R HB2 . 17273 1 92 . 1 1 10 10 ARG HD2 H 1 3.236 0.04 . 2 . . . . 275 R HD1 . 17273 1 93 . 1 1 10 10 ARG HG2 H 1 1.660 0.04 . 2 . . . . 275 R HG1 . 17273 1 94 . 1 1 10 10 ARG CA C 13 55.685 0.4 . 1 . . . . 275 R CA . 17273 1 95 . 1 1 10 10 ARG CB C 13 31.038 0.4 . 1 . . . . 275 R CB . 17273 1 96 . 1 1 10 10 ARG CD C 13 43.291 0.4 . 1 . . . . 275 R CD . 17273 1 97 . 1 1 10 10 ARG CG C 13 27.195 0.4 . 1 . . . . 275 R CG . 17273 1 98 . 1 1 10 10 ARG N N 15 122.176 0.4 . 1 . . . . 275 R N . 17273 1 99 . 1 1 11 11 SER H H 1 8.466 0.04 . 1 . . . . 276 S HN . 17273 1 100 . 1 1 11 11 SER HA H 1 4.601 0.04 . 1 . . . . 276 S HA . 17273 1 101 . 1 1 11 11 SER HB2 H 1 3.879 0.04 . 2 . . . . 276 S HB1 . 17273 1 102 . 1 1 11 11 SER CA C 13 58.216 0.4 . 1 . . . . 276 S CA . 17273 1 103 . 1 1 11 11 SER CB C 13 63.890 0.4 . 1 . . . . 276 S CB . 17273 1 104 . 1 1 11 11 SER N N 15 117.618 0.4 . 1 . . . . 276 S N . 17273 1 105 . 1 1 12 12 GLU H H 1 8.681 0.04 . 1 . . . . 277 E HN . 17273 1 106 . 1 1 12 12 GLU HA H 1 4.774 0.04 . 1 . . . . 277 E HA . 17273 1 107 . 1 1 12 12 GLU HB2 H 1 2.311 0.04 . 2 . . . . 277 E HB1 . 17273 1 108 . 1 1 12 12 GLU HB3 H 1 2.224 0.04 . 2 . . . . 277 E HB2 . 17273 1 109 . 1 1 12 12 GLU HG2 H 1 2.484 0.04 . 2 . . . . 277 E HG1 . 17273 1 110 . 1 1 12 12 GLU CA C 13 56.572 0.4 . 1 . . . . 277 E CA . 17273 1 111 . 1 1 12 12 GLU CB C 13 31.880 0.4 . 1 . . . . 277 E CB . 17273 1 112 . 1 1 12 12 GLU CG C 13 36.500 0.4 . 1 . . . . 277 E CG . 17273 1 113 . 1 1 12 12 GLU N N 15 123.744 0.4 . 1 . . . . 277 E N . 17273 1 114 . 1 1 13 13 THR H H 1 9.126 0.04 . 1 . . . . 278 T HN . 17273 1 115 . 1 1 13 13 THR HA H 1 5.050 0.04 . 1 . . . . 278 T HA . 17273 1 116 . 1 1 13 13 THR HB H 1 4.672 0.04 . 1 . . . . 278 T HB . 17273 1 117 . 1 1 13 13 THR HG21 H 1 0.982 0.04 . 1 . . . . 278 T HG21 . 17273 1 118 . 1 1 13 13 THR HG22 H 1 0.982 0.04 . 1 . . . . 278 T HG21 . 17273 1 119 . 1 1 13 13 THR HG23 H 1 0.982 0.04 . 1 . . . . 278 T HG21 . 17273 1 120 . 1 1 13 13 THR CA C 13 60.214 0.4 . 1 . . . . 278 T CA . 17273 1 121 . 1 1 13 13 THR CB C 13 72.620 0.4 . 1 . . . . 278 T CB . 17273 1 122 . 1 1 13 13 THR CG2 C 13 20.938 0.4 . 1 . . . . 278 T CG2 . 17273 1 123 . 1 1 13 13 THR N N 15 113.765 0.4 . 1 . . . . 278 T N . 17273 1 124 . 1 1 14 14 VAL H H 1 8.734 0.04 . 1 . . . . 279 V HN . 17273 1 125 . 1 1 14 14 VAL HA H 1 3.610 0.04 . 1 . . . . 279 V HA . 17273 1 126 . 1 1 14 14 VAL HB H 1 2.220 0.04 . 1 . . . . 279 V HB . 17273 1 127 . 1 1 14 14 VAL HG11 H 1 0.811 0.04 . 2 . . . . 279 V HG11 . 17273 1 128 . 1 1 14 14 VAL HG12 H 1 0.811 0.04 . 2 . . . . 279 V HG11 . 17273 1 129 . 1 1 14 14 VAL HG13 H 1 0.811 0.04 . 2 . . . . 279 V HG11 . 17273 1 130 . 1 1 14 14 VAL HG21 H 1 0.993 0.04 . 2 . . . . 279 V HG21 . 17273 1 131 . 1 1 14 14 VAL HG22 H 1 0.993 0.04 . 2 . . . . 279 V HG21 . 17273 1 132 . 1 1 14 14 VAL HG23 H 1 0.993 0.04 . 2 . . . . 279 V HG21 . 17273 1 133 . 1 1 14 14 VAL CA C 13 65.885 0.4 . 1 . . . . 279 V CA . 17273 1 134 . 1 1 14 14 VAL CB C 13 30.584 0.4 . 1 . . . . 279 V CB . 17273 1 135 . 1 1 14 14 VAL CG1 C 13 24.657 0.4 . 1 . . . . 279 V CG1 . 17273 1 136 . 1 1 14 14 VAL CG2 C 13 23.270 0.4 . 1 . . . . 279 V CG2 . 17273 1 137 . 1 1 14 14 VAL N N 15 119.562 0.4 . 1 . . . . 279 V N . 17273 1 138 . 1 1 15 15 LEU H H 1 6.844 0.04 . 1 . . . . 280 L HN . 17273 1 139 . 1 1 15 15 LEU HA H 1 4.130 0.04 . 1 . . . . 280 L HA . 17273 1 140 . 1 1 15 15 LEU HB2 H 1 1.894 0.04 . 2 . . . . 280 L HB1 . 17273 1 141 . 1 1 15 15 LEU HB3 H 1 1.008 0.04 . 2 . . . . 280 L HB2 . 17273 1 142 . 1 1 15 15 LEU HD11 H 1 0.959 0.04 . 2 . . . . 280 L HD11 . 17273 1 143 . 1 1 15 15 LEU HD12 H 1 0.959 0.04 . 2 . . . . 280 L HD11 . 17273 1 144 . 1 1 15 15 LEU HD13 H 1 0.959 0.04 . 2 . . . . 280 L HD11 . 17273 1 145 . 1 1 15 15 LEU HD21 H 1 0.951 0.04 . 2 . . . . 280 L HD21 . 17273 1 146 . 1 1 15 15 LEU HD22 H 1 0.951 0.04 . 2 . . . . 280 L HD21 . 17273 1 147 . 1 1 15 15 LEU HD23 H 1 0.951 0.04 . 2 . . . . 280 L HD21 . 17273 1 148 . 1 1 15 15 LEU HG H 1 1.577 0.04 . 1 . . . . 280 L HG . 17273 1 149 . 1 1 15 15 LEU CA C 13 57.587 0.4 . 1 . . . . 280 L CA . 17273 1 150 . 1 1 15 15 LEU CB C 13 41.370 0.4 . 1 . . . . 280 L CB . 17273 1 151 . 1 1 15 15 LEU CD1 C 13 25.890 0.4 . 1 . . . . 280 L CD1 . 17273 1 152 . 1 1 15 15 LEU CD2 C 13 23.772 0.4 . 1 . . . . 280 L CD2 . 17273 1 153 . 1 1 15 15 LEU CG C 13 26.157 0.4 . 1 . . . . 280 L CG . 17273 1 154 . 1 1 15 15 LEU N N 15 120.286 0.4 . 1 . . . . 280 L N . 17273 1 155 . 1 1 16 16 ASP H H 1 7.754 0.04 . 1 . . . . 281 D HN . 17273 1 156 . 1 1 16 16 ASP HA H 1 4.447 0.04 . 1 . . . . 281 D HA . 17273 1 157 . 1 1 16 16 ASP HB2 H 1 3.170 0.04 . 2 . . . . 281 D HB1 . 17273 1 158 . 1 1 16 16 ASP HB3 H 1 2.880 0.04 . 2 . . . . 281 D HB2 . 17273 1 159 . 1 1 16 16 ASP CA C 13 57.759 0.4 . 1 . . . . 281 D CA . 17273 1 160 . 1 1 16 16 ASP CB C 13 40.718 0.4 . 1 . . . . 281 D CB . 17273 1 161 . 1 1 16 16 ASP N N 15 119.466 0.4 . 1 . . . . 281 D N . 17273 1 162 . 1 1 17 17 PHE H H 1 8.169 0.04 . 1 . . . . 282 F HN . 17273 1 163 . 1 1 17 17 PHE HA H 1 4.350 0.04 . 1 . . . . 282 F HA . 17273 1 164 . 1 1 17 17 PHE HB2 H 1 3.478 0.04 . 2 . . . . 282 F HB1 . 17273 1 165 . 1 1 17 17 PHE HB3 H 1 3.312 0.04 . 2 . . . . 282 F HB2 . 17273 1 166 . 1 1 17 17 PHE HD1 H 1 7.200 0.04 . 3 . . . . 282 F HD1 . 17273 1 167 . 1 1 17 17 PHE HE1 H 1 7.200 0.04 . 3 . . . . 282 F HE1 . 17273 1 168 . 1 1 17 17 PHE HZ H 1 7.350 0.04 . 1 . . . . 282 F HZ . 17273 1 169 . 1 1 17 17 PHE CA C 13 61.130 0.4 . 1 . . . . 282 F CA . 17273 1 170 . 1 1 17 17 PHE CB C 13 39.270 0.4 . 1 . . . . 282 F CB . 17273 1 171 . 1 1 17 17 PHE CD1 C 13 132.016 0.4 . 3 . . . . 282 F CD1 . 17273 1 172 . 1 1 17 17 PHE CE1 C 13 131.070 0.4 . 3 . . . . 282 F CE1 . 17273 1 173 . 1 1 17 17 PHE CZ C 13 130.180 0.4 . 1 . . . . 282 F CZ . 17273 1 174 . 1 1 17 17 PHE N N 15 120.637 0.4 . 1 . . . . 282 F N . 17273 1 175 . 1 1 18 18 MET H H 1 8.708 0.04 . 1 . . . . 283 M HN . 17273 1 176 . 1 1 18 18 MET HA H 1 3.999 0.04 . 1 . . . . 283 M HA . 17273 1 177 . 1 1 18 18 MET HB2 H 1 3.235 0.04 . 2 . . . . 283 M HB1 . 17273 1 178 . 1 1 18 18 MET HB3 H 1 2.466 0.04 . 2 . . . . 283 M HB2 . 17273 1 179 . 1 1 18 18 MET HE1 H 1 1.927 0.04 . 1 . . . . 283 M HE1 . 17273 1 180 . 1 1 18 18 MET HE2 H 1 1.927 0.04 . 1 . . . . 283 M HE1 . 17273 1 181 . 1 1 18 18 MET HE3 H 1 1.927 0.04 . 1 . . . . 283 M HE1 . 17273 1 182 . 1 1 18 18 MET HG2 H 1 2.583 0.04 . 2 . . . . 283 M HG1 . 17273 1 183 . 1 1 18 18 MET CA C 13 60.637 0.4 . 1 . . . . 283 M CA . 17273 1 184 . 1 1 18 18 MET CB C 13 34.027 0.4 . 1 . . . . 283 M CB . 17273 1 185 . 1 1 18 18 MET CE C 13 17.760 0.4 . 1 . . . . 283 M CE . 17273 1 186 . 1 1 18 18 MET CG C 13 34.027 0.4 . 1 . . . . 283 M CG . 17273 1 187 . 1 1 18 18 MET N N 15 118.687 0.4 . 1 . . . . 283 M N . 17273 1 188 . 1 1 19 19 PHE H H 1 8.582 0.04 . 1 . . . . 284 F HN . 17273 1 189 . 1 1 19 19 PHE HA H 1 4.352 0.04 . 1 . . . . 284 F HA . 17273 1 190 . 1 1 19 19 PHE HB2 H 1 3.314 0.04 . 2 . . . . 284 F HB1 . 17273 1 191 . 1 1 19 19 PHE HD1 H 1 7.337 0.04 . 3 . . . . 284 F HD1 . 17273 1 192 . 1 1 19 19 PHE HE1 H 1 7.387 0.04 . 3 . . . . 284 F HE1 . 17273 1 193 . 1 1 19 19 PHE CA C 13 61.097 0.4 . 1 . . . . 284 F CA . 17273 1 194 . 1 1 19 19 PHE CB C 13 38.790 0.4 . 1 . . . . 284 F CB . 17273 1 195 . 1 1 19 19 PHE CD1 C 13 131.449 0.4 . 3 . . . . 284 F CD1 . 17273 1 196 . 1 1 19 19 PHE CE1 C 13 130.014 0.4 . 3 . . . . 284 F CE1 . 17273 1 197 . 1 1 19 19 PHE N N 15 118.702 0.4 . 1 . . . . 284 F N . 17273 1 198 . 1 1 20 20 ASN H H 1 8.162 0.04 . 1 . . . . 285 N HN . 17273 1 199 . 1 1 20 20 ASN HA H 1 4.525 0.04 . 1 . . . . 285 N HA . 17273 1 200 . 1 1 20 20 ASN HB2 H 1 2.800 0.04 . 2 . . . . 285 N HB1 . 17273 1 201 . 1 1 20 20 ASN HB3 H 1 2.688 0.04 . 2 . . . . 285 N HB2 . 17273 1 202 . 1 1 20 20 ASN HD21 H 1 7.556 0.04 . 2 . . . . 285 N HD21 . 17273 1 203 . 1 1 20 20 ASN HD22 H 1 7.065 0.04 . 2 . . . . 285 N HD22 . 17273 1 204 . 1 1 20 20 ASN CA C 13 55.770 0.4 . 1 . . . . 285 N CA . 17273 1 205 . 1 1 20 20 ASN CB C 13 38.200 0.4 . 1 . . . . 285 N CB . 17273 1 206 . 1 1 20 20 ASN N N 15 117.627 0.4 . 1 . . . . 285 N N . 17273 1 207 . 1 1 20 20 ASN ND2 N 15 113.980 0.4 . 1 . . . . 285 N ND2 . 17273 1 208 . 1 1 21 21 PHE H H 1 8.195 0.04 . 1 . . . . 286 F HN . 17273 1 209 . 1 1 21 21 PHE HA H 1 4.187 0.04 . 1 . . . . 286 F HA . 17273 1 210 . 1 1 21 21 PHE HB2 H 1 3.181 0.04 . 2 . . . . 286 F HB1 . 17273 1 211 . 1 1 21 21 PHE HB3 H 1 2.925 0.04 . 2 . . . . 286 F HB2 . 17273 1 212 . 1 1 21 21 PHE HD1 H 1 7.171 0.04 . 3 . . . . 286 F HD1 . 17273 1 213 . 1 1 21 21 PHE HE1 H 1 7.097 0.04 . 3 . . . . 286 F HE1 . 17273 1 214 . 1 1 21 21 PHE HZ H 1 7.192 0.04 . 1 . . . . 286 F HZ . 17273 1 215 . 1 1 21 21 PHE CA C 13 60.234 0.4 . 1 . . . . 286 F CA . 17273 1 216 . 1 1 21 21 PHE CB C 13 39.536 0.4 . 1 . . . . 286 F CB . 17273 1 217 . 1 1 21 21 PHE CD1 C 13 131.934 0.4 . 3 . . . . 286 F CD1 . 17273 1 218 . 1 1 21 21 PHE CE1 C 13 131.089 0.4 . 3 . . . . 286 F CE1 . 17273 1 219 . 1 1 21 21 PHE CZ C 13 129.839 0.4 . 1 . . . . 286 F CZ . 17273 1 220 . 1 1 21 21 PHE N N 15 119.820 0.4 . 1 . . . . 286 F N . 17273 1 221 . 1 1 22 22 TYR H H 1 8.227 0.04 . 1 . . . . 287 Y HN . 17273 1 222 . 1 1 22 22 TYR HA H 1 3.921 0.04 . 1 . . . . 287 Y HA . 17273 1 223 . 1 1 22 22 TYR HB2 H 1 2.839 0.04 . 2 . . . . 287 Y HB1 . 17273 1 224 . 1 1 22 22 TYR HB3 H 1 2.722 0.04 . 2 . . . . 287 Y HB2 . 17273 1 225 . 1 1 22 22 TYR HD1 H 1 6.078 0.04 . 3 . . . . 287 Y HD1 . 17273 1 226 . 1 1 22 22 TYR HE1 H 1 6.580 0.04 . 3 . . . . 287 Y HE1 . 17273 1 227 . 1 1 22 22 TYR CA C 13 60.522 0.4 . 1 . . . . 287 Y CA . 17273 1 228 . 1 1 22 22 TYR CB C 13 38.224 0.4 . 1 . . . . 287 Y CB . 17273 1 229 . 1 1 22 22 TYR CD1 C 13 132.543 0.4 . 3 . . . . 287 Y CD1 . 17273 1 230 . 1 1 22 22 TYR CE1 C 13 117.830 0.4 . 3 . . . . 287 Y CE1 . 17273 1 231 . 1 1 22 22 TYR N N 15 120.555 0.4 . 1 . . . . 287 Y N . 17273 1 232 . 1 1 23 23 HIS H H 1 7.586 0.04 . 1 . . . . 288 H HN . 17273 1 233 . 1 1 23 23 HIS HA H 1 4.448 0.04 . 1 . . . . 288 H HA . 17273 1 234 . 1 1 23 23 HIS HB2 H 1 3.314 0.04 . 2 . . . . 288 H HB1 . 17273 1 235 . 1 1 23 23 HIS HB3 H 1 3.080 0.04 . 2 . . . . 288 H HB2 . 17273 1 236 . 1 1 23 23 HIS HD2 H 1 7.135 0.04 . 3 . . . . 288 H HD2 . 17273 1 237 . 1 1 23 23 HIS HE1 H 1 8.150 0.04 . 3 . . . . 288 H HE1 . 17273 1 238 . 1 1 23 23 HIS CA C 13 56.646 0.4 . 1 . . . . 288 H CA . 17273 1 239 . 1 1 23 23 HIS CB C 13 29.110 0.4 . 1 . . . . 288 H CB . 17273 1 240 . 1 1 23 23 HIS CD2 C 13 120.206 0.4 . 1 . . . . 288 H CD2 . 17273 1 241 . 1 1 23 23 HIS N N 15 115.550 0.4 . 1 . . . . 288 H N . 17273 1 242 . 1 1 24 24 GLN H H 1 7.761 0.04 . 1 . . . . 289 Q HN . 17273 1 243 . 1 1 24 24 GLN HA H 1 4.389 0.04 . 1 . . . . 289 Q HA . 17273 1 244 . 1 1 24 24 GLN HB2 H 1 2.111 0.04 . 2 . . . . 289 Q HB1 . 17273 1 245 . 1 1 24 24 GLN HB3 H 1 1.940 0.04 . 2 . . . . 289 Q HB2 . 17273 1 246 . 1 1 24 24 GLN HE21 H 1 7.317 0.04 . 2 . . . . 289 Q HE21 . 17273 1 247 . 1 1 24 24 GLN HE22 H 1 6.725 0.04 . 2 . . . . 289 Q HE22 . 17273 1 248 . 1 1 24 24 GLN HG2 H 1 2.278 0.04 . 2 . . . . 289 Q HG1 . 17273 1 249 . 1 1 24 24 GLN CA C 13 55.547 0.4 . 1 . . . . 289 Q CA . 17273 1 250 . 1 1 24 24 GLN CB C 13 29.310 0.4 . 1 . . . . 289 Q CB . 17273 1 251 . 1 1 24 24 GLN CG C 13 33.433 0.4 . 1 . . . . 289 Q CG . 17273 1 252 . 1 1 24 24 GLN N N 15 117.510 0.4 . 1 . . . . 289 Q N . 17273 1 253 . 1 1 24 24 GLN NE2 N 15 111.980 0.4 . 1 . . . . 289 Q NE2 . 17273 1 254 . 1 1 25 25 THR H H 1 7.405 0.04 . 1 . . . . 290 T HN . 17273 1 255 . 1 1 25 25 THR HA H 1 4.500 0.04 . 1 . . . . 290 T HA . 17273 1 256 . 1 1 25 25 THR HB H 1 4.017 0.04 . 1 . . . . 290 T HB . 17273 1 257 . 1 1 25 25 THR HG21 H 1 1.234 0.04 . 1 . . . . 290 T HG21 . 17273 1 258 . 1 1 25 25 THR HG22 H 1 1.234 0.04 . 1 . . . . 290 T HG21 . 17273 1 259 . 1 1 25 25 THR HG23 H 1 1.234 0.04 . 1 . . . . 290 T HG21 . 17273 1 260 . 1 1 25 25 THR CA C 13 60.584 0.4 . 1 . . . . 290 T CA . 17273 1 261 . 1 1 25 25 THR CB C 13 70.173 0.4 . 1 . . . . 290 T CB . 17273 1 262 . 1 1 25 25 THR CG2 C 13 20.759 0.4 . 1 . . . . 290 T CG2 . 17273 1 263 . 1 1 25 25 THR N N 15 113.050 0.4 . 1 . . . . 290 T N . 17273 1 264 . 1 1 26 26 GLU H H 1 8.310 0.04 . 1 . . . . 291 E HN . 17273 1 265 . 1 1 26 26 GLU HA H 1 4.380 0.04 . 1 . . . . 291 E HA . 17273 1 266 . 1 1 26 26 GLU HB2 H 1 2.163 0.04 . 2 . . . . 291 E HB1 . 17273 1 267 . 1 1 26 26 GLU HB3 H 1 1.770 0.04 . 2 . . . . 291 E HB2 . 17273 1 268 . 1 1 26 26 GLU HG2 H 1 2.344 0.04 . 2 . . . . 291 E HG1 . 17273 1 269 . 1 1 26 26 GLU CA C 13 55.855 0.4 . 1 . . . . 291 E CA . 17273 1 270 . 1 1 26 26 GLU CB C 13 30.840 0.4 . 1 . . . . 291 E CB . 17273 1 271 . 1 1 26 26 GLU CG C 13 36.674 0.4 . 1 . . . . 291 E CG . 17273 1 272 . 1 1 26 26 GLU N N 15 122.250 0.4 . 1 . . . . 291 E N . 17273 1 273 . 1 1 27 27 GLU H H 1 8.788 0.04 . 1 . . . . 292 E HN . 17273 1 274 . 1 1 27 27 GLU HA H 1 3.961 0.04 . 1 . . . . 292 E HA . 17273 1 275 . 1 1 27 27 GLU HB2 H 1 2.131 0.04 . 2 . . . . 292 E HB1 . 17273 1 276 . 1 1 27 27 GLU HB3 H 1 2.025 0.04 . 2 . . . . 292 E HB2 . 17273 1 277 . 1 1 27 27 GLU HG2 H 1 2.287 0.04 . 2 . . . . 292 E HG1 . 17273 1 278 . 1 1 27 27 GLU HG3 H 1 2.223 0.04 . 2 . . . . 292 E HG2 . 17273 1 279 . 1 1 27 27 GLU CA C 13 59.963 0.4 . 1 . . . . 292 E CA . 17273 1 280 . 1 1 27 27 GLU CB C 13 29.710 0.4 . 1 . . . . 292 E CB . 17273 1 281 . 1 1 27 27 GLU CG C 13 35.997 0.4 . 1 . . . . 292 E CG . 17273 1 282 . 1 1 27 27 GLU N N 15 124.357 0.4 . 1 . . . . 292 E N . 17273 1 283 . 1 1 28 28 HIS HA H 1 4.523 0.04 . 1 . . . . 293 H HA . 17273 1 284 . 1 1 28 28 HIS HB2 H 1 3.352 0.04 . 2 . . . . 293 H HB1 . 17273 1 285 . 1 1 28 28 HIS HB3 H 1 3.214 0.04 . 2 . . . . 293 H HB2 . 17273 1 286 . 1 1 28 28 HIS HD2 H 1 7.180 0.04 . 3 . . . . 293 H HD2 . 17273 1 287 . 1 1 28 28 HIS HE1 H 1 8.190 0.04 . 3 . . . . 293 H HE1 . 17273 1 288 . 1 1 28 28 HIS CA C 13 58.160 0.4 . 1 . . . . 293 H CA . 17273 1 289 . 1 1 28 28 HIS CB C 13 28.770 0.4 . 1 . . . . 293 H CB . 17273 1 290 . 1 1 28 28 HIS CD2 C 13 119.280 0.4 . 1 . . . . 293 H CD2 . 17273 1 291 . 1 1 28 28 HIS CE1 C 13 137.770 0.4 . 1 . . . . 293 H CE1 . 17273 1 292 . 1 1 29 29 LYS H H 1 7.478 0.04 . 1 . . . . 294 K HN . 17273 1 293 . 1 1 29 29 LYS HA H 1 4.465 0.04 . 1 . . . . 294 K HA . 17273 1 294 . 1 1 29 29 LYS HB2 H 1 1.936 0.04 . 2 . . . . 294 K HB1 . 17273 1 295 . 1 1 29 29 LYS HB3 H 1 1.689 0.04 . 2 . . . . 294 K HB2 . 17273 1 296 . 1 1 29 29 LYS HD2 H 1 1.662 0.04 . 2 . . . . 294 K HD1 . 17273 1 297 . 1 1 29 29 LYS HE2 H 1 2.970 0.04 . 2 . . . . 294 K HE1 . 17273 1 298 . 1 1 29 29 LYS HG2 H 1 1.142 0.04 . 2 . . . . 294 K HG1 . 17273 1 299 . 1 1 29 29 LYS CA C 13 56.320 0.4 . 1 . . . . 294 K CA . 17273 1 300 . 1 1 29 29 LYS CB C 13 33.090 0.4 . 1 . . . . 294 K CB . 17273 1 301 . 1 1 29 29 LYS CD C 13 28.967 0.4 . 1 . . . . 294 K CD . 17273 1 302 . 1 1 29 29 LYS CE C 13 41.998 0.4 . 1 . . . . 294 K CE . 17273 1 303 . 1 1 29 29 LYS CG C 13 24.852 0.4 . 1 . . . . 294 K CG . 17273 1 304 . 1 1 29 29 LYS N N 15 118.823 0.4 . 1 . . . . 294 K N . 17273 1 305 . 1 1 30 30 PHE H H 1 7.551 0.04 . 1 . . . . 295 F HN . 17273 1 306 . 1 1 30 30 PHE HA H 1 4.290 0.04 . 1 . . . . 295 F HA . 17273 1 307 . 1 1 30 30 PHE HB2 H 1 3.350 0.04 . 2 . . . . 295 F HB1 . 17273 1 308 . 1 1 30 30 PHE HB3 H 1 3.020 0.04 . 2 . . . . 295 F HB2 . 17273 1 309 . 1 1 30 30 PHE HD1 H 1 7.190 0.04 . 3 . . . . 295 F HD1 . 17273 1 310 . 1 1 30 30 PHE HE1 H 1 7.550 0.04 . 3 . . . . 295 F HE1 . 17273 1 311 . 1 1 30 30 PHE HZ H 1 7.250 0.04 . 1 . . . . 295 F HZ . 17273 1 312 . 1 1 30 30 PHE CA C 13 61.322 0.4 . 1 . . . . 295 F CA . 17273 1 313 . 1 1 30 30 PHE CB C 13 39.300 0.4 . 1 . . . . 295 F CB . 17273 1 314 . 1 1 30 30 PHE CD1 C 13 132.145 0.4 . 3 . . . . 295 F CD1 . 17273 1 315 . 1 1 30 30 PHE CE1 C 13 131.730 0.4 . 3 . . . . 295 F CE1 . 17273 1 316 . 1 1 30 30 PHE CZ C 13 129.840 0.4 . 1 . . . . 295 F CZ . 17273 1 317 . 1 1 30 30 PHE N N 15 119.900 0.4 . 1 . . . . 295 F N . 17273 1 318 . 1 1 31 31 GLN H H 1 8.418 0.04 . 1 . . . . 296 Q HN . 17273 1 319 . 1 1 31 31 GLN HA H 1 3.051 0.04 . 1 . . . . 296 Q HA . 17273 1 320 . 1 1 31 31 GLN HB2 H 1 1.496 0.04 . 2 . . . . 296 Q HB1 . 17273 1 321 . 1 1 31 31 GLN HB3 H 1 0.777 0.04 . 2 . . . . 296 Q HB2 . 17273 1 322 . 1 1 31 31 GLN HG2 H 1 1.664 0.04 . 2 . . . . 296 Q HG1 . 17273 1 323 . 1 1 31 31 GLN HG3 H 1 0.225 0.04 . 2 . . . . 296 Q HG2 . 17273 1 324 . 1 1 31 31 GLN CA C 13 58.900 0.4 . 1 . . . . 296 Q CA . 17273 1 325 . 1 1 31 31 GLN CB C 13 26.949 0.4 . 1 . . . . 296 Q CB . 17273 1 326 . 1 1 31 31 GLN CG C 13 32.450 0.4 . 1 . . . . 296 Q CG . 17273 1 327 . 1 1 31 31 GLN N N 15 117.200 0.4 . 1 . . . . 296 Q N . 17273 1 328 . 1 1 32 32 GLU H H 1 8.313 0.04 . 1 . . . . 297 E HN . 17273 1 329 . 1 1 32 32 GLU HA H 1 4.050 0.04 . 1 . . . . 297 E HA . 17273 1 330 . 1 1 32 32 GLU HB2 H 1 2.131 0.04 . 2 . . . . 297 E HB1 . 17273 1 331 . 1 1 32 32 GLU HB3 H 1 2.050 0.04 . 2 . . . . 297 E HB2 . 17273 1 332 . 1 1 32 32 GLU HG2 H 1 2.347 0.04 . 2 . . . . 297 E HG1 . 17273 1 333 . 1 1 32 32 GLU HG3 H 1 2.237 0.04 . 2 . . . . 297 E HG2 . 17273 1 334 . 1 1 32 32 GLU CA C 13 59.190 0.4 . 1 . . . . 297 E CA . 17273 1 335 . 1 1 32 32 GLU CB C 13 29.750 0.4 . 1 . . . . 297 E CB . 17273 1 336 . 1 1 32 32 GLU CG C 13 36.215 0.4 . 1 . . . . 297 E CG . 17273 1 337 . 1 1 32 32 GLU N N 15 119.980 0.4 . 1 . . . . 297 E N . 17273 1 338 . 1 1 33 33 GLN H H 1 8.199 0.04 . 1 . . . . 298 Q HN . 17273 1 339 . 1 1 33 33 GLN HA H 1 4.098 0.04 . 1 . . . . 298 Q HA . 17273 1 340 . 1 1 33 33 GLN HB2 H 1 2.330 0.04 . 2 . . . . 298 Q HB1 . 17273 1 341 . 1 1 33 33 GLN HB3 H 1 2.242 0.04 . 2 . . . . 298 Q HB2 . 17273 1 342 . 1 1 33 33 GLN HE21 H 1 7.661 0.04 . 2 . . . . 298 Q HE21 . 17273 1 343 . 1 1 33 33 GLN HE22 H 1 6.986 0.04 . 2 . . . . 298 Q HE22 . 17273 1 344 . 1 1 33 33 GLN HG2 H 1 2.650 0.04 . 2 . . . . 298 Q HG1 . 17273 1 345 . 1 1 33 33 GLN HG3 H 1 2.494 0.04 . 2 . . . . 298 Q HG2 . 17273 1 346 . 1 1 33 33 GLN CA C 13 58.770 0.4 . 1 . . . . 298 Q CA . 17273 1 347 . 1 1 33 33 GLN CB C 13 28.785 0.4 . 1 . . . . 298 Q CB . 17273 1 348 . 1 1 33 33 GLN CG C 13 34.400 0.4 . 1 . . . . 298 Q CG . 17273 1 349 . 1 1 33 33 GLN N N 15 118.044 0.4 . 1 . . . . 298 Q N . 17273 1 350 . 1 1 33 33 GLN NE2 N 15 111.703 0.4 . 1 . . . . 298 Q NE2 . 17273 1 351 . 1 1 34 34 VAL H H 1 8.904 0.04 . 1 . . . . 299 V HN . 17273 1 352 . 1 1 34 34 VAL HA H 1 3.207 0.04 . 1 . . . . 299 V HA . 17273 1 353 . 1 1 34 34 VAL HB H 1 1.748 0.04 . 1 . . . . 299 V HB . 17273 1 354 . 1 1 34 34 VAL HG11 H 1 0.696 0.04 . 2 . . . . 299 V HG11 . 17273 1 355 . 1 1 34 34 VAL HG12 H 1 0.696 0.04 . 2 . . . . 299 V HG11 . 17273 1 356 . 1 1 34 34 VAL HG13 H 1 0.696 0.04 . 2 . . . . 299 V HG11 . 17273 1 357 . 1 1 34 34 VAL HG21 H 1 0.832 0.04 . 2 . . . . 299 V HG21 . 17273 1 358 . 1 1 34 34 VAL HG22 H 1 0.832 0.04 . 2 . . . . 299 V HG21 . 17273 1 359 . 1 1 34 34 VAL HG23 H 1 0.832 0.04 . 2 . . . . 299 V HG21 . 17273 1 360 . 1 1 34 34 VAL CA C 13 65.186 0.4 . 1 . . . . 299 V CA . 17273 1 361 . 1 1 34 34 VAL CB C 13 31.043 0.4 . 1 . . . . 299 V CB . 17273 1 362 . 1 1 34 34 VAL CG1 C 13 24.126 0.4 . 1 . . . . 299 V CG1 . 17273 1 363 . 1 1 34 34 VAL CG2 C 13 21.668 0.4 . 1 . . . . 299 V CG2 . 17273 1 364 . 1 1 34 34 VAL N N 15 119.841 0.4 . 1 . . . . 299 V N . 17273 1 365 . 1 1 35 35 SER H H 1 7.827 0.04 . 1 . . . . 300 S HN . 17273 1 366 . 1 1 35 35 SER HA H 1 4.179 0.04 . 1 . . . . 300 S HA . 17273 1 367 . 1 1 35 35 SER HB2 H 1 4.085 0.04 . 2 . . . . 300 S HB1 . 17273 1 368 . 1 1 35 35 SER CA C 13 63.106 0.4 . 1 . . . . 300 S CA . 17273 1 369 . 1 1 35 35 SER N N 15 117.070 0.4 . 1 . . . . 300 S N . 17273 1 370 . 1 1 36 36 LYS H H 1 7.265 0.04 . 1 . . . . 301 K HN . 17273 1 371 . 1 1 36 36 LYS HA H 1 4.073 0.04 . 1 . . . . 301 K HA . 17273 1 372 . 1 1 36 36 LYS HB2 H 1 2.004 0.04 . 2 . . . . 301 K HB1 . 17273 1 373 . 1 1 36 36 LYS HD2 H 1 1.719 0.04 . 2 . . . . 301 K HD1 . 17273 1 374 . 1 1 36 36 LYS HE2 H 1 3.057 0.04 . 2 . . . . 301 K HE1 . 17273 1 375 . 1 1 36 36 LYS HG2 H 1 1.652 0.04 . 2 . . . . 301 K HG1 . 17273 1 376 . 1 1 36 36 LYS HG3 H 1 1.555 0.04 . 2 . . . . 301 K HG2 . 17273 1 377 . 1 1 36 36 LYS CA C 13 58.432 0.4 . 1 . . . . 301 K CA . 17273 1 378 . 1 1 36 36 LYS CB C 13 32.235 0.4 . 1 . . . . 301 K CB . 17273 1 379 . 1 1 36 36 LYS CD C 13 28.864 0.4 . 1 . . . . 301 K CD . 17273 1 380 . 1 1 36 36 LYS CE C 13 41.938 0.4 . 1 . . . . 301 K CE . 17273 1 381 . 1 1 36 36 LYS CG C 13 25.228 0.4 . 1 . . . . 301 K CG . 17273 1 382 . 1 1 36 36 LYS N N 15 118.410 0.4 . 1 . . . . 301 K N . 17273 1 383 . 1 1 37 37 GLU H H 1 7.285 0.04 . 1 . . . . 302 E HN . 17273 1 384 . 1 1 37 37 GLU HA H 1 4.211 0.04 . 1 . . . . 302 E HA . 17273 1 385 . 1 1 37 37 GLU HB2 H 1 2.221 0.04 . 2 . . . . 302 E HB1 . 17273 1 386 . 1 1 37 37 GLU HB3 H 1 1.890 0.04 . 2 . . . . 302 E HB2 . 17273 1 387 . 1 1 37 37 GLU HG2 H 1 2.318 0.04 . 2 . . . . 302 E HG1 . 17273 1 388 . 1 1 37 37 GLU HG3 H 1 2.096 0.04 . 2 . . . . 302 E HG2 . 17273 1 389 . 1 1 37 37 GLU CA C 13 57.373 0.4 . 1 . . . . 302 E CA . 17273 1 390 . 1 1 37 37 GLU CB C 13 29.840 0.4 . 1 . . . . 302 E CB . 17273 1 391 . 1 1 37 37 GLU CG C 13 35.646 0.4 . 1 . . . . 302 E CG . 17273 1 392 . 1 1 37 37 GLU N N 15 115.437 0.4 . 1 . . . . 302 E N . 17273 1 393 . 1 1 38 38 LEU H H 1 7.730 0.04 . 1 . . . . 303 L HN . 17273 1 394 . 1 1 38 38 LEU HA H 1 4.258 0.04 . 1 . . . . 303 L HA . 17273 1 395 . 1 1 38 38 LEU HB2 H 1 1.710 0.04 . 2 . . . . 303 L HB1 . 17273 1 396 . 1 1 38 38 LEU HB3 H 1 1.319 0.04 . 2 . . . . 303 L HB2 . 17273 1 397 . 1 1 38 38 LEU HD11 H 1 0.770 0.04 . 2 . . . . 303 L HD11 . 17273 1 398 . 1 1 38 38 LEU HD12 H 1 0.770 0.04 . 2 . . . . 303 L HD11 . 17273 1 399 . 1 1 38 38 LEU HD13 H 1 0.770 0.04 . 2 . . . . 303 L HD11 . 17273 1 400 . 1 1 38 38 LEU HD21 H 1 0.624 0.04 . 2 . . . . 303 L HD21 . 17273 1 401 . 1 1 38 38 LEU HD22 H 1 0.624 0.04 . 2 . . . . 303 L HD21 . 17273 1 402 . 1 1 38 38 LEU HD23 H 1 0.624 0.04 . 2 . . . . 303 L HD21 . 17273 1 403 . 1 1 38 38 LEU HG H 1 1.743 0.04 . 1 . . . . 303 L HG . 17273 1 404 . 1 1 38 38 LEU CA C 13 55.850 0.4 . 1 . . . . 303 L CA . 17273 1 405 . 1 1 38 38 LEU CB C 13 44.940 0.4 . 1 . . . . 303 L CB . 17273 1 406 . 1 1 38 38 LEU CD1 C 13 26.142 0.4 . 1 . . . . 303 L CD1 . 17273 1 407 . 1 1 38 38 LEU CD2 C 13 24.777 0.4 . 1 . . . . 303 L CD2 . 17273 1 408 . 1 1 38 38 LEU CG C 13 27.160 0.4 . 1 . . . . 303 L CG . 17273 1 409 . 1 1 38 38 LEU N N 15 116.745 0.4 . 1 . . . . 303 L N . 17273 1 410 . 1 1 39 39 ILE H H 1 7.694 0.04 . 1 . . . . 304 I HN . 17273 1 411 . 1 1 39 39 ILE HA H 1 3.580 0.04 . 1 . . . . 304 I HA . 17273 1 412 . 1 1 39 39 ILE HB H 1 1.876 0.04 . 1 . . . . 304 I HB . 17273 1 413 . 1 1 39 39 ILE HD11 H 1 0.962 0.04 . 1 . . . . 304 I HD11 . 17273 1 414 . 1 1 39 39 ILE HD12 H 1 0.962 0.04 . 1 . . . . 304 I HD11 . 17273 1 415 . 1 1 39 39 ILE HD13 H 1 0.962 0.04 . 1 . . . . 304 I HD11 . 17273 1 416 . 1 1 39 39 ILE HG12 H 1 1.773 0.04 . 1 . . . . 304 I HG11 . 17273 1 417 . 1 1 39 39 ILE HG13 H 1 0.826 0.04 . 1 . . . . 304 I HG12 . 17273 1 418 . 1 1 39 39 ILE HG21 H 1 0.957 0.04 . 1 . . . . 304 I HG21 . 17273 1 419 . 1 1 39 39 ILE HG22 H 1 0.957 0.04 . 1 . . . . 304 I HG21 . 17273 1 420 . 1 1 39 39 ILE HG23 H 1 0.957 0.04 . 1 . . . . 304 I HG21 . 17273 1 421 . 1 1 39 39 ILE CA C 13 64.180 0.4 . 1 . . . . 304 I CA . 17273 1 422 . 1 1 39 39 ILE CB C 13 36.630 0.4 . 1 . . . . 304 I CB . 17273 1 423 . 1 1 39 39 ILE CD1 C 13 13.562 0.4 . 1 . . . . 304 I CD1 . 17273 1 424 . 1 1 39 39 ILE CG1 C 13 29.806 0.4 . 1 . . . . 304 I CG1 . 17273 1 425 . 1 1 39 39 ILE CG2 C 13 17.052 0.4 . 1 . . . . 304 I CG2 . 17273 1 426 . 1 1 39 39 ILE N N 15 117.690 0.4 . 1 . . . . 304 I N . 17273 1 427 . 1 1 40 40 GLY H H 1 9.543 0.04 . 1 . . . . 305 G HN . 17273 1 428 . 1 1 40 40 GLY HA2 H 1 4.512 0.04 . 2 . . . . 305 G HA1 . 17273 1 429 . 1 1 40 40 GLY HA3 H 1 3.439 0.04 . 2 . . . . 305 G HA2 . 17273 1 430 . 1 1 40 40 GLY CA C 13 44.320 0.4 . 1 . . . . 305 G CA . 17273 1 431 . 1 1 40 40 GLY N N 15 117.600 0.4 . 1 . . . . 305 G N . 17273 1 432 . 1 1 41 41 LEU H H 1 8.064 0.04 . 1 . . . . 306 L HN . 17273 1 433 . 1 1 41 41 LEU HA H 1 4.396 0.04 . 1 . . . . 306 L HA . 17273 1 434 . 1 1 41 41 LEU HB2 H 1 1.873 0.04 . 2 . . . . 306 L HB1 . 17273 1 435 . 1 1 41 41 LEU HB3 H 1 1.371 0.04 . 2 . . . . 306 L HB2 . 17273 1 436 . 1 1 41 41 LEU HD11 H 1 0.651 0.04 . 2 . . . . 306 L HD11 . 17273 1 437 . 1 1 41 41 LEU HD12 H 1 0.651 0.04 . 2 . . . . 306 L HD11 . 17273 1 438 . 1 1 41 41 LEU HD13 H 1 0.651 0.04 . 2 . . . . 306 L HD11 . 17273 1 439 . 1 1 41 41 LEU HD21 H 1 0.819 0.04 . 2 . . . . 306 L HD21 . 17273 1 440 . 1 1 41 41 LEU HD22 H 1 0.819 0.04 . 2 . . . . 306 L HD21 . 17273 1 441 . 1 1 41 41 LEU HD23 H 1 0.819 0.04 . 2 . . . . 306 L HD21 . 17273 1 442 . 1 1 41 41 LEU HG H 1 1.823 0.04 . 1 . . . . 306 L HG . 17273 1 443 . 1 1 41 41 LEU CA C 13 55.224 0.4 . 1 . . . . 306 L CA . 17273 1 444 . 1 1 41 41 LEU CB C 13 41.905 0.4 . 1 . . . . 306 L CB . 17273 1 445 . 1 1 41 41 LEU CD1 C 13 24.252 0.4 . 1 . . . . 306 L CD1 . 17273 1 446 . 1 1 41 41 LEU CD2 C 13 22.669 0.4 . 1 . . . . 306 L CD2 . 17273 1 447 . 1 1 41 41 LEU CG C 13 26.889 0.4 . 1 . . . . 306 L CG . 17273 1 448 . 1 1 41 41 LEU N N 15 120.810 0.4 . 1 . . . . 306 L N . 17273 1 449 . 1 1 42 42 VAL H H 1 7.932 0.04 . 1 . . . . 307 V HN . 17273 1 450 . 1 1 42 42 VAL HA H 1 4.890 0.04 . 1 . . . . 307 V HA . 17273 1 451 . 1 1 42 42 VAL HB H 1 1.810 0.04 . 1 . . . . 307 V HB . 17273 1 452 . 1 1 42 42 VAL HG11 H 1 0.820 0.04 . 2 . . . . 307 V HG11 . 17273 1 453 . 1 1 42 42 VAL HG12 H 1 0.820 0.04 . 2 . . . . 307 V HG11 . 17273 1 454 . 1 1 42 42 VAL HG13 H 1 0.820 0.04 . 2 . . . . 307 V HG11 . 17273 1 455 . 1 1 42 42 VAL HG21 H 1 0.820 0.04 . 2 . . . . 307 V HG21 . 17273 1 456 . 1 1 42 42 VAL HG22 H 1 0.820 0.04 . 2 . . . . 307 V HG21 . 17273 1 457 . 1 1 42 42 VAL HG23 H 1 0.820 0.04 . 2 . . . . 307 V HG21 . 17273 1 458 . 1 1 42 42 VAL CA C 13 61.310 0.4 . 1 . . . . 307 V CA . 17273 1 459 . 1 1 42 42 VAL CB C 13 32.070 0.4 . 1 . . . . 307 V CB . 17273 1 460 . 1 1 42 42 VAL CG1 C 13 21.690 0.4 . 1 . . . . 307 V CG1 . 17273 1 461 . 1 1 42 42 VAL CG2 C 13 21.290 0.4 . 1 . . . . 307 V CG2 . 17273 1 462 . 1 1 42 42 VAL N N 15 119.861 0.4 . 1 . . . . 307 V N . 17273 1 463 . 1 1 43 43 VAL H H 1 9.344 0.04 . 1 . . . . 308 V HN . 17273 1 464 . 1 1 43 43 VAL HA H 1 5.307 0.04 . 1 . . . . 308 V HA . 17273 1 465 . 1 1 43 43 VAL HB H 1 1.998 0.04 . 1 . . . . 308 V HB . 17273 1 466 . 1 1 43 43 VAL HG11 H 1 0.640 0.04 . 2 . . . . 308 V HG11 . 17273 1 467 . 1 1 43 43 VAL HG12 H 1 0.640 0.04 . 2 . . . . 308 V HG11 . 17273 1 468 . 1 1 43 43 VAL HG13 H 1 0.640 0.04 . 2 . . . . 308 V HG11 . 17273 1 469 . 1 1 43 43 VAL HG21 H 1 0.760 0.04 . 2 . . . . 308 V HG21 . 17273 1 470 . 1 1 43 43 VAL HG22 H 1 0.760 0.04 . 2 . . . . 308 V HG21 . 17273 1 471 . 1 1 43 43 VAL HG23 H 1 0.760 0.04 . 2 . . . . 308 V HG21 . 17273 1 472 . 1 1 43 43 VAL CA C 13 58.000 0.4 . 1 . . . . 308 V CA . 17273 1 473 . 1 1 43 43 VAL CB C 13 35.061 0.4 . 1 . . . . 308 V CB . 17273 1 474 . 1 1 43 43 VAL CG1 C 13 21.663 0.4 . 1 . . . . 308 V CG1 . 17273 1 475 . 1 1 43 43 VAL CG2 C 13 17.967 0.4 . 1 . . . . 308 V CG2 . 17273 1 476 . 1 1 43 43 VAL N N 15 121.128 0.4 . 1 . . . . 308 V N . 17273 1 477 . 1 1 44 44 LEU H H 1 9.091 0.04 . 1 . . . . 309 L HN . 17273 1 478 . 1 1 44 44 LEU HA H 1 5.316 0.04 . 1 . . . . 309 L HA . 17273 1 479 . 1 1 44 44 LEU HB2 H 1 1.699 0.04 . 2 . . . . 309 L HB1 . 17273 1 480 . 1 1 44 44 LEU HB3 H 1 1.369 0.04 . 2 . . . . 309 L HB2 . 17273 1 481 . 1 1 44 44 LEU HD11 H 1 0.793 0.04 . 2 . . . . 309 L HD11 . 17273 1 482 . 1 1 44 44 LEU HD12 H 1 0.793 0.04 . 2 . . . . 309 L HD11 . 17273 1 483 . 1 1 44 44 LEU HD13 H 1 0.793 0.04 . 2 . . . . 309 L HD11 . 17273 1 484 . 1 1 44 44 LEU HD21 H 1 0.756 0.04 . 2 . . . . 309 L HD21 . 17273 1 485 . 1 1 44 44 LEU HD22 H 1 0.756 0.04 . 2 . . . . 309 L HD21 . 17273 1 486 . 1 1 44 44 LEU HD23 H 1 0.756 0.04 . 2 . . . . 309 L HD21 . 17273 1 487 . 1 1 44 44 LEU HG H 1 1.376 0.04 . 1 . . . . 309 L HG . 17273 1 488 . 1 1 44 44 LEU CA C 13 52.914 0.4 . 1 . . . . 309 L CA . 17273 1 489 . 1 1 44 44 LEU CB C 13 46.350 0.4 . 1 . . . . 309 L CB . 17273 1 490 . 1 1 44 44 LEU CD1 C 13 26.186 0.4 . 1 . . . . 309 L CD1 . 17273 1 491 . 1 1 44 44 LEU CD2 C 13 23.791 0.4 . 1 . . . . 309 L CD2 . 17273 1 492 . 1 1 44 44 LEU CG C 13 27.490 0.4 . 1 . . . . 309 L CG . 17273 1 493 . 1 1 44 44 LEU N N 15 122.680 0.4 . 1 . . . . 309 L N . 17273 1 494 . 1 1 45 45 THR H H 1 9.363 0.04 . 1 . . . . 310 T HN . 17273 1 495 . 1 1 45 45 THR HA H 1 4.930 0.04 . 1 . . . . 310 T HA . 17273 1 496 . 1 1 45 45 THR HB H 1 3.391 0.04 . 1 . . . . 310 T HB . 17273 1 497 . 1 1 45 45 THR HG21 H 1 1.269 0.04 . 1 . . . . 310 T HG21 . 17273 1 498 . 1 1 45 45 THR HG22 H 1 1.269 0.04 . 1 . . . . 310 T HG21 . 17273 1 499 . 1 1 45 45 THR HG23 H 1 1.269 0.04 . 1 . . . . 310 T HG21 . 17273 1 500 . 1 1 45 45 THR CA C 13 59.230 0.4 . 1 . . . . 310 T CA . 17273 1 501 . 1 1 45 45 THR CB C 13 68.591 0.4 . 1 . . . . 310 T CB . 17273 1 502 . 1 1 45 45 THR CG2 C 13 23.225 0.4 . 1 . . . . 310 T CG2 . 17273 1 503 . 1 1 45 45 THR N N 15 115.990 0.4 . 1 . . . . 310 T N . 17273 1 504 . 1 1 46 46 LYS H H 1 9.003 0.04 . 1 . . . . 311 K HN . 17273 1 505 . 1 1 46 46 LYS HA H 1 4.097 0.04 . 1 . . . . 311 K HA . 17273 1 506 . 1 1 46 46 LYS HB2 H 1 1.829 0.04 . 2 . . . . 311 K HB1 . 17273 1 507 . 1 1 46 46 LYS HB3 H 1 1.741 0.04 . 2 . . . . 311 K HB2 . 17273 1 508 . 1 1 46 46 LYS HD2 H 1 1.502 0.04 . 2 . . . . 311 K HD1 . 17273 1 509 . 1 1 46 46 LYS HD3 H 1 1.292 0.04 . 2 . . . . 311 K HD2 . 17273 1 510 . 1 1 46 46 LYS HE2 H 1 2.588 0.04 . 2 . . . . 311 K HE1 . 17273 1 511 . 1 1 46 46 LYS HE3 H 1 2.140 0.04 . 2 . . . . 311 K HE2 . 17273 1 512 . 1 1 46 46 LYS HG2 H 1 1.246 0.04 . 2 . . . . 311 K HG1 . 17273 1 513 . 1 1 46 46 LYS HG3 H 1 0.783 0.04 . 2 . . . . 311 K HG2 . 17273 1 514 . 1 1 46 46 LYS CA C 13 58.171 0.4 . 1 . . . . 311 K CA . 17273 1 515 . 1 1 46 46 LYS CB C 13 33.330 0.4 . 1 . . . . 311 K CB . 17273 1 516 . 1 1 46 46 LYS CD C 13 29.820 0.4 . 1 . . . . 311 K CD . 17273 1 517 . 1 1 46 46 LYS CE C 13 41.257 0.4 . 1 . . . . 311 K CE . 17273 1 518 . 1 1 46 46 LYS CG C 13 26.293 0.4 . 1 . . . . 311 K CG . 17273 1 519 . 1 1 46 46 LYS N N 15 122.238 0.4 . 1 . . . . 311 K N . 17273 1 520 . 1 1 47 47 TYR H H 1 6.928 0.04 . 1 . . . . 312 Y HN . 17273 1 521 . 1 1 47 47 TYR HA H 1 4.626 0.04 . 1 . . . . 312 Y HA . 17273 1 522 . 1 1 47 47 TYR HB2 H 1 3.102 0.04 . 2 . . . . 312 Y HB1 . 17273 1 523 . 1 1 47 47 TYR HB3 H 1 2.797 0.04 . 2 . . . . 312 Y HB2 . 17273 1 524 . 1 1 47 47 TYR HD1 H 1 6.610 0.04 . 3 . . . . 312 Y HD1 . 17273 1 525 . 1 1 47 47 TYR HE1 H 1 6.726 0.04 . 3 . . . . 312 Y HE1 . 17273 1 526 . 1 1 47 47 TYR CA C 13 56.860 0.4 . 1 . . . . 312 Y CA . 17273 1 527 . 1 1 47 47 TYR CB C 13 37.420 0.4 . 1 . . . . 312 Y CB . 17273 1 528 . 1 1 47 47 TYR CD1 C 13 132.830 0.4 . 3 . . . . 312 Y CD1 . 17273 1 529 . 1 1 47 47 TYR CE1 C 13 118.727 0.4 . 3 . . . . 312 Y CE1 . 17273 1 530 . 1 1 47 47 TYR N N 15 111.817 0.4 . 1 . . . . 312 Y N . 17273 1 531 . 1 1 48 48 ASN H H 1 6.736 0.04 . 1 . . . . 313 N HN . 17273 1 532 . 1 1 48 48 ASN HA H 1 4.860 0.04 . 1 . . . . 313 N HA . 17273 1 533 . 1 1 48 48 ASN HB2 H 1 3.382 0.04 . 2 . . . . 313 N HB1 . 17273 1 534 . 1 1 48 48 ASN HB3 H 1 2.876 0.04 . 2 . . . . 313 N HB2 . 17273 1 535 . 1 1 48 48 ASN HD21 H 1 7.986 0.04 . 2 . . . . 313 N HD21 . 17273 1 536 . 1 1 48 48 ASN HD22 H 1 6.907 0.04 . 2 . . . . 313 N HD22 . 17273 1 537 . 1 1 48 48 ASN CA C 13 52.129 0.4 . 1 . . . . 313 N CA . 17273 1 538 . 1 1 48 48 ASN CB C 13 38.302 0.4 . 1 . . . . 313 N CB . 17273 1 539 . 1 1 48 48 ASN N N 15 117.370 0.4 . 1 . . . . 313 N N . 17273 1 540 . 1 1 48 48 ASN ND2 N 15 109.395 0.4 . 1 . . . . 313 N ND2 . 17273 1 541 . 1 1 49 49 ASN H H 1 7.798 0.04 . 1 . . . . 314 N HN . 17273 1 542 . 1 1 49 49 ASN HA H 1 4.461 0.04 . 1 . . . . 314 N HA . 17273 1 543 . 1 1 49 49 ASN HB2 H 1 3.099 0.04 . 2 . . . . 314 N HB1 . 17273 1 544 . 1 1 49 49 ASN HB3 H 1 2.660 0.04 . 2 . . . . 314 N HB2 . 17273 1 545 . 1 1 49 49 ASN HD21 H 1 7.555 0.04 . 2 . . . . 314 N HD21 . 17273 1 546 . 1 1 49 49 ASN HD22 H 1 6.757 0.04 . 2 . . . . 314 N HD22 . 17273 1 547 . 1 1 49 49 ASN CA C 13 54.023 0.4 . 1 . . . . 314 N CA . 17273 1 548 . 1 1 49 49 ASN CB C 13 37.880 0.4 . 1 . . . . 314 N CB . 17273 1 549 . 1 1 49 49 ASN N N 15 116.530 0.4 . 1 . . . . 314 N N . 17273 1 550 . 1 1 49 49 ASN ND2 N 15 111.840 0.4 . 1 . . . . 314 N ND2 . 17273 1 551 . 1 1 50 50 LYS H H 1 7.466 0.04 . 1 . . . . 315 K HN . 17273 1 552 . 1 1 50 50 LYS HA H 1 4.518 0.04 . 1 . . . . 315 K HA . 17273 1 553 . 1 1 50 50 LYS HB2 H 1 1.578 0.04 . 2 . . . . 315 K HB1 . 17273 1 554 . 1 1 50 50 LYS HB3 H 1 1.372 0.04 . 2 . . . . 315 K HB2 . 17273 1 555 . 1 1 50 50 LYS HD2 H 1 1.655 0.04 . 2 . . . . 315 K HD1 . 17273 1 556 . 1 1 50 50 LYS HE2 H 1 2.976 0.04 . 2 . . . . 315 K HE1 . 17273 1 557 . 1 1 50 50 LYS HG2 H 1 1.315 0.04 . 2 . . . . 315 K HG1 . 17273 1 558 . 1 1 50 50 LYS HG3 H 1 1.149 0.04 . 2 . . . . 315 K HG2 . 17273 1 559 . 1 1 50 50 LYS CA C 13 55.343 0.4 . 1 . . . . 315 K CA . 17273 1 560 . 1 1 50 50 LYS CB C 13 35.244 0.4 . 1 . . . . 315 K CB . 17273 1 561 . 1 1 50 50 LYS CD C 13 28.849 0.4 . 1 . . . . 315 K CD . 17273 1 562 . 1 1 50 50 LYS CE C 13 41.897 0.4 . 1 . . . . 315 K CE . 17273 1 563 . 1 1 50 50 LYS CG C 13 25.559 0.4 . 1 . . . . 315 K CG . 17273 1 564 . 1 1 50 50 LYS N N 15 118.670 0.4 . 1 . . . . 315 K N . 17273 1 565 . 1 1 51 51 THR H H 1 7.412 0.04 . 1 . . . . 316 T HN . 17273 1 566 . 1 1 51 51 THR HA H 1 5.630 0.04 . 1 . . . . 316 T HA . 17273 1 567 . 1 1 51 51 THR HB H 1 3.900 0.04 . 1 . . . . 316 T HB . 17273 1 568 . 1 1 51 51 THR HG21 H 1 1.044 0.04 . 1 . . . . 316 T HG21 . 17273 1 569 . 1 1 51 51 THR HG22 H 1 1.044 0.04 . 1 . . . . 316 T HG21 . 17273 1 570 . 1 1 51 51 THR HG23 H 1 1.044 0.04 . 1 . . . . 316 T HG21 . 17273 1 571 . 1 1 51 51 THR CA C 13 58.637 0.4 . 1 . . . . 316 T CA . 17273 1 572 . 1 1 51 51 THR CB C 13 71.503 0.4 . 1 . . . . 316 T CB . 17273 1 573 . 1 1 51 51 THR CG2 C 13 22.025 0.4 . 1 . . . . 316 T CG2 . 17273 1 574 . 1 1 51 51 THR N N 15 107.711 0.4 . 1 . . . . 316 T N . 17273 1 575 . 1 1 52 52 TYR H H 1 8.880 0.04 . 1 . . . . 317 Y HN . 17273 1 576 . 1 1 52 52 TYR HA H 1 4.677 0.04 . 1 . . . . 317 Y HA . 17273 1 577 . 1 1 52 52 TYR HB2 H 1 2.931 0.04 . 2 . . . . 317 Y HB1 . 17273 1 578 . 1 1 52 52 TYR HB3 H 1 2.243 0.04 . 2 . . . . 317 Y HB2 . 17273 1 579 . 1 1 52 52 TYR HD1 H 1 6.846 0.04 . 3 . . . . 317 Y HD1 . 17273 1 580 . 1 1 52 52 TYR HE1 H 1 6.920 0.04 . 3 . . . . 317 Y HE1 . 17273 1 581 . 1 1 52 52 TYR CA C 13 56.840 0.4 . 1 . . . . 317 Y CA . 17273 1 582 . 1 1 52 52 TYR CB C 13 43.208 0.4 . 1 . . . . 317 Y CB . 17273 1 583 . 1 1 52 52 TYR CD1 C 13 133.275 0.4 . 3 . . . . 317 Y CD1 . 17273 1 584 . 1 1 52 52 TYR CE1 C 13 118.612 0.4 . 3 . . . . 317 Y CE1 . 17273 1 585 . 1 1 52 52 TYR N N 15 118.130 0.4 . 1 . . . . 317 Y N . 17273 1 586 . 1 1 53 53 ARG H H 1 8.898 0.04 . 1 . . . . 318 R HN . 17273 1 587 . 1 1 53 53 ARG HA H 1 4.866 0.04 . 1 . . . . 318 R HA . 17273 1 588 . 1 1 53 53 ARG HB2 H 1 1.888 0.04 . 2 . . . . 318 R HB1 . 17273 1 589 . 1 1 53 53 ARG HB3 H 1 1.655 0.04 . 2 . . . . 318 R HB2 . 17273 1 590 . 1 1 53 53 ARG HD2 H 1 3.320 0.04 . 2 . . . . 318 R HD1 . 17273 1 591 . 1 1 53 53 ARG HD3 H 1 3.230 0.04 . 2 . . . . 318 R HD2 . 17273 1 592 . 1 1 53 53 ARG HG2 H 1 1.359 0.04 . 2 . . . . 318 R HG1 . 17273 1 593 . 1 1 53 53 ARG CA C 13 55.013 0.4 . 1 . . . . 318 R CA . 17273 1 594 . 1 1 53 53 ARG CB C 13 31.400 0.4 . 1 . . . . 318 R CB . 17273 1 595 . 1 1 53 53 ARG CD C 13 43.355 0.4 . 1 . . . . 318 R CD . 17273 1 596 . 1 1 53 53 ARG CG C 13 27.730 0.4 . 1 . . . . 318 R CG . 17273 1 597 . 1 1 53 53 ARG N N 15 123.130 0.4 . 1 . . . . 318 R N . 17273 1 598 . 1 1 54 54 VAL H H 1 8.970 0.04 . 1 . . . . 319 V HN . 17273 1 599 . 1 1 54 54 VAL HA H 1 3.610 0.04 . 1 . . . . 319 V HA . 17273 1 600 . 1 1 54 54 VAL HB H 1 2.497 0.04 . 1 . . . . 319 V HB . 17273 1 601 . 1 1 54 54 VAL HG11 H 1 0.815 0.04 . 2 . . . . 319 V HG11 . 17273 1 602 . 1 1 54 54 VAL HG12 H 1 0.815 0.04 . 2 . . . . 319 V HG11 . 17273 1 603 . 1 1 54 54 VAL HG13 H 1 0.815 0.04 . 2 . . . . 319 V HG11 . 17273 1 604 . 1 1 54 54 VAL HG21 H 1 0.768 0.04 . 2 . . . . 319 V HG21 . 17273 1 605 . 1 1 54 54 VAL HG22 H 1 0.768 0.04 . 2 . . . . 319 V HG21 . 17273 1 606 . 1 1 54 54 VAL HG23 H 1 0.768 0.04 . 2 . . . . 319 V HG21 . 17273 1 607 . 1 1 54 54 VAL CA C 13 64.252 0.4 . 1 . . . . 319 V CA . 17273 1 608 . 1 1 54 54 VAL CB C 13 30.682 0.4 . 1 . . . . 319 V CB . 17273 1 609 . 1 1 54 54 VAL CG1 C 13 22.528 0.4 . 1 . . . . 319 V CG1 . 17273 1 610 . 1 1 54 54 VAL CG2 C 13 22.528 0.4 . 1 . . . . 319 V CG2 . 17273 1 611 . 1 1 54 54 VAL N N 15 127.080 0.4 . 1 . . . . 319 V N . 17273 1 612 . 1 1 55 55 ASP H H 1 9.142 0.04 . 1 . . . . 320 D HN . 17273 1 613 . 1 1 55 55 ASP HA H 1 5.041 0.04 . 1 . . . . 320 D HA . 17273 1 614 . 1 1 55 55 ASP HB2 H 1 2.788 0.04 . 2 . . . . 320 D HB1 . 17273 1 615 . 1 1 55 55 ASP HB3 H 1 2.492 0.04 . 2 . . . . 320 D HB2 . 17273 1 616 . 1 1 55 55 ASP CA C 13 55.631 0.4 . 1 . . . . 320 D CA . 17273 1 617 . 1 1 55 55 ASP CB C 13 43.807 0.4 . 1 . . . . 320 D CB . 17273 1 618 . 1 1 55 55 ASP N N 15 129.407 0.4 . 1 . . . . 320 D N . 17273 1 619 . 1 1 56 56 ASP H H 1 8.360 0.04 . 1 . . . . 321 D HN . 17273 1 620 . 1 1 56 56 ASP HA H 1 4.748 0.04 . 1 . . . . 321 D HA . 17273 1 621 . 1 1 56 56 ASP HB2 H 1 2.694 0.04 . 2 . . . . 321 D HB1 . 17273 1 622 . 1 1 56 56 ASP HB3 H 1 2.256 0.04 . 2 . . . . 321 D HB2 . 17273 1 623 . 1 1 56 56 ASP CA C 13 52.650 0.4 . 1 . . . . 321 D CA . 17273 1 624 . 1 1 56 56 ASP CB C 13 43.292 0.4 . 1 . . . . 321 D CB . 17273 1 625 . 1 1 56 56 ASP N N 15 116.820 0.4 . 1 . . . . 321 D N . 17273 1 626 . 1 1 57 57 ILE H H 1 8.775 0.04 . 1 . . . . 322 I HN . 17273 1 627 . 1 1 57 57 ILE HA H 1 4.167 0.04 . 1 . . . . 322 I HA . 17273 1 628 . 1 1 57 57 ILE HB H 1 1.423 0.04 . 1 . . . . 322 I HB . 17273 1 629 . 1 1 57 57 ILE HD11 H 1 0.734 0.04 . 1 . . . . 322 I HD11 . 17273 1 630 . 1 1 57 57 ILE HD12 H 1 0.734 0.04 . 1 . . . . 322 I HD11 . 17273 1 631 . 1 1 57 57 ILE HD13 H 1 0.734 0.04 . 1 . . . . 322 I HD11 . 17273 1 632 . 1 1 57 57 ILE HG12 H 1 1.282 0.04 . 1 . . . . 322 I HG11 . 17273 1 633 . 1 1 57 57 ILE HG13 H 1 0.618 0.04 . 1 . . . . 322 I HG12 . 17273 1 634 . 1 1 57 57 ILE HG21 H 1 -0.493 0.04 . 1 . . . . 322 I HG21 . 17273 1 635 . 1 1 57 57 ILE HG22 H 1 -0.493 0.04 . 1 . . . . 322 I HG21 . 17273 1 636 . 1 1 57 57 ILE HG23 H 1 -0.493 0.04 . 1 . . . . 322 I HG21 . 17273 1 637 . 1 1 57 57 ILE CA C 13 61.052 0.4 . 1 . . . . 322 I CA . 17273 1 638 . 1 1 57 57 ILE CB C 13 40.755 0.4 . 1 . . . . 322 I CB . 17273 1 639 . 1 1 57 57 ILE CD1 C 13 15.500 0.4 . 1 . . . . 322 I CD1 . 17273 1 640 . 1 1 57 57 ILE CG1 C 13 27.239 0.4 . 1 . . . . 322 I CG1 . 17273 1 641 . 1 1 57 57 ILE CG2 C 13 16.278 0.4 . 1 . . . . 322 I CG2 . 17273 1 642 . 1 1 57 57 ILE N N 15 119.652 0.4 . 1 . . . . 322 I N . 17273 1 643 . 1 1 58 58 ASP H H 1 9.063 0.04 . 1 . . . . 323 D HN . 17273 1 644 . 1 1 58 58 ASP HA H 1 4.898 0.04 . 1 . . . . 323 D HA . 17273 1 645 . 1 1 58 58 ASP HB2 H 1 2.881 0.04 . 2 . . . . 323 D HB1 . 17273 1 646 . 1 1 58 58 ASP HB3 H 1 2.125 0.04 . 2 . . . . 323 D HB2 . 17273 1 647 . 1 1 58 58 ASP CA C 13 51.863 0.4 . 1 . . . . 323 D CA . 17273 1 648 . 1 1 58 58 ASP CB C 13 40.215 0.4 . 1 . . . . 323 D CB . 17273 1 649 . 1 1 58 58 ASP N N 15 126.350 0.4 . 1 . . . . 323 D N . 17273 1 650 . 1 1 59 59 TRP H H 1 8.213 0.04 . 1 . . . . 324 W HN . 17273 1 651 . 1 1 59 59 TRP HA H 1 4.510 0.04 . 1 . . . . 324 W HA . 17273 1 652 . 1 1 59 59 TRP HB2 H 1 3.634 0.04 . 2 . . . . 324 W HB1 . 17273 1 653 . 1 1 59 59 TRP HB3 H 1 3.030 0.04 . 2 . . . . 324 W HB2 . 17273 1 654 . 1 1 59 59 TRP HD1 H 1 7.300 0.04 . 1 . . . . 324 W HD1 . 17273 1 655 . 1 1 59 59 TRP HE1 H 1 9.550 0.04 . 3 . . . . 324 W HE1 . 17273 1 656 . 1 1 59 59 TRP HE3 H 1 7.943 0.04 . 3 . . . . 324 W HE3 . 17273 1 657 . 1 1 59 59 TRP HH2 H 1 6.796 0.04 . 1 . . . . 324 W HH2 . 17273 1 658 . 1 1 59 59 TRP HZ2 H 1 7.139 0.04 . 3 . . . . 324 W HZ2 . 17273 1 659 . 1 1 59 59 TRP HZ3 H 1 7.304 0.04 . 3 . . . . 324 W HZ3 . 17273 1 660 . 1 1 59 59 TRP CA C 13 58.143 0.4 . 1 . . . . 324 W CA . 17273 1 661 . 1 1 59 59 TRP CB C 13 28.693 0.4 . 1 . . . . 324 W CB . 17273 1 662 . 1 1 59 59 TRP CD1 C 13 128.068 0.4 . 3 . . . . 324 W CD1 . 17273 1 663 . 1 1 59 59 TRP CE3 C 13 121.819 0.4 . 3 . . . . 324 W CE3 . 17273 1 664 . 1 1 59 59 TRP CH2 C 13 123.566 0.4 . 1 . . . . 324 W CH2 . 17273 1 665 . 1 1 59 59 TRP CZ2 C 13 114.085 0.4 . 3 . . . . 324 W CZ2 . 17273 1 666 . 1 1 59 59 TRP CZ3 C 13 121.850 0.4 . 3 . . . . 324 W CZ3 . 17273 1 667 . 1 1 59 59 TRP N N 15 123.397 0.4 . 1 . . . . 324 W N . 17273 1 668 . 1 1 59 59 TRP NE1 N 15 127.950 0.4 . 1 . . . . 324 W NE1 . 17273 1 669 . 1 1 60 60 ASP H H 1 8.769 0.04 . 1 . . . . 325 D HN . 17273 1 670 . 1 1 60 60 ASP HA H 1 4.931 0.04 . 1 . . . . 325 D HA . 17273 1 671 . 1 1 60 60 ASP HB2 H 1 2.958 0.04 . 2 . . . . 325 D HB1 . 17273 1 672 . 1 1 60 60 ASP CA C 13 54.748 0.4 . 1 . . . . 325 D CA . 17273 1 673 . 1 1 60 60 ASP CB C 13 41.374 0.4 . 1 . . . . 325 D CB . 17273 1 674 . 1 1 60 60 ASP N N 15 118.225 0.4 . 1 . . . . 325 D N . 17273 1 675 . 1 1 61 61 GLN H H 1 7.266 0.04 . 1 . . . . 326 Q HN . 17273 1 676 . 1 1 61 61 GLN HA H 1 4.743 0.04 . 1 . . . . 326 Q HA . 17273 1 677 . 1 1 61 61 GLN HB2 H 1 2.278 0.04 . 2 . . . . 326 Q HB1 . 17273 1 678 . 1 1 61 61 GLN HB3 H 1 1.603 0.04 . 2 . . . . 326 Q HB2 . 17273 1 679 . 1 1 61 61 GLN HE21 H 1 8.048 0.04 . 2 . . . . 326 Q HE21 . 17273 1 680 . 1 1 61 61 GLN HE22 H 1 6.209 0.04 . 2 . . . . 326 Q HE22 . 17273 1 681 . 1 1 61 61 GLN HG2 H 1 2.439 0.04 . 2 . . . . 326 Q HG1 . 17273 1 682 . 1 1 61 61 GLN HG3 H 1 2.142 0.04 . 2 . . . . 326 Q HG2 . 17273 1 683 . 1 1 61 61 GLN CA C 13 55.054 0.4 . 1 . . . . 326 Q CA . 17273 1 684 . 1 1 61 61 GLN CB C 13 35.100 0.4 . 1 . . . . 326 Q CB . 17273 1 685 . 1 1 61 61 GLN CG C 13 35.860 0.4 . 1 . . . . 326 Q CG . 17273 1 686 . 1 1 61 61 GLN N N 15 117.815 0.4 . 1 . . . . 326 Q N . 17273 1 687 . 1 1 61 61 GLN NE2 N 15 109.128 0.4 . 1 . . . . 326 Q NE2 . 17273 1 688 . 1 1 62 62 ASN H H 1 8.784 0.04 . 1 . . . . 327 N HN . 17273 1 689 . 1 1 62 62 ASN HA H 1 5.500 0.04 . 1 . . . . 327 N HA . 17273 1 690 . 1 1 62 62 ASN HB2 H 1 3.148 0.04 . 2 . . . . 327 N HB1 . 17273 1 691 . 1 1 62 62 ASN HB3 H 1 2.799 0.04 . 2 . . . . 327 N HB2 . 17273 1 692 . 1 1 62 62 ASN HD21 H 1 7.838 0.04 . 2 . . . . 327 N HD21 . 17273 1 693 . 1 1 62 62 ASN HD22 H 1 6.701 0.04 . 2 . . . . 327 N HD22 . 17273 1 694 . 1 1 62 62 ASN CA C 13 52.480 0.4 . 1 . . . . 327 N CA . 17273 1 695 . 1 1 62 62 ASN CB C 13 39.010 0.4 . 1 . . . . 327 N CB . 17273 1 696 . 1 1 62 62 ASN N N 15 116.084 0.4 . 1 . . . . 327 N N . 17273 1 697 . 1 1 62 62 ASN ND2 N 15 114.379 0.4 . 1 . . . . 327 N ND2 . 17273 1 698 . 1 1 63 63 PRO HA H 1 4.567 0.04 . 1 . . . . 328 P HA . 17273 1 699 . 1 1 63 63 PRO HB2 H 1 2.445 0.04 . 2 . . . . 328 P HB1 . 17273 1 700 . 1 1 63 63 PRO HB3 H 1 2.202 0.04 . 2 . . . . 328 P HB2 . 17273 1 701 . 1 1 63 63 PRO HD2 H 1 3.569 0.04 . 2 . . . . 328 P HD1 . 17273 1 702 . 1 1 63 63 PRO HD3 H 1 3.634 0.04 . 2 . . . . 328 P HD2 . 17273 1 703 . 1 1 63 63 PRO HG2 H 1 2.021 0.04 . 2 . . . . 328 P HG1 . 17273 1 704 . 1 1 63 63 PRO HG3 H 1 1.925 0.04 . 2 . . . . 328 P HG2 . 17273 1 705 . 1 1 63 63 PRO CA C 13 65.857 0.4 . 1 . . . . 328 P CA . 17273 1 706 . 1 1 63 63 PRO CB C 13 30.870 0.4 . 1 . . . . 328 P CB . 17273 1 707 . 1 1 63 63 PRO CD C 13 50.530 0.4 . 1 . . . . 328 P CD . 17273 1 708 . 1 1 63 63 PRO CG C 13 24.732 0.4 . 1 . . . . 328 P CG . 17273 1 709 . 1 1 64 64 LYS H H 1 8.456 0.04 . 1 . . . . 329 K HN . 17273 1 710 . 1 1 64 64 LYS HA H 1 4.500 0.04 . 1 . . . . 329 K HA . 17273 1 711 . 1 1 64 64 LYS HB2 H 1 2.113 0.04 . 2 . . . . 329 K HB1 . 17273 1 712 . 1 1 64 64 LYS HD2 H 1 1.888 0.04 . 2 . . . . 329 K HD1 . 17273 1 713 . 1 1 64 64 LYS HE2 H 1 3.125 0.04 . 2 . . . . 329 K HE1 . 17273 1 714 . 1 1 64 64 LYS HG2 H 1 1.707 0.04 . 2 . . . . 329 K HG1 . 17273 1 715 . 1 1 64 64 LYS HG3 H 1 1.572 0.04 . 2 . . . . 329 K HG2 . 17273 1 716 . 1 1 64 64 LYS CA C 13 57.181 0.4 . 1 . . . . 329 K CA . 17273 1 717 . 1 1 64 64 LYS CB C 13 31.660 0.4 . 1 . . . . 329 K CB . 17273 1 718 . 1 1 64 64 LYS CD C 13 29.063 0.4 . 1 . . . . 329 K CD . 17273 1 719 . 1 1 64 64 LYS CE C 13 41.450 0.4 . 1 . . . . 329 K CE . 17273 1 720 . 1 1 64 64 LYS CG C 13 25.940 0.4 . 1 . . . . 329 K CG . 17273 1 721 . 1 1 64 64 LYS N N 15 111.420 0.4 . 1 . . . . 329 K N . 17273 1 722 . 1 1 65 65 SER H H 1 8.652 0.04 . 1 . . . . 330 S HN . 17273 1 723 . 1 1 65 65 SER HA H 1 4.546 0.04 . 1 . . . . 330 S HA . 17273 1 724 . 1 1 65 65 SER HB2 H 1 4.491 0.04 . 2 . . . . 330 S HB1 . 17273 1 725 . 1 1 65 65 SER CA C 13 60.759 0.4 . 1 . . . . 330 S CA . 17273 1 726 . 1 1 65 65 SER CB C 13 63.149 0.4 . 1 . . . . 330 S CB . 17273 1 727 . 1 1 65 65 SER N N 15 119.440 0.4 . 1 . . . . 330 S N . 17273 1 728 . 1 1 66 66 THR H H 1 8.040 0.04 . 1 . . . . 331 T HN . 17273 1 729 . 1 1 66 66 THR HA H 1 4.970 0.04 . 1 . . . . 331 T HA . 17273 1 730 . 1 1 66 66 THR HB H 1 3.838 0.04 . 1 . . . . 331 T HB . 17273 1 731 . 1 1 66 66 THR HG21 H 1 0.992 0.04 . 1 . . . . 331 T HG21 . 17273 1 732 . 1 1 66 66 THR HG22 H 1 0.992 0.04 . 1 . . . . 331 T HG21 . 17273 1 733 . 1 1 66 66 THR HG23 H 1 0.992 0.04 . 1 . . . . 331 T HG21 . 17273 1 734 . 1 1 66 66 THR CA C 13 59.137 0.4 . 1 . . . . 331 T CA . 17273 1 735 . 1 1 66 66 THR CB C 13 71.822 0.4 . 1 . . . . 331 T CB . 17273 1 736 . 1 1 66 66 THR CG2 C 13 21.227 0.4 . 1 . . . . 331 T CG2 . 17273 1 737 . 1 1 66 66 THR N N 15 108.840 0.4 . 1 . . . . 331 T N . 17273 1 738 . 1 1 67 67 PHE H H 1 8.555 0.04 . 1 . . . . 332 F HN . 17273 1 739 . 1 1 67 67 PHE HA H 1 4.817 0.04 . 1 . . . . 332 F HA . 17273 1 740 . 1 1 67 67 PHE HB2 H 1 2.912 0.04 . 2 . . . . 332 F HB1 . 17273 1 741 . 1 1 67 67 PHE HB3 H 1 2.670 0.04 . 2 . . . . 332 F HB2 . 17273 1 742 . 1 1 67 67 PHE HD1 H 1 6.300 0.04 . 3 . . . . 332 F HD1 . 17273 1 743 . 1 1 67 67 PHE HE1 H 1 6.450 0.04 . 3 . . . . 332 F HE1 . 17273 1 744 . 1 1 67 67 PHE HZ H 1 5.787 0.04 . 1 . . . . 332 F HZ . 17273 1 745 . 1 1 67 67 PHE CA C 13 54.969 0.4 . 1 . . . . 332 F CA . 17273 1 746 . 1 1 67 67 PHE CB C 13 41.370 0.4 . 1 . . . . 332 F CB . 17273 1 747 . 1 1 67 67 PHE CD1 C 13 132.600 0.4 . 3 . . . . 332 F CD1 . 17273 1 748 . 1 1 67 67 PHE CE1 C 13 130.060 0.4 . 3 . . . . 332 F CE1 . 17273 1 749 . 1 1 67 67 PHE CZ C 13 128.367 0.4 . 1 . . . . 332 F CZ . 17273 1 750 . 1 1 67 67 PHE N N 15 118.760 0.4 . 1 . . . . 332 F N . 17273 1 751 . 1 1 68 68 LYS H H 1 8.265 0.04 . 1 . . . . 333 K HN . 17273 1 752 . 1 1 68 68 LYS HA H 1 4.752 0.04 . 1 . . . . 333 K HA . 17273 1 753 . 1 1 68 68 LYS HB2 H 1 1.686 0.04 . 2 . . . . 333 K HB1 . 17273 1 754 . 1 1 68 68 LYS HD2 H 1 1.644 0.04 . 2 . . . . 333 K HD1 . 17273 1 755 . 1 1 68 68 LYS HE2 H 1 2.970 0.04 . 2 . . . . 333 K HE1 . 17273 1 756 . 1 1 68 68 LYS HG2 H 1 1.359 0.04 . 2 . . . . 333 K HG1 . 17273 1 757 . 1 1 68 68 LYS CA C 13 54.680 0.4 . 1 . . . . 333 K CA . 17273 1 758 . 1 1 68 68 LYS CB C 13 33.570 0.4 . 1 . . . . 333 K CB . 17273 1 759 . 1 1 68 68 LYS CD C 13 29.300 0.4 . 1 . . . . 333 K CD . 17273 1 760 . 1 1 68 68 LYS CE C 13 41.890 0.4 . 1 . . . . 333 K CE . 17273 1 761 . 1 1 68 68 LYS CG C 13 25.157 0.4 . 1 . . . . 333 K CG . 17273 1 762 . 1 1 68 68 LYS N N 15 118.470 0.4 . 1 . . . . 333 K N . 17273 1 763 . 1 1 69 69 LYS H H 1 8.711 0.04 . 1 . . . . 334 K HN . 17273 1 764 . 1 1 69 69 LYS HA H 1 4.396 0.04 . 1 . . . . 334 K HA . 17273 1 765 . 1 1 69 69 LYS HB2 H 1 2.013 0.04 . 2 . . . . 334 K HB1 . 17273 1 766 . 1 1 69 69 LYS HB3 H 1 1.900 0.04 . 2 . . . . 334 K HB2 . 17273 1 767 . 1 1 69 69 LYS HD2 H 1 1.660 0.04 . 2 . . . . 334 K HD1 . 17273 1 768 . 1 1 69 69 LYS HE2 H 1 2.880 0.04 . 2 . . . . 334 K HE1 . 17273 1 769 . 1 1 69 69 LYS HG2 H 1 1.334 0.04 . 2 . . . . 334 K HG1 . 17273 1 770 . 1 1 69 69 LYS CA C 13 55.850 0.4 . 1 . . . . 334 K CA . 17273 1 771 . 1 1 69 69 LYS CB C 13 33.601 0.4 . 1 . . . . 334 K CB . 17273 1 772 . 1 1 69 69 LYS CD C 13 29.305 0.4 . 1 . . . . 334 K CD . 17273 1 773 . 1 1 69 69 LYS CE C 13 41.427 0.4 . 1 . . . . 334 K CE . 17273 1 774 . 1 1 69 69 LYS CG C 13 25.630 0.4 . 1 . . . . 334 K CG . 17273 1 775 . 1 1 69 69 LYS N N 15 123.947 0.4 . 1 . . . . 334 K N . 17273 1 776 . 1 1 70 70 ALA H H 1 8.865 0.04 . 1 . . . . 335 A HN . 17273 1 777 . 1 1 70 70 ALA HA H 1 4.188 0.04 . 1 . . . . 335 A HA . 17273 1 778 . 1 1 70 70 ALA HB1 H 1 1.530 0.04 . 1 . . . . 335 A HB1 . 17273 1 779 . 1 1 70 70 ALA HB2 H 1 1.530 0.04 . 1 . . . . 335 A HB1 . 17273 1 780 . 1 1 70 70 ALA HB3 H 1 1.530 0.04 . 1 . . . . 335 A HB1 . 17273 1 781 . 1 1 70 70 ALA CA C 13 54.973 0.4 . 1 . . . . 335 A CA . 17273 1 782 . 1 1 70 70 ALA CB C 13 18.287 0.4 . 1 . . . . 335 A CB . 17273 1 783 . 1 1 70 70 ALA N N 15 124.350 0.4 . 1 . . . . 335 A N . 17273 1 784 . 1 1 71 71 ASP H H 1 7.662 0.04 . 1 . . . . 336 D HN . 17273 1 785 . 1 1 71 71 ASP HA H 1 4.520 0.04 . 1 . . . . 336 D HA . 17273 1 786 . 1 1 71 71 ASP HB2 H 1 3.140 0.04 . 2 . . . . 336 D HB1 . 17273 1 787 . 1 1 71 71 ASP HB3 H 1 2.670 0.04 . 2 . . . . 336 D HB2 . 17273 1 788 . 1 1 71 71 ASP CA C 13 53.349 0.4 . 1 . . . . 336 D CA . 17273 1 789 . 1 1 71 71 ASP CB C 13 39.690 0.4 . 1 . . . . 336 D CB . 17273 1 790 . 1 1 71 71 ASP N N 15 113.823 0.4 . 1 . . . . 336 D N . 17273 1 791 . 1 1 72 72 GLY H H 1 8.212 0.04 . 1 . . . . 337 G HN . 17273 1 792 . 1 1 72 72 GLY HA2 H 1 4.402 0.04 . 2 . . . . 337 G HA1 . 17273 1 793 . 1 1 72 72 GLY HA3 H 1 3.588 0.04 . 2 . . . . 337 G HA2 . 17273 1 794 . 1 1 72 72 GLY CA C 13 44.902 0.4 . 1 . . . . 337 G CA . 17273 1 795 . 1 1 72 72 GLY N N 15 108.807 0.4 . 1 . . . . 337 G N . 17273 1 796 . 1 1 73 73 SER H H 1 8.233 0.04 . 1 . . . . 338 S HN . 17273 1 797 . 1 1 73 73 SER HA H 1 4.384 0.04 . 1 . . . . 338 S HA . 17273 1 798 . 1 1 73 73 SER HB2 H 1 3.876 0.04 . 2 . . . . 338 S HB1 . 17273 1 799 . 1 1 73 73 SER CA C 13 58.917 0.4 . 1 . . . . 338 S CA . 17273 1 800 . 1 1 73 73 SER CB C 13 63.952 0.4 . 1 . . . . 338 S CB . 17273 1 801 . 1 1 73 73 SER N N 15 117.800 0.4 . 1 . . . . 338 S N . 17273 1 802 . 1 1 74 74 GLU H H 1 8.426 0.04 . 1 . . . . 339 E HN . 17273 1 803 . 1 1 74 74 GLU HA H 1 5.008 0.04 . 1 . . . . 339 E HA . 17273 1 804 . 1 1 74 74 GLU HB2 H 1 1.747 0.04 . 2 . . . . 339 E HB1 . 17273 1 805 . 1 1 74 74 GLU HG2 H 1 2.087 0.04 . 2 . . . . 339 E HG1 . 17273 1 806 . 1 1 74 74 GLU HG3 H 1 1.931 0.04 . 2 . . . . 339 E HG2 . 17273 1 807 . 1 1 74 74 GLU CA C 13 55.020 0.4 . 1 . . . . 339 E CA . 17273 1 808 . 1 1 74 74 GLU CB C 13 32.440 0.4 . 1 . . . . 339 E CB . 17273 1 809 . 1 1 74 74 GLU CG C 13 36.975 0.4 . 1 . . . . 339 E CG . 17273 1 810 . 1 1 74 74 GLU N N 15 120.328 0.4 . 1 . . . . 339 E N . 17273 1 811 . 1 1 75 75 VAL H H 1 8.281 0.04 . 1 . . . . 340 V HN . 17273 1 812 . 1 1 75 75 VAL HA H 1 4.496 0.04 . 1 . . . . 340 V HA . 17273 1 813 . 1 1 75 75 VAL HB H 1 1.752 0.04 . 1 . . . . 340 V HB . 17273 1 814 . 1 1 75 75 VAL HG11 H 1 0.463 0.04 . 2 . . . . 340 V HG11 . 17273 1 815 . 1 1 75 75 VAL HG12 H 1 0.463 0.04 . 2 . . . . 340 V HG11 . 17273 1 816 . 1 1 75 75 VAL HG13 H 1 0.463 0.04 . 2 . . . . 340 V HG11 . 17273 1 817 . 1 1 75 75 VAL HG21 H 1 0.814 0.04 . 2 . . . . 340 V HG21 . 17273 1 818 . 1 1 75 75 VAL HG22 H 1 0.814 0.04 . 2 . . . . 340 V HG21 . 17273 1 819 . 1 1 75 75 VAL HG23 H 1 0.814 0.04 . 2 . . . . 340 V HG21 . 17273 1 820 . 1 1 75 75 VAL CA C 13 59.217 0.4 . 1 . . . . 340 V CA . 17273 1 821 . 1 1 75 75 VAL CB C 13 35.752 0.4 . 1 . . . . 340 V CB . 17273 1 822 . 1 1 75 75 VAL CG1 C 13 20.715 0.4 . 1 . . . . 340 V CG1 . 17273 1 823 . 1 1 75 75 VAL CG2 C 13 20.489 0.4 . 1 . . . . 340 V CG2 . 17273 1 824 . 1 1 75 75 VAL N N 15 121.560 0.4 . 1 . . . . 340 V N . 17273 1 825 . 1 1 76 76 SER H H 1 8.453 0.04 . 1 . . . . 341 S HN . 17273 1 826 . 1 1 76 76 SER HA H 1 5.156 0.04 . 1 . . . . 341 S HA . 17273 1 827 . 1 1 76 76 SER HB2 H 1 4.424 0.04 . 2 . . . . 341 S HB1 . 17273 1 828 . 1 1 76 76 SER HB3 H 1 3.940 0.04 . 2 . . . . 341 S HB2 . 17273 1 829 . 1 1 76 76 SER CA C 13 56.320 0.4 . 1 . . . . 341 S CA . 17273 1 830 . 1 1 76 76 SER CB C 13 65.388 0.4 . 1 . . . . 341 S CB . 17273 1 831 . 1 1 76 76 SER N N 15 118.283 0.4 . 1 . . . . 341 S N . 17273 1 832 . 1 1 77 77 PHE H H 1 8.214 0.04 . 1 . . . . 342 F HN . 17273 1 833 . 1 1 77 77 PHE HA H 1 4.586 0.04 . 1 . . . . 342 F HA . 17273 1 834 . 1 1 77 77 PHE HB2 H 1 3.648 0.04 . 2 . . . . 342 F HB1 . 17273 1 835 . 1 1 77 77 PHE HB3 H 1 3.167 0.04 . 2 . . . . 342 F HB2 . 17273 1 836 . 1 1 77 77 PHE HD1 H 1 7.442 0.04 . 3 . . . . 342 F HD1 . 17273 1 837 . 1 1 77 77 PHE HE1 H 1 7.089 0.04 . 3 . . . . 342 F HE1 . 17273 1 838 . 1 1 77 77 PHE HZ H 1 7.213 0.04 . 1 . . . . 342 F HZ . 17273 1 839 . 1 1 77 77 PHE CA C 13 63.930 0.4 . 1 . . . . 342 F CA . 17273 1 840 . 1 1 77 77 PHE CB C 13 38.486 0.4 . 1 . . . . 342 F CB . 17273 1 841 . 1 1 77 77 PHE CD1 C 13 131.586 0.4 . 3 . . . . 342 F CD1 . 17273 1 842 . 1 1 77 77 PHE CE1 C 13 131.951 0.4 . 3 . . . . 342 F CE1 . 17273 1 843 . 1 1 77 77 PHE CZ C 13 129.837 0.4 . 1 . . . . 342 F CZ . 17273 1 844 . 1 1 77 77 PHE N N 15 119.220 0.4 . 1 . . . . 342 F N . 17273 1 845 . 1 1 78 78 LEU H H 1 8.561 0.04 . 1 . . . . 343 L HN . 17273 1 846 . 1 1 78 78 LEU HA H 1 4.219 0.04 . 1 . . . . 343 L HA . 17273 1 847 . 1 1 78 78 LEU HB2 H 1 1.858 0.04 . 2 . . . . 343 L HB1 . 17273 1 848 . 1 1 78 78 LEU HB3 H 1 1.579 0.04 . 2 . . . . 343 L HB2 . 17273 1 849 . 1 1 78 78 LEU HD11 H 1 1.054 0.04 . 2 . . . . 343 L HD11 . 17273 1 850 . 1 1 78 78 LEU HD12 H 1 1.054 0.04 . 2 . . . . 343 L HD11 . 17273 1 851 . 1 1 78 78 LEU HD13 H 1 1.054 0.04 . 2 . . . . 343 L HD11 . 17273 1 852 . 1 1 78 78 LEU HD21 H 1 0.999 0.04 . 2 . . . . 343 L HD21 . 17273 1 853 . 1 1 78 78 LEU HD22 H 1 0.999 0.04 . 2 . . . . 343 L HD21 . 17273 1 854 . 1 1 78 78 LEU HD23 H 1 0.999 0.04 . 2 . . . . 343 L HD21 . 17273 1 855 . 1 1 78 78 LEU HG H 1 1.677 0.04 . 1 . . . . 343 L HG . 17273 1 856 . 1 1 78 78 LEU CA C 13 58.768 0.4 . 1 . . . . 343 L CA . 17273 1 857 . 1 1 78 78 LEU CB C 13 43.690 0.4 . 1 . . . . 343 L CB . 17273 1 858 . 1 1 78 78 LEU CD1 C 13 25.630 0.4 . 1 . . . . 343 L CD1 . 17273 1 859 . 1 1 78 78 LEU CD2 C 13 25.110 0.4 . 1 . . . . 343 L CD2 . 17273 1 860 . 1 1 78 78 LEU CG C 13 26.930 0.4 . 1 . . . . 343 L CG . 17273 1 861 . 1 1 78 78 LEU N N 15 117.502 0.4 . 1 . . . . 343 L N . 17273 1 862 . 1 1 79 79 GLU H H 1 8.182 0.04 . 1 . . . . 344 E HN . 17273 1 863 . 1 1 79 79 GLU HA H 1 4.173 0.04 . 1 . . . . 344 E HA . 17273 1 864 . 1 1 79 79 GLU HB2 H 1 2.187 0.04 . 2 . . . . 344 E HB1 . 17273 1 865 . 1 1 79 79 GLU HB3 H 1 2.090 0.04 . 2 . . . . 344 E HB2 . 17273 1 866 . 1 1 79 79 GLU HG2 H 1 2.359 0.04 . 2 . . . . 344 E HG1 . 17273 1 867 . 1 1 79 79 GLU HG3 H 1 2.286 0.04 . 2 . . . . 344 E HG2 . 17273 1 868 . 1 1 79 79 GLU CA C 13 58.950 0.4 . 1 . . . . 344 E CA . 17273 1 869 . 1 1 79 79 GLU CB C 13 29.795 0.4 . 1 . . . . 344 E CB . 17273 1 870 . 1 1 79 79 GLU CG C 13 36.419 0.4 . 1 . . . . 344 E CG . 17273 1 871 . 1 1 79 79 GLU N N 15 119.292 0.4 . 1 . . . . 344 E N . 17273 1 872 . 1 1 80 80 TYR H H 1 8.920 0.04 . 1 . . . . 345 Y HN . 17273 1 873 . 1 1 80 80 TYR HA H 1 4.321 0.04 . 1 . . . . 345 Y HA . 17273 1 874 . 1 1 80 80 TYR HB2 H 1 3.302 0.04 . 2 . . . . 345 Y HB1 . 17273 1 875 . 1 1 80 80 TYR HB3 H 1 3.163 0.04 . 2 . . . . 345 Y HB2 . 17273 1 876 . 1 1 80 80 TYR HD1 H 1 6.731 0.04 . 3 . . . . 345 Y HD1 . 17273 1 877 . 1 1 80 80 TYR HE1 H 1 6.614 0.04 . 3 . . . . 345 Y HE1 . 17273 1 878 . 1 1 80 80 TYR CA C 13 61.306 0.4 . 1 . . . . 345 Y CA . 17273 1 879 . 1 1 80 80 TYR CB C 13 39.270 0.4 . 1 . . . . 345 Y CB . 17273 1 880 . 1 1 80 80 TYR CD1 C 13 133.090 0.4 . 3 . . . . 345 Y CD1 . 17273 1 881 . 1 1 80 80 TYR CE1 C 13 117.610 0.4 . 3 . . . . 345 Y CE1 . 17273 1 882 . 1 1 80 80 TYR N N 15 121.130 0.4 . 1 . . . . 345 Y N . 17273 1 883 . 1 1 81 81 TYR H H 1 8.977 0.04 . 1 . . . . 346 Y HN . 17273 1 884 . 1 1 81 81 TYR HA H 1 3.832 0.04 . 1 . . . . 346 Y HA . 17273 1 885 . 1 1 81 81 TYR HB2 H 1 3.092 0.04 . 2 . . . . 346 Y HB1 . 17273 1 886 . 1 1 81 81 TYR HB3 H 1 2.931 0.04 . 2 . . . . 346 Y HB2 . 17273 1 887 . 1 1 81 81 TYR HD1 H 1 7.210 0.04 . 3 . . . . 346 Y HD1 . 17273 1 888 . 1 1 81 81 TYR HE1 H 1 6.652 0.04 . 3 . . . . 346 Y HE1 . 17273 1 889 . 1 1 81 81 TYR CA C 13 64.980 0.4 . 1 . . . . 346 Y CA . 17273 1 890 . 1 1 81 81 TYR CB C 13 37.170 0.4 . 1 . . . . 346 Y CB . 17273 1 891 . 1 1 81 81 TYR CD1 C 13 132.830 0.4 . 3 . . . . 346 Y CD1 . 17273 1 892 . 1 1 81 81 TYR CE1 C 13 118.478 0.4 . 3 . . . . 346 Y CE1 . 17273 1 893 . 1 1 81 81 TYR N N 15 115.280 0.4 . 1 . . . . 346 Y N . 17273 1 894 . 1 1 82 82 ARG H H 1 7.579 0.04 . 1 . . . . 347 R HN . 17273 1 895 . 1 1 82 82 ARG HA H 1 4.181 0.04 . 1 . . . . 347 R HA . 17273 1 896 . 1 1 82 82 ARG HB2 H 1 2.137 0.04 . 2 . . . . 347 R HB1 . 17273 1 897 . 1 1 82 82 ARG HB3 H 1 2.009 0.04 . 2 . . . . 347 R HB2 . 17273 1 898 . 1 1 82 82 ARG HD2 H 1 3.231 0.04 . 2 . . . . 347 R HD1 . 17273 1 899 . 1 1 82 82 ARG HE H 1 8.063 0.04 . 1 . . . . 347 R HE . 17273 1 900 . 1 1 82 82 ARG HG2 H 1 1.804 0.04 . 2 . . . . 347 R HG1 . 17273 1 901 . 1 1 82 82 ARG HG3 H 1 1.647 0.04 . 2 . . . . 347 R HG2 . 17273 1 902 . 1 1 82 82 ARG CA C 13 59.735 0.4 . 1 . . . . 347 R CA . 17273 1 903 . 1 1 82 82 ARG CB C 13 30.890 0.4 . 1 . . . . 347 R CB . 17273 1 904 . 1 1 82 82 ARG CD C 13 43.489 0.4 . 1 . . . . 347 R CD . 17273 1 905 . 1 1 82 82 ARG CG C 13 26.965 0.4 . 1 . . . . 347 R CG . 17273 1 906 . 1 1 82 82 ARG N N 15 120.810 0.4 . 1 . . . . 347 R N . 17273 1 907 . 1 1 82 82 ARG NE N 15 107.590 0.4 . 1 . . . . 347 R NE . 17273 1 908 . 1 1 83 83 LYS H H 1 8.395 0.04 . 1 . . . . 348 K HN . 17273 1 909 . 1 1 83 83 LYS HA H 1 4.080 0.04 . 1 . . . . 348 K HA . 17273 1 910 . 1 1 83 83 LYS HB2 H 1 1.928 0.04 . 2 . . . . 348 K HB1 . 17273 1 911 . 1 1 83 83 LYS HB3 H 1 1.814 0.04 . 2 . . . . 348 K HB2 . 17273 1 912 . 1 1 83 83 LYS HD2 H 1 1.700 0.04 . 2 . . . . 348 K HD1 . 17273 1 913 . 1 1 83 83 LYS HE2 H 1 3.020 0.04 . 2 . . . . 348 K HE1 . 17273 1 914 . 1 1 83 83 LYS HG2 H 1 1.555 0.04 . 2 . . . . 348 K HG1 . 17273 1 915 . 1 1 83 83 LYS HG3 H 1 1.478 0.04 . 2 . . . . 348 K HG2 . 17273 1 916 . 1 1 83 83 LYS CA C 13 58.867 0.4 . 1 . . . . 348 K CA . 17273 1 917 . 1 1 83 83 LYS CB C 13 32.912 0.4 . 1 . . . . 348 K CB . 17273 1 918 . 1 1 83 83 LYS CD C 13 28.780 0.4 . 1 . . . . 348 K CD . 17273 1 919 . 1 1 83 83 LYS CE C 13 41.960 0.4 . 1 . . . . 348 K CE . 17273 1 920 . 1 1 83 83 LYS CG C 13 25.351 0.4 . 1 . . . . 348 K CG . 17273 1 921 . 1 1 83 83 LYS N N 15 118.595 0.4 . 1 . . . . 348 K N . 17273 1 922 . 1 1 84 84 GLN H H 1 8.798 0.04 . 1 . . . . 349 Q HN . 17273 1 923 . 1 1 84 84 GLN HA H 1 3.776 0.04 . 1 . . . . 349 Q HA . 17273 1 924 . 1 1 84 84 GLN HB2 H 1 1.169 0.04 . 2 . . . . 349 Q HB1 . 17273 1 925 . 1 1 84 84 GLN HB3 H 1 0.701 0.04 . 2 . . . . 349 Q HB2 . 17273 1 926 . 1 1 84 84 GLN HE21 H 1 7.053 0.04 . 2 . . . . 349 Q HE21 . 17273 1 927 . 1 1 84 84 GLN HE22 H 1 6.810 0.04 . 2 . . . . 349 Q HE22 . 17273 1 928 . 1 1 84 84 GLN HG2 H 1 1.653 0.04 . 2 . . . . 349 Q HG1 . 17273 1 929 . 1 1 84 84 GLN HG3 H 1 1.024 0.04 . 2 . . . . 349 Q HG2 . 17273 1 930 . 1 1 84 84 GLN CA C 13 56.900 0.4 . 1 . . . . 349 Q CA . 17273 1 931 . 1 1 84 84 GLN CB C 13 27.962 0.4 . 1 . . . . 349 Q CB . 17273 1 932 . 1 1 84 84 GLN CG C 13 32.247 0.4 . 1 . . . . 349 Q CG . 17273 1 933 . 1 1 84 84 GLN N N 15 116.089 0.4 . 1 . . . . 349 Q N . 17273 1 934 . 1 1 84 84 GLN NE2 N 15 112.185 0.4 . 1 . . . . 349 Q NE2 . 17273 1 935 . 1 1 85 85 TYR H H 1 6.436 0.04 . 1 . . . . 350 Y HN . 17273 1 936 . 1 1 85 85 TYR HA H 1 5.080 0.04 . 1 . . . . 350 Y HA . 17273 1 937 . 1 1 85 85 TYR HB2 H 1 3.488 0.04 . 2 . . . . 350 Y HB1 . 17273 1 938 . 1 1 85 85 TYR HB3 H 1 2.520 0.04 . 2 . . . . 350 Y HB2 . 17273 1 939 . 1 1 85 85 TYR HD1 H 1 6.937 0.04 . 3 . . . . 350 Y HD1 . 17273 1 940 . 1 1 85 85 TYR HE1 H 1 6.803 0.04 . 3 . . . . 350 Y HE1 . 17273 1 941 . 1 1 85 85 TYR CA C 13 56.580 0.4 . 1 . . . . 350 Y CA . 17273 1 942 . 1 1 85 85 TYR CB C 13 41.110 0.4 . 1 . . . . 350 Y CB . 17273 1 943 . 1 1 85 85 TYR CD1 C 13 133.495 0.4 . 3 . . . . 350 Y CD1 . 17273 1 944 . 1 1 85 85 TYR CE1 C 13 118.200 0.4 . 3 . . . . 350 Y CE1 . 17273 1 945 . 1 1 85 85 TYR N N 15 110.200 0.4 . 1 . . . . 350 Y N . 17273 1 946 . 1 1 86 86 ASN H H 1 7.631 0.04 . 1 . . . . 351 N HN . 17273 1 947 . 1 1 86 86 ASN HA H 1 4.921 0.04 . 1 . . . . 351 N HA . 17273 1 948 . 1 1 86 86 ASN HB2 H 1 3.261 0.04 . 2 . . . . 351 N HB1 . 17273 1 949 . 1 1 86 86 ASN HB3 H 1 2.814 0.04 . 2 . . . . 351 N HB2 . 17273 1 950 . 1 1 86 86 ASN HD21 H 1 7.625 0.04 . 2 . . . . 351 N HD21 . 17273 1 951 . 1 1 86 86 ASN HD22 H 1 6.875 0.04 . 2 . . . . 351 N HD22 . 17273 1 952 . 1 1 86 86 ASN CA C 13 54.665 0.4 . 1 . . . . 351 N CA . 17273 1 953 . 1 1 86 86 ASN CB C 13 37.473 0.4 . 1 . . . . 351 N CB . 17273 1 954 . 1 1 86 86 ASN N N 15 118.834 0.4 . 1 . . . . 351 N N . 17273 1 955 . 1 1 86 86 ASN ND2 N 15 112.165 0.4 . 1 . . . . 351 N ND2 . 17273 1 956 . 1 1 87 87 GLN H H 1 7.893 0.04 . 1 . . . . 352 Q HN . 17273 1 957 . 1 1 87 87 GLN HA H 1 4.552 0.04 . 1 . . . . 352 Q HA . 17273 1 958 . 1 1 87 87 GLN HB2 H 1 2.100 0.04 . 2 . . . . 352 Q HB1 . 17273 1 959 . 1 1 87 87 GLN HB3 H 1 1.707 0.04 . 2 . . . . 352 Q HB2 . 17273 1 960 . 1 1 87 87 GLN HE21 H 1 7.546 0.04 . 2 . . . . 352 Q HE21 . 17273 1 961 . 1 1 87 87 GLN HE22 H 1 7.195 0.04 . 2 . . . . 352 Q HE22 . 17273 1 962 . 1 1 87 87 GLN HG2 H 1 2.393 0.04 . 2 . . . . 352 Q HG1 . 17273 1 963 . 1 1 87 87 GLN HG3 H 1 1.970 0.04 . 2 . . . . 352 Q HG2 . 17273 1 964 . 1 1 87 87 GLN CA C 13 53.464 0.4 . 1 . . . . 352 Q CA . 17273 1 965 . 1 1 87 87 GLN CB C 13 31.660 0.4 . 1 . . . . 352 Q CB . 17273 1 966 . 1 1 87 87 GLN CG C 13 33.502 0.4 . 1 . . . . 352 Q CG . 17273 1 967 . 1 1 87 87 GLN N N 15 115.744 0.4 . 1 . . . . 352 Q N . 17273 1 968 . 1 1 87 87 GLN NE2 N 15 115.280 0.4 . 1 . . . . 352 Q NE2 . 17273 1 969 . 1 1 88 88 GLU H H 1 8.640 0.04 . 1 . . . . 353 E HN . 17273 1 970 . 1 1 88 88 GLU HA H 1 4.414 0.04 . 1 . . . . 353 E HA . 17273 1 971 . 1 1 88 88 GLU HB2 H 1 1.950 0.04 . 2 . . . . 353 E HB1 . 17273 1 972 . 1 1 88 88 GLU HB3 H 1 1.840 0.04 . 2 . . . . 353 E HB2 . 17273 1 973 . 1 1 88 88 GLU HG2 H 1 2.131 0.04 . 2 . . . . 353 E HG1 . 17273 1 974 . 1 1 88 88 GLU CA C 13 55.010 0.4 . 1 . . . . 353 E CA . 17273 1 975 . 1 1 88 88 GLU CB C 13 30.596 0.4 . 1 . . . . 353 E CB . 17273 1 976 . 1 1 88 88 GLU CG C 13 35.371 0.4 . 1 . . . . 353 E CG . 17273 1 977 . 1 1 88 88 GLU N N 15 124.425 0.4 . 1 . . . . 353 E N . 17273 1 978 . 1 1 89 89 ILE H H 1 7.912 0.04 . 1 . . . . 354 I HN . 17273 1 979 . 1 1 89 89 ILE HA H 1 3.790 0.04 . 1 . . . . 354 I HA . 17273 1 980 . 1 1 89 89 ILE HB H 1 1.659 0.04 . 1 . . . . 354 I HB . 17273 1 981 . 1 1 89 89 ILE HD11 H 1 0.926 0.04 . 1 . . . . 354 I HD11 . 17273 1 982 . 1 1 89 89 ILE HD12 H 1 0.926 0.04 . 1 . . . . 354 I HD11 . 17273 1 983 . 1 1 89 89 ILE HD13 H 1 0.926 0.04 . 1 . . . . 354 I HD11 . 17273 1 984 . 1 1 89 89 ILE HG12 H 1 1.696 0.04 . 1 . . . . 354 I HG11 . 17273 1 985 . 1 1 89 89 ILE HG13 H 1 0.622 0.04 . 1 . . . . 354 I HG12 . 17273 1 986 . 1 1 89 89 ILE HG21 H 1 0.829 0.04 . 1 . . . . 354 I HG21 . 17273 1 987 . 1 1 89 89 ILE HG22 H 1 0.829 0.04 . 1 . . . . 354 I HG21 . 17273 1 988 . 1 1 89 89 ILE HG23 H 1 0.829 0.04 . 1 . . . . 354 I HG21 . 17273 1 989 . 1 1 89 89 ILE CA C 13 61.624 0.4 . 1 . . . . 354 I CA . 17273 1 990 . 1 1 89 89 ILE CB C 13 39.540 0.4 . 1 . . . . 354 I CB . 17273 1 991 . 1 1 89 89 ILE CD1 C 13 15.153 0.4 . 1 . . . . 354 I CD1 . 17273 1 992 . 1 1 89 89 ILE CG1 C 13 28.520 0.4 . 1 . . . . 354 I CG1 . 17273 1 993 . 1 1 89 89 ILE CG2 C 13 18.241 0.4 . 1 . . . . 354 I CG2 . 17273 1 994 . 1 1 89 89 ILE N N 15 126.717 0.4 . 1 . . . . 354 I N . 17273 1 995 . 1 1 90 90 THR H H 1 9.619 0.04 . 1 . . . . 355 T HN . 17273 1 996 . 1 1 90 90 THR HA H 1 4.490 0.04 . 1 . . . . 355 T HA . 17273 1 997 . 1 1 90 90 THR HB H 1 4.186 0.04 . 1 . . . . 355 T HB . 17273 1 998 . 1 1 90 90 THR HG21 H 1 1.208 0.04 . 1 . . . . 355 T HG21 . 17273 1 999 . 1 1 90 90 THR HG22 H 1 1.208 0.04 . 1 . . . . 355 T HG21 . 17273 1 1000 . 1 1 90 90 THR HG23 H 1 1.208 0.04 . 1 . . . . 355 T HG21 . 17273 1 1001 . 1 1 90 90 THR CA C 13 62.982 0.4 . 1 . . . . 355 T CA . 17273 1 1002 . 1 1 90 90 THR CB C 13 70.260 0.4 . 1 . . . . 355 T CB . 17273 1 1003 . 1 1 90 90 THR CG2 C 13 21.472 0.4 . 1 . . . . 355 T CG2 . 17273 1 1004 . 1 1 90 90 THR N N 15 119.245 0.4 . 1 . . . . 355 T N . 17273 1 1005 . 1 1 91 91 ASP H H 1 8.330 0.04 . 1 . . . . 356 D HN . 17273 1 1006 . 1 1 91 91 ASP HA H 1 4.881 0.04 . 1 . . . . 356 D HA . 17273 1 1007 . 1 1 91 91 ASP HB2 H 1 3.046 0.04 . 2 . . . . 356 D HB1 . 17273 1 1008 . 1 1 91 91 ASP HB3 H 1 2.387 0.04 . 2 . . . . 356 D HB2 . 17273 1 1009 . 1 1 91 91 ASP CA C 13 53.793 0.4 . 1 . . . . 356 D CA . 17273 1 1010 . 1 1 91 91 ASP CB C 13 42.423 0.4 . 1 . . . . 356 D CB . 17273 1 1011 . 1 1 91 91 ASP N N 15 124.986 0.4 . 1 . . . . 356 D N . 17273 1 1012 . 1 1 92 92 LEU H H 1 8.886 0.04 . 1 . . . . 357 L HN . 17273 1 1013 . 1 1 92 92 LEU HA H 1 4.307 0.04 . 1 . . . . 357 L HA . 17273 1 1014 . 1 1 92 92 LEU HB2 H 1 1.767 0.04 . 2 . . . . 357 L HB1 . 17273 1 1015 . 1 1 92 92 LEU HD11 H 1 1.012 0.04 . 2 . . . . 357 L HD11 . 17273 1 1016 . 1 1 92 92 LEU HD12 H 1 1.012 0.04 . 2 . . . . 357 L HD11 . 17273 1 1017 . 1 1 92 92 LEU HD13 H 1 1.012 0.04 . 2 . . . . 357 L HD11 . 17273 1 1018 . 1 1 92 92 LEU HD21 H 1 0.814 0.04 . 2 . . . . 357 L HD21 . 17273 1 1019 . 1 1 92 92 LEU HD22 H 1 0.814 0.04 . 2 . . . . 357 L HD21 . 17273 1 1020 . 1 1 92 92 LEU HD23 H 1 0.814 0.04 . 2 . . . . 357 L HD21 . 17273 1 1021 . 1 1 92 92 LEU HG H 1 1.801 0.04 . 1 . . . . 357 L HG . 17273 1 1022 . 1 1 92 92 LEU CA C 13 55.013 0.4 . 1 . . . . 357 L CA . 17273 1 1023 . 1 1 92 92 LEU CB C 13 40.534 0.4 . 1 . . . . 357 L CB . 17273 1 1024 . 1 1 92 92 LEU CD1 C 13 25.455 0.4 . 1 . . . . 357 L CD1 . 17273 1 1025 . 1 1 92 92 LEU CD2 C 13 23.142 0.4 . 1 . . . . 357 L CD2 . 17273 1 1026 . 1 1 92 92 LEU CG C 13 27.181 0.4 . 1 . . . . 357 L CG . 17273 1 1027 . 1 1 92 92 LEU N N 15 124.730 0.4 . 1 . . . . 357 L N . 17273 1 1028 . 1 1 93 93 LYS H H 1 8.591 0.04 . 1 . . . . 358 K HN . 17273 1 1029 . 1 1 93 93 LYS HA H 1 4.613 0.04 . 1 . . . . 358 K HA . 17273 1 1030 . 1 1 93 93 LYS HB2 H 1 2.053 0.04 . 2 . . . . 358 K HB1 . 17273 1 1031 . 1 1 93 93 LYS HB3 H 1 1.970 0.04 . 2 . . . . 358 K HB2 . 17273 1 1032 . 1 1 93 93 LYS HD2 H 1 1.752 0.04 . 2 . . . . 358 K HD1 . 17273 1 1033 . 1 1 93 93 LYS HE2 H 1 3.073 0.04 . 2 . . . . 358 K HE1 . 17273 1 1034 . 1 1 93 93 LYS HG2 H 1 1.515 0.04 . 2 . . . . 358 K HG1 . 17273 1 1035 . 1 1 93 93 LYS HG3 H 1 1.455 0.04 . 2 . . . . 358 K HG2 . 17273 1 1036 . 1 1 93 93 LYS CA C 13 55.574 0.4 . 1 . . . . 358 K CA . 17273 1 1037 . 1 1 93 93 LYS CB C 13 33.710 0.4 . 1 . . . . 358 K CB . 17273 1 1038 . 1 1 93 93 LYS CD C 13 28.833 0.4 . 1 . . . . 358 K CD . 17273 1 1039 . 1 1 93 93 LYS CE C 13 41.871 0.4 . 1 . . . . 358 K CE . 17273 1 1040 . 1 1 93 93 LYS CG C 13 25.037 0.4 . 1 . . . . 358 K CG . 17273 1 1041 . 1 1 93 93 LYS N N 15 118.100 0.4 . 1 . . . . 358 K N . 17273 1 1042 . 1 1 94 94 GLN H H 1 7.234 0.04 . 1 . . . . 359 Q HN . 17273 1 1043 . 1 1 94 94 GLN HA H 1 4.546 0.04 . 1 . . . . 359 Q HA . 17273 1 1044 . 1 1 94 94 GLN HB2 H 1 2.230 0.04 . 2 . . . . 359 Q HB1 . 17273 1 1045 . 1 1 94 94 GLN HB3 H 1 1.855 0.04 . 2 . . . . 359 Q HB2 . 17273 1 1046 . 1 1 94 94 GLN HG2 H 1 2.108 0.04 . 2 . . . . 359 Q HG1 . 17273 1 1047 . 1 1 94 94 GLN CA C 13 53.757 0.4 . 1 . . . . 359 Q CA . 17273 1 1048 . 1 1 94 94 GLN CB C 13 29.043 0.4 . 1 . . . . 359 Q CB . 17273 1 1049 . 1 1 94 94 GLN CG C 13 31.660 0.4 . 1 . . . . 359 Q CG . 17273 1 1050 . 1 1 94 94 GLN N N 15 121.790 0.4 . 1 . . . . 359 Q N . 17273 1 1051 . 1 1 95 95 PRO HA H 1 5.175 0.04 . 1 . . . . 360 P HA . 17273 1 1052 . 1 1 95 95 PRO HB2 H 1 1.659 0.04 . 2 . . . . 360 P HB1 . 17273 1 1053 . 1 1 95 95 PRO HB3 H 1 0.997 0.04 . 2 . . . . 360 P HB2 . 17273 1 1054 . 1 1 95 95 PRO HD2 H 1 3.684 0.04 . 2 . . . . 360 P HD1 . 17273 1 1055 . 1 1 95 95 PRO HD3 H 1 3.260 0.04 . 2 . . . . 360 P HD2 . 17273 1 1056 . 1 1 95 95 PRO HG2 H 1 0.784 0.04 . 2 . . . . 360 P HG1 . 17273 1 1057 . 1 1 95 95 PRO CA C 13 61.331 0.4 . 1 . . . . 360 P CA . 17273 1 1058 . 1 1 95 95 PRO CB C 13 32.620 0.4 . 1 . . . . 360 P CB . 17273 1 1059 . 1 1 95 95 PRO CD C 13 48.455 0.4 . 1 . . . . 360 P CD . 17273 1 1060 . 1 1 96 96 VAL H H 1 6.296 0.04 . 1 . . . . 361 V HN . 17273 1 1061 . 1 1 96 96 VAL HA H 1 4.024 0.04 . 1 . . . . 361 V HA . 17273 1 1062 . 1 1 96 96 VAL HB H 1 1.456 0.04 . 1 . . . . 361 V HB . 17273 1 1063 . 1 1 96 96 VAL HG11 H 1 0.429 0.04 . 2 . . . . 361 V HG11 . 17273 1 1064 . 1 1 96 96 VAL HG12 H 1 0.429 0.04 . 2 . . . . 361 V HG11 . 17273 1 1065 . 1 1 96 96 VAL HG13 H 1 0.429 0.04 . 2 . . . . 361 V HG11 . 17273 1 1066 . 1 1 96 96 VAL HG21 H 1 0.234 0.04 . 2 . . . . 361 V HG21 . 17273 1 1067 . 1 1 96 96 VAL HG22 H 1 0.234 0.04 . 2 . . . . 361 V HG21 . 17273 1 1068 . 1 1 96 96 VAL HG23 H 1 0.234 0.04 . 2 . . . . 361 V HG21 . 17273 1 1069 . 1 1 96 96 VAL CA C 13 60.780 0.4 . 1 . . . . 361 V CA . 17273 1 1070 . 1 1 96 96 VAL CB C 13 34.550 0.4 . 1 . . . . 361 V CB . 17273 1 1071 . 1 1 96 96 VAL CG1 C 13 21.754 0.4 . 1 . . . . 361 V CG1 . 17273 1 1072 . 1 1 96 96 VAL CG2 C 13 21.732 0.4 . 1 . . . . 361 V CG2 . 17273 1 1073 . 1 1 96 96 VAL N N 15 110.900 0.4 . 1 . . . . 361 V N . 17273 1 1074 . 1 1 97 97 LEU H H 1 8.862 0.04 . 1 . . . . 362 L HN . 17273 1 1075 . 1 1 97 97 LEU HA H 1 4.475 0.04 . 1 . . . . 362 L HA . 17273 1 1076 . 1 1 97 97 LEU HB2 H 1 1.699 0.04 . 2 . . . . 362 L HB1 . 17273 1 1077 . 1 1 97 97 LEU HB3 H 1 1.194 0.04 . 2 . . . . 362 L HB2 . 17273 1 1078 . 1 1 97 97 LEU HD11 H 1 0.707 0.04 . 2 . . . . 362 L HD11 . 17273 1 1079 . 1 1 97 97 LEU HD12 H 1 0.707 0.04 . 2 . . . . 362 L HD11 . 17273 1 1080 . 1 1 97 97 LEU HD13 H 1 0.707 0.04 . 2 . . . . 362 L HD11 . 17273 1 1081 . 1 1 97 97 LEU HD21 H 1 0.546 0.04 . 2 . . . . 362 L HD21 . 17273 1 1082 . 1 1 97 97 LEU HD22 H 1 0.546 0.04 . 2 . . . . 362 L HD21 . 17273 1 1083 . 1 1 97 97 LEU HD23 H 1 0.546 0.04 . 2 . . . . 362 L HD21 . 17273 1 1084 . 1 1 97 97 LEU HG H 1 1.414 0.04 . 1 . . . . 362 L HG . 17273 1 1085 . 1 1 97 97 LEU CA C 13 52.937 0.4 . 1 . . . . 362 L CA . 17273 1 1086 . 1 1 97 97 LEU CB C 13 42.150 0.4 . 1 . . . . 362 L CB . 17273 1 1087 . 1 1 97 97 LEU CD1 C 13 25.108 0.4 . 1 . . . . 362 L CD1 . 17273 1 1088 . 1 1 97 97 LEU CD2 C 13 23.069 0.4 . 1 . . . . 362 L CD2 . 17273 1 1089 . 1 1 97 97 LEU CG C 13 26.490 0.4 . 1 . . . . 362 L CG . 17273 1 1090 . 1 1 97 97 LEU N N 15 122.862 0.4 . 1 . . . . 362 L N . 17273 1 1091 . 1 1 98 98 VAL H H 1 8.335 0.04 . 1 . . . . 363 V HN . 17273 1 1092 . 1 1 98 98 VAL HA H 1 4.617 0.04 . 1 . . . . 363 V HA . 17273 1 1093 . 1 1 98 98 VAL HB H 1 1.670 0.04 . 1 . . . . 363 V HB . 17273 1 1094 . 1 1 98 98 VAL HG11 H 1 0.790 0.04 . 2 . . . . 363 V HG11 . 17273 1 1095 . 1 1 98 98 VAL HG12 H 1 0.790 0.04 . 2 . . . . 363 V HG11 . 17273 1 1096 . 1 1 98 98 VAL HG13 H 1 0.790 0.04 . 2 . . . . 363 V HG11 . 17273 1 1097 . 1 1 98 98 VAL HG21 H 1 0.910 0.04 . 2 . . . . 363 V HG21 . 17273 1 1098 . 1 1 98 98 VAL HG22 H 1 0.910 0.04 . 2 . . . . 363 V HG21 . 17273 1 1099 . 1 1 98 98 VAL HG23 H 1 0.910 0.04 . 2 . . . . 363 V HG21 . 17273 1 1100 . 1 1 98 98 VAL CA C 13 61.531 0.4 . 1 . . . . 363 V CA . 17273 1 1101 . 1 1 98 98 VAL CB C 13 34.049 0.4 . 1 . . . . 363 V CB . 17273 1 1102 . 1 1 98 98 VAL CG1 C 13 20.080 0.4 . 1 . . . . 363 V CG1 . 17273 1 1103 . 1 1 98 98 VAL CG2 C 13 21.250 0.4 . 1 . . . . 363 V CG2 . 17273 1 1104 . 1 1 98 98 VAL N N 15 122.123 0.4 . 1 . . . . 363 V N . 17273 1 1105 . 1 1 99 99 SER H H 1 8.793 0.04 . 1 . . . . 364 S HN . 17273 1 1106 . 1 1 99 99 SER HA H 1 5.216 0.04 . 1 . . . . 364 S HA . 17273 1 1107 . 1 1 99 99 SER HB2 H 1 3.670 0.04 . 2 . . . . 364 S HB1 . 17273 1 1108 . 1 1 99 99 SER HB3 H 1 3.459 0.04 . 2 . . . . 364 S HB2 . 17273 1 1109 . 1 1 99 99 SER CA C 13 56.890 0.4 . 1 . . . . 364 S CA . 17273 1 1110 . 1 1 99 99 SER CB C 13 65.702 0.4 . 1 . . . . 364 S CB . 17273 1 1111 . 1 1 99 99 SER N N 15 121.618 0.4 . 1 . . . . 364 S N . 17273 1 1112 . 1 1 100 100 GLN H H 1 10.259 0.04 . 1 . . . . 365 Q HN . 17273 1 1113 . 1 1 100 100 GLN HA H 1 4.734 0.04 . 1 . . . . 365 Q HA . 17273 1 1114 . 1 1 100 100 GLN HB2 H 1 2.160 0.04 . 2 . . . . 365 Q HB1 . 17273 1 1115 . 1 1 100 100 GLN HB3 H 1 1.962 0.04 . 2 . . . . 365 Q HB2 . 17273 1 1116 . 1 1 100 100 GLN HG2 H 1 2.404 0.04 . 2 . . . . 365 Q HG1 . 17273 1 1117 . 1 1 100 100 GLN CA C 13 53.502 0.4 . 1 . . . . 365 Q CA . 17273 1 1118 . 1 1 100 100 GLN CB C 13 28.740 0.4 . 1 . . . . 365 Q CB . 17273 1 1119 . 1 1 100 100 GLN CG C 13 32.768 0.4 . 1 . . . . 365 Q CG . 17273 1 1120 . 1 1 100 100 GLN N N 15 128.476 0.4 . 1 . . . . 365 Q N . 17273 1 1121 . 1 1 101 101 PRO HA H 1 4.574 0.04 . 1 . . . . 366 P HA . 17273 1 1122 . 1 1 101 101 PRO HB2 H 1 2.370 0.04 . 2 . . . . 366 P HB1 . 17273 1 1123 . 1 1 101 101 PRO HB3 H 1 2.070 0.04 . 2 . . . . 366 P HB2 . 17273 1 1124 . 1 1 101 101 PRO HD2 H 1 3.867 0.04 . 2 . . . . 366 P HD1 . 17273 1 1125 . 1 1 101 101 PRO HD3 H 1 3.800 0.04 . 2 . . . . 366 P HD2 . 17273 1 1126 . 1 1 101 101 PRO HG2 H 1 2.072 0.04 . 2 . . . . 366 P HG1 . 17273 1 1127 . 1 1 101 101 PRO CA C 13 63.670 0.4 . 1 . . . . 366 P CA . 17273 1 1128 . 1 1 101 101 PRO CB C 13 32.415 0.4 . 1 . . . . 366 P CB . 17273 1 1129 . 1 1 101 101 PRO CD C 13 50.816 0.4 . 1 . . . . 366 P CD . 17273 1 1130 . 1 1 101 101 PRO CG C 13 27.476 0.4 . 1 . . . . 366 P CG . 17273 1 1131 . 1 1 102 102 LYS H H 1 8.529 0.04 . 1 . . . . 367 K HN . 17273 1 1132 . 1 1 102 102 LYS HA H 1 4.310 0.04 . 1 . . . . 367 K HA . 17273 1 1133 . 1 1 102 102 LYS HB2 H 1 1.906 0.04 . 2 . . . . 367 K HB1 . 17273 1 1134 . 1 1 102 102 LYS HB3 H 1 1.812 0.04 . 2 . . . . 367 K HB2 . 17273 1 1135 . 1 1 102 102 LYS HG2 H 1 1.556 0.04 . 2 . . . . 367 K HG1 . 17273 1 1136 . 1 1 102 102 LYS HZ1 H 1 3.000 0.04 . 1 . . . . 367 K HZ1 . 17273 1 1137 . 1 1 102 102 LYS HZ2 H 1 3.000 0.04 . 1 . . . . 367 K HZ1 . 17273 1 1138 . 1 1 102 102 LYS HZ3 H 1 3.000 0.04 . 1 . . . . 367 K HZ1 . 17273 1 1139 . 1 1 102 102 LYS CA C 13 56.160 0.4 . 1 . . . . 367 K CA . 17273 1 1140 . 1 1 102 102 LYS CB C 13 32.780 0.4 . 1 . . . . 367 K CB . 17273 1 1141 . 1 1 102 102 LYS N N 15 121.493 0.4 . 1 . . . . 367 K N . 17273 1 1142 . 1 1 102 102 LYS NZ N 15 109.840 0.4 . 1 . . . . 367 K NZ . 17273 1 1143 . 1 1 103 103 ARG H H 1 8.248 0.04 . 1 . . . . 368 R HN . 17273 1 1144 . 1 1 103 103 ARG HA H 1 4.311 0.04 . 1 . . . . 368 R HA . 17273 1 1145 . 1 1 103 103 ARG HB2 H 1 1.823 0.04 . 2 . . . . 368 R HB1 . 17273 1 1146 . 1 1 103 103 ARG HD2 H 1 3.220 0.04 . 2 . . . . 368 R HD1 . 17273 1 1147 . 1 1 103 103 ARG HG2 H 1 1.642 0.04 . 2 . . . . 368 R HG1 . 17273 1 1148 . 1 1 103 103 ARG CA C 13 55.700 0.4 . 1 . . . . 368 R CA . 17273 1 1149 . 1 1 103 103 ARG CB C 13 30.520 0.4 . 1 . . . . 368 R CB . 17273 1 1150 . 1 1 103 103 ARG N N 15 120.989 0.4 . 1 . . . . 368 R N . 17273 1 1151 . 1 1 104 104 ARG H H 1 8.431 0.04 . 1 . . . . 369 R HN . 17273 1 1152 . 1 1 104 104 ARG HA H 1 4.347 0.04 . 1 . . . . 369 R HA . 17273 1 1153 . 1 1 104 104 ARG HB2 H 1 1.799 0.04 . 2 . . . . 369 R HB1 . 17273 1 1154 . 1 1 104 104 ARG HD2 H 1 3.229 0.04 . 2 . . . . 369 R HD1 . 17273 1 1155 . 1 1 104 104 ARG HG2 H 1 1.653 0.04 . 2 . . . . 369 R HG1 . 17273 1 1156 . 1 1 104 104 ARG CA C 13 56.200 0.4 . 1 . . . . 369 R CA . 17273 1 1157 . 1 1 104 104 ARG CB C 13 30.040 0.4 . 1 . . . . 369 R CB . 17273 1 1158 . 1 1 104 104 ARG N N 15 122.950 0.4 . 1 . . . . 369 R N . 17273 1 1159 . 1 1 105 105 ARG H H 1 8.493 0.04 . 1 . . . . 370 R HN . 17273 1 1160 . 1 1 105 105 ARG HA H 1 4.359 0.04 . 1 . . . . 370 R HA . 17273 1 1161 . 1 1 105 105 ARG HB2 H 1 1.833 0.04 . 2 . . . . 370 R HB1 . 17273 1 1162 . 1 1 105 105 ARG HD2 H 1 3.216 0.04 . 2 . . . . 370 R HD1 . 17273 1 1163 . 1 1 105 105 ARG HG2 H 1 1.680 0.04 . 2 . . . . 370 R HG1 . 17273 1 1164 . 1 1 105 105 ARG CA C 13 55.680 0.4 . 1 . . . . 370 R CA . 17273 1 1165 . 1 1 105 105 ARG CB C 13 30.650 0.4 . 1 . . . . 370 R CB . 17273 1 1166 . 1 1 105 105 ARG N N 15 121.630 0.4 . 1 . . . . 370 R N . 17273 1 1167 . 1 1 106 106 GLY H H 1 8.401 0.04 . 1 . . . . 371 G HN . 17273 1 1168 . 1 1 106 106 GLY HA2 H 1 4.253 0.04 . 2 . . . . 371 G HA1 . 17273 1 1169 . 1 1 106 106 GLY HA3 H 1 4.096 0.04 . 2 . . . . 371 G HA2 . 17273 1 1170 . 1 1 106 106 GLY CA C 13 44.330 0.4 . 1 . . . . 371 G CA . 17273 1 1171 . 1 1 106 106 GLY N N 15 110.342 0.4 . 1 . . . . 371 G N . 17273 1 1172 . 1 1 107 107 PRO HA H 1 4.490 0.04 . 1 . . . . 372 P HA . 17273 1 1173 . 1 1 107 107 PRO HB2 H 1 2.350 0.04 . 2 . . . . 372 P HB1 . 17273 1 1174 . 1 1 107 107 PRO HB3 H 1 2.040 0.04 . 2 . . . . 372 P HB2 . 17273 1 1175 . 1 1 107 107 PRO HD2 H 1 3.688 0.04 . 2 . . . . 372 P HD1 . 17273 1 1176 . 1 1 107 107 PRO HG2 H 1 2.090 0.04 . 2 . . . . 372 P HG1 . 17273 1 1177 . 1 1 107 107 PRO CA C 13 63.670 0.4 . 1 . . . . 372 P CA . 17273 1 1178 . 1 1 107 107 PRO CB C 13 31.970 0.4 . 1 . . . . 372 P CB . 17273 1 1179 . 1 1 107 107 PRO CD C 13 49.792 0.4 . 1 . . . . 372 P CD . 17273 1 1180 . 1 1 107 107 PRO CG C 13 27.298 0.4 . 1 . . . . 372 P CG . 17273 1 1181 . 1 1 108 108 GLY H H 1 8.800 0.04 . 1 . . . . 373 G HN . 17273 1 1182 . 1 1 108 108 GLY HA2 H 1 4.076 0.04 . 2 . . . . 373 G HA1 . 17273 1 1183 . 1 1 108 108 GLY HA3 H 1 3.954 0.04 . 2 . . . . 373 G HA2 . 17273 1 1184 . 1 1 108 108 GLY CA C 13 44.258 0.4 . 1 . . . . 373 G CA . 17273 1 1185 . 1 1 108 108 GLY N N 15 110.440 0.4 . 1 . . . . 373 G N . 17273 1 1186 . 1 1 109 109 GLY H H 1 8.277 0.04 . 1 . . . . 374 G HN . 17273 1 1187 . 1 1 109 109 GLY HA2 H 1 4.086 0.04 . 2 . . . . 374 G HA1 . 17273 1 1188 . 1 1 109 109 GLY HA3 H 1 3.987 0.04 . 2 . . . . 374 G HA2 . 17273 1 1189 . 1 1 109 109 GLY CA C 13 45.315 0.4 . 1 . . . . 374 G CA . 17273 1 1190 . 1 1 109 109 GLY N N 15 108.159 0.4 . 1 . . . . 374 G N . 17273 1 1191 . 1 1 110 110 THR H H 1 7.890 0.04 . 1 . . . . 375 T HN . 17273 1 1192 . 1 1 110 110 THR HA H 1 4.376 0.04 . 1 . . . . 375 T HA . 17273 1 1193 . 1 1 110 110 THR HB H 1 4.200 0.04 . 1 . . . . 375 T HB . 17273 1 1194 . 1 1 110 110 THR HG21 H 1 1.247 0.04 . 1 . . . . 375 T HG21 . 17273 1 1195 . 1 1 110 110 THR HG22 H 1 1.247 0.04 . 1 . . . . 375 T HG21 . 17273 1 1196 . 1 1 110 110 THR HG23 H 1 1.247 0.04 . 1 . . . . 375 T HG21 . 17273 1 1197 . 1 1 110 110 THR CA C 13 61.431 0.4 . 1 . . . . 375 T CA . 17273 1 1198 . 1 1 110 110 THR CB C 13 70.260 0.4 . 1 . . . . 375 T CB . 17273 1 1199 . 1 1 110 110 THR CG2 C 13 21.733 0.4 . 1 . . . . 375 T CG2 . 17273 1 1200 . 1 1 110 110 THR N N 15 113.800 0.4 . 1 . . . . 375 T N . 17273 1 1201 . 1 1 111 111 LEU H H 1 8.604 0.04 . 1 . . . . 376 L HN . 17273 1 1202 . 1 1 111 111 LEU HA H 1 4.731 0.04 . 1 . . . . 376 L HA . 17273 1 1203 . 1 1 111 111 LEU HB2 H 1 1.661 0.04 . 2 . . . . 376 L HB1 . 17273 1 1204 . 1 1 111 111 LEU HD11 H 1 0.969 0.04 . 2 . . . . 376 L HD11 . 17273 1 1205 . 1 1 111 111 LEU HD12 H 1 0.969 0.04 . 2 . . . . 376 L HD11 . 17273 1 1206 . 1 1 111 111 LEU HD13 H 1 0.969 0.04 . 2 . . . . 376 L HD11 . 17273 1 1207 . 1 1 111 111 LEU HD21 H 1 0.906 0.04 . 2 . . . . 376 L HD21 . 17273 1 1208 . 1 1 111 111 LEU HD22 H 1 0.906 0.04 . 2 . . . . 376 L HD21 . 17273 1 1209 . 1 1 111 111 LEU HD23 H 1 0.906 0.04 . 2 . . . . 376 L HD21 . 17273 1 1210 . 1 1 111 111 LEU HG H 1 2.062 0.04 . 1 . . . . 376 L HG . 17273 1 1211 . 1 1 111 111 LEU CA C 13 52.891 0.4 . 1 . . . . 376 L CA . 17273 1 1212 . 1 1 111 111 LEU CB C 13 42.159 0.4 . 1 . . . . 376 L CB . 17273 1 1213 . 1 1 111 111 LEU CD1 C 13 25.110 0.4 . 1 . . . . 376 L CD1 . 17273 1 1214 . 1 1 111 111 LEU CD2 C 13 24.000 0.4 . 1 . . . . 376 L CD2 . 17273 1 1215 . 1 1 111 111 LEU CG C 13 27.412 0.4 . 1 . . . . 376 L CG . 17273 1 1216 . 1 1 111 111 LEU N N 15 126.030 0.4 . 1 . . . . 376 L N . 17273 1 1217 . 1 1 112 112 PRO HA H 1 4.573 0.04 . 1 . . . . 377 P HA . 17273 1 1218 . 1 1 112 112 PRO HB2 H 1 2.386 0.04 . 2 . . . . 377 P HB1 . 17273 1 1219 . 1 1 112 112 PRO HB3 H 1 2.062 0.04 . 2 . . . . 377 P HB2 . 17273 1 1220 . 1 1 112 112 PRO HD2 H 1 3.975 0.04 . 2 . . . . 377 P HD1 . 17273 1 1221 . 1 1 112 112 PRO HD3 H 1 3.675 0.04 . 2 . . . . 377 P HD2 . 17273 1 1222 . 1 1 112 112 PRO HG2 H 1 2.063 0.04 . 2 . . . . 377 P HG1 . 17273 1 1223 . 1 1 112 112 PRO CA C 13 62.838 0.4 . 1 . . . . 377 P CA . 17273 1 1224 . 1 1 112 112 PRO CB C 13 32.475 0.4 . 1 . . . . 377 P CB . 17273 1 1225 . 1 1 112 112 PRO CD C 13 50.807 0.4 . 1 . . . . 377 P CD . 17273 1 1226 . 1 1 112 112 PRO CG C 13 27.435 0.4 . 1 . . . . 377 P CG . 17273 1 1227 . 1 1 113 113 GLY H H 1 8.302 0.04 . 1 . . . . 378 G HN . 17273 1 1228 . 1 1 113 113 GLY HA2 H 1 4.350 0.04 . 2 . . . . 378 G HA1 . 17273 1 1229 . 1 1 113 113 GLY HA3 H 1 3.931 0.04 . 2 . . . . 378 G HA2 . 17273 1 1230 . 1 1 113 113 GLY CA C 13 44.001 0.4 . 1 . . . . 378 G CA . 17273 1 1231 . 1 1 113 113 GLY N N 15 107.597 0.4 . 1 . . . . 378 G N . 17273 1 1232 . 1 1 114 114 PRO HA H 1 4.564 0.04 . 1 . . . . 379 P HA . 17273 1 1233 . 1 1 114 114 PRO HB2 H 1 1.955 0.04 . 2 . . . . 379 P HB1 . 17273 1 1234 . 1 1 114 114 PRO HB3 H 1 1.786 0.04 . 2 . . . . 379 P HB2 . 17273 1 1235 . 1 1 114 114 PRO HD2 H 1 3.850 0.04 . 2 . . . . 379 P HD1 . 17273 1 1236 . 1 1 114 114 PRO HD3 H 1 3.668 0.04 . 2 . . . . 379 P HD2 . 17273 1 1237 . 1 1 114 114 PRO HG2 H 1 2.072 0.04 . 2 . . . . 379 P HG1 . 17273 1 1238 . 1 1 114 114 PRO CA C 13 62.719 0.4 . 1 . . . . 379 P CA . 17273 1 1239 . 1 1 114 114 PRO CB C 13 32.350 0.4 . 1 . . . . 379 P CB . 17273 1 1240 . 1 1 114 114 PRO CD C 13 50.926 0.4 . 1 . . . . 379 P CD . 17273 1 1241 . 1 1 114 114 PRO CG C 13 27.476 0.4 . 1 . . . . 379 P CG . 17273 1 1242 . 1 1 115 115 ALA H H 1 8.947 0.04 . 1 . . . . 380 A HN . 17273 1 1243 . 1 1 115 115 ALA HA H 1 4.479 0.04 . 1 . . . . 380 A HA . 17273 1 1244 . 1 1 115 115 ALA HB1 H 1 1.250 0.04 . 1 . . . . 380 A HB1 . 17273 1 1245 . 1 1 115 115 ALA HB2 H 1 1.250 0.04 . 1 . . . . 380 A HB1 . 17273 1 1246 . 1 1 115 115 ALA HB3 H 1 1.250 0.04 . 1 . . . . 380 A HB1 . 17273 1 1247 . 1 1 115 115 ALA CA C 13 51.254 0.4 . 1 . . . . 380 A CA . 17273 1 1248 . 1 1 115 115 ALA CB C 13 20.150 0.4 . 1 . . . . 380 A CB . 17273 1 1249 . 1 1 115 115 ALA N N 15 124.531 0.4 . 1 . . . . 380 A N . 17273 1 1250 . 1 1 116 116 MET H H 1 7.969 0.04 . 1 . . . . 381 M HN . 17273 1 1251 . 1 1 116 116 MET HA H 1 5.084 0.04 . 1 . . . . 381 M HA . 17273 1 1252 . 1 1 116 116 MET HB2 H 1 1.938 0.04 . 2 . . . . 381 M HB1 . 17273 1 1253 . 1 1 116 116 MET HB3 H 1 1.451 0.04 . 2 . . . . 381 M HB2 . 17273 1 1254 . 1 1 116 116 MET HE1 H 1 2.040 0.04 . 1 . . . . 381 M HE1 . 17273 1 1255 . 1 1 116 116 MET HE2 H 1 2.040 0.04 . 1 . . . . 381 M HE1 . 17273 1 1256 . 1 1 116 116 MET HE3 H 1 2.040 0.04 . 1 . . . . 381 M HE1 . 17273 1 1257 . 1 1 116 116 MET HG2 H 1 2.708 0.04 . 2 . . . . 381 M HG1 . 17273 1 1258 . 1 1 116 116 MET HG3 H 1 2.412 0.04 . 2 . . . . 381 M HG2 . 17273 1 1259 . 1 1 116 116 MET CA C 13 53.170 0.4 . 1 . . . . 381 M CA . 17273 1 1260 . 1 1 116 116 MET CB C 13 32.500 0.4 . 1 . . . . 381 M CB . 17273 1 1261 . 1 1 116 116 MET CE C 13 18.050 0.4 . 1 . . . . 381 M CE . 17273 1 1262 . 1 1 116 116 MET CG C 13 32.730 0.4 . 1 . . . . 381 M CG . 17273 1 1263 . 1 1 116 116 MET N N 15 121.370 0.4 . 1 . . . . 381 M N . 17273 1 1264 . 1 1 117 117 LEU H H 1 9.078 0.04 . 1 . . . . 382 L HN . 17273 1 1265 . 1 1 117 117 LEU HA H 1 4.621 0.04 . 1 . . . . 382 L HA . 17273 1 1266 . 1 1 117 117 LEU HB2 H 1 1.307 0.04 . 2 . . . . 382 L HB1 . 17273 1 1267 . 1 1 117 117 LEU HB3 H 1 1.039 0.04 . 2 . . . . 382 L HB2 . 17273 1 1268 . 1 1 117 117 LEU HD11 H 1 0.104 0.04 . 2 . . . . 382 L HD11 . 17273 1 1269 . 1 1 117 117 LEU HD12 H 1 0.104 0.04 . 2 . . . . 382 L HD11 . 17273 1 1270 . 1 1 117 117 LEU HD13 H 1 0.104 0.04 . 2 . . . . 382 L HD11 . 17273 1 1271 . 1 1 117 117 LEU HD21 H 1 0.086 0.04 . 2 . . . . 382 L HD21 . 17273 1 1272 . 1 1 117 117 LEU HD22 H 1 0.086 0.04 . 2 . . . . 382 L HD21 . 17273 1 1273 . 1 1 117 117 LEU HD23 H 1 0.086 0.04 . 2 . . . . 382 L HD21 . 17273 1 1274 . 1 1 117 117 LEU HG H 1 0.957 0.04 . 1 . . . . 382 L HG . 17273 1 1275 . 1 1 117 117 LEU CA C 13 52.303 0.4 . 1 . . . . 382 L CA . 17273 1 1276 . 1 1 117 117 LEU CB C 13 45.307 0.4 . 1 . . . . 382 L CB . 17273 1 1277 . 1 1 117 117 LEU CD1 C 13 25.118 0.4 . 1 . . . . 382 L CD1 . 17273 1 1278 . 1 1 117 117 LEU CD2 C 13 22.172 0.4 . 1 . . . . 382 L CD2 . 17273 1 1279 . 1 1 117 117 LEU CG C 13 26.408 0.4 . 1 . . . . 382 L CG . 17273 1 1280 . 1 1 117 117 LEU N N 15 124.058 0.4 . 1 . . . . 382 L N . 17273 1 1281 . 1 1 118 118 ILE H H 1 8.332 0.04 . 1 . . . . 383 I HN . 17273 1 1282 . 1 1 118 118 ILE HA H 1 4.536 0.04 . 1 . . . . 383 I HA . 17273 1 1283 . 1 1 118 118 ILE HB H 1 1.696 0.04 . 1 . . . . 383 I HB . 17273 1 1284 . 1 1 118 118 ILE HD11 H 1 0.169 0.04 . 1 . . . . 383 I HD11 . 17273 1 1285 . 1 1 118 118 ILE HD12 H 1 0.169 0.04 . 1 . . . . 383 I HD11 . 17273 1 1286 . 1 1 118 118 ILE HD13 H 1 0.169 0.04 . 1 . . . . 383 I HD11 . 17273 1 1287 . 1 1 118 118 ILE HG12 H 1 1.234 0.04 . 1 . . . . 383 I HG11 . 17273 1 1288 . 1 1 118 118 ILE HG13 H 1 0.838 0.04 . 1 . . . . 383 I HG12 . 17273 1 1289 . 1 1 118 118 ILE HG21 H 1 0.718 0.04 . 1 . . . . 383 I HG21 . 17273 1 1290 . 1 1 118 118 ILE HG22 H 1 0.718 0.04 . 1 . . . . 383 I HG21 . 17273 1 1291 . 1 1 118 118 ILE HG23 H 1 0.718 0.04 . 1 . . . . 383 I HG21 . 17273 1 1292 . 1 1 118 118 ILE CA C 13 53.960 0.4 . 1 . . . . 383 I CA . 17273 1 1293 . 1 1 118 118 ILE CB C 13 36.650 0.4 . 1 . . . . 383 I CB . 17273 1 1294 . 1 1 118 118 ILE CD1 C 13 7.721 0.4 . 1 . . . . 383 I CD1 . 17273 1 1295 . 1 1 118 118 ILE CG1 C 13 25.632 0.4 . 1 . . . . 383 I CG1 . 17273 1 1296 . 1 1 118 118 ILE CG2 C 13 17.030 0.4 . 1 . . . . 383 I CG2 . 17273 1 1297 . 1 1 118 118 ILE N N 15 121.346 0.4 . 1 . . . . 383 I N . 17273 1 1298 . 1 1 119 119 PRO HA H 1 3.820 0.04 . 1 . . . . 384 P HA . 17273 1 1299 . 1 1 119 119 PRO HB2 H 1 2.460 0.04 . 2 . . . . 384 P HB1 . 17273 1 1300 . 1 1 119 119 PRO HB3 H 1 1.960 0.04 . 2 . . . . 384 P HB2 . 17273 1 1301 . 1 1 119 119 PRO HD2 H 1 4.186 0.04 . 2 . . . . 384 P HD1 . 17273 1 1302 . 1 1 119 119 PRO HG2 H 1 1.487 0.04 . 2 . . . . 384 P HG1 . 17273 1 1303 . 1 1 119 119 PRO CA C 13 67.536 0.4 . 1 . . . . 384 P CA . 17273 1 1304 . 1 1 119 119 PRO CB C 13 31.440 0.4 . 1 . . . . 384 P CB . 17273 1 1305 . 1 1 119 119 PRO CD C 13 52.914 0.4 . 1 . . . . 384 P CD . 17273 1 1306 . 1 1 119 119 PRO CG C 13 27.469 0.4 . 1 . . . . 384 P CG . 17273 1 1307 . 1 1 120 120 GLU H H 1 9.130 0.04 . 1 . . . . 385 E HN . 17273 1 1308 . 1 1 120 120 GLU HA H 1 4.000 0.04 . 1 . . . . 385 E HA . 17273 1 1309 . 1 1 120 120 GLU HB2 H 1 2.680 0.04 . 2 . . . . 385 E HB1 . 17273 1 1310 . 1 1 120 120 GLU HB3 H 1 1.670 0.04 . 2 . . . . 385 E HB2 . 17273 1 1311 . 1 1 120 120 GLU HG2 H 1 2.530 0.04 . 2 . . . . 385 E HG1 . 17273 1 1312 . 1 1 120 120 GLU HG3 H 1 2.410 0.04 . 2 . . . . 385 E HG2 . 17273 1 1313 . 1 1 120 120 GLU CA C 13 58.028 0.4 . 1 . . . . 385 E CA . 17273 1 1314 . 1 1 120 120 GLU CB C 13 32.100 0.4 . 1 . . . . 385 E CB . 17273 1 1315 . 1 1 120 120 GLU CG C 13 35.060 0.4 . 1 . . . . 385 E CG . 17273 1 1316 . 1 1 120 120 GLU N N 15 116.370 0.4 . 1 . . . . 385 E N . 17273 1 1317 . 1 1 121 121 LEU H H 1 8.031 0.04 . 1 . . . . 386 L HN . 17273 1 1318 . 1 1 121 121 LEU HA H 1 4.596 0.04 . 1 . . . . 386 L HA . 17273 1 1319 . 1 1 121 121 LEU HB2 H 1 2.044 0.04 . 2 . . . . 386 L HB1 . 17273 1 1320 . 1 1 121 121 LEU HB3 H 1 1.980 0.04 . 2 . . . . 386 L HB2 . 17273 1 1321 . 1 1 121 121 LEU HD11 H 1 0.299 0.04 . 2 . . . . 386 L HD11 . 17273 1 1322 . 1 1 121 121 LEU HD12 H 1 0.299 0.04 . 2 . . . . 386 L HD11 . 17273 1 1323 . 1 1 121 121 LEU HD13 H 1 0.299 0.04 . 2 . . . . 386 L HD11 . 17273 1 1324 . 1 1 121 121 LEU HD21 H 1 0.853 0.04 . 2 . . . . 386 L HD21 . 17273 1 1325 . 1 1 121 121 LEU HD22 H 1 0.853 0.04 . 2 . . . . 386 L HD21 . 17273 1 1326 . 1 1 121 121 LEU HD23 H 1 0.853 0.04 . 2 . . . . 386 L HD21 . 17273 1 1327 . 1 1 121 121 LEU HG H 1 1.220 0.04 . 1 . . . . 386 L HG . 17273 1 1328 . 1 1 121 121 LEU CA C 13 52.652 0.4 . 1 . . . . 386 L CA . 17273 1 1329 . 1 1 121 121 LEU CB C 13 42.420 0.4 . 1 . . . . 386 L CB . 17273 1 1330 . 1 1 121 121 LEU CD1 C 13 25.821 0.4 . 1 . . . . 386 L CD1 . 17273 1 1331 . 1 1 121 121 LEU CD2 C 13 22.089 0.4 . 1 . . . . 386 L CD2 . 17273 1 1332 . 1 1 121 121 LEU CG C 13 27.570 0.4 . 1 . . . . 386 L CG . 17273 1 1333 . 1 1 121 121 LEU N N 15 112.430 0.4 . 1 . . . . 386 L N . 17273 1 1334 . 1 1 122 122 CYS H H 1 7.367 0.04 . 1 . . . . 387 C HN . 17273 1 1335 . 1 1 122 122 CYS HA H 1 5.036 0.04 . 1 . . . . 387 C HA . 17273 1 1336 . 1 1 122 122 CYS HB2 H 1 2.791 0.04 . 2 . . . . 387 C HB1 . 17273 1 1337 . 1 1 122 122 CYS HB3 H 1 2.228 0.04 . 2 . . . . 387 C HB2 . 17273 1 1338 . 1 1 122 122 CYS CA C 13 57.900 0.4 . 1 . . . . 387 C CA . 17273 1 1339 . 1 1 122 122 CYS CB C 13 30.617 0.4 . 1 . . . . 387 C CB . 17273 1 1340 . 1 1 122 122 CYS N N 15 115.167 0.4 . 1 . . . . 387 C N . 17273 1 1341 . 1 1 123 123 TYR H H 1 9.706 0.04 . 1 . . . . 388 Y HN . 17273 1 1342 . 1 1 123 123 TYR HA H 1 4.795 0.04 . 1 . . . . 388 Y HA . 17273 1 1343 . 1 1 123 123 TYR HB2 H 1 3.102 0.04 . 2 . . . . 388 Y HB1 . 17273 1 1344 . 1 1 123 123 TYR HB3 H 1 2.861 0.04 . 2 . . . . 388 Y HB2 . 17273 1 1345 . 1 1 123 123 TYR HD1 H 1 7.140 0.04 . 3 . . . . 388 Y HD1 . 17273 1 1346 . 1 1 123 123 TYR HE1 H 1 6.831 0.04 . 3 . . . . 388 Y HE1 . 17273 1 1347 . 1 1 123 123 TYR CA C 13 57.630 0.4 . 1 . . . . 388 Y CA . 17273 1 1348 . 1 1 123 123 TYR CB C 13 40.022 0.4 . 1 . . . . 388 Y CB . 17273 1 1349 . 1 1 123 123 TYR CD1 C 13 133.054 0.4 . 3 . . . . 388 Y CD1 . 17273 1 1350 . 1 1 123 123 TYR CE1 C 13 118.310 0.4 . 3 . . . . 388 Y CE1 . 17273 1 1351 . 1 1 123 123 TYR N N 15 121.440 0.4 . 1 . . . . 388 Y N . 17273 1 1352 . 1 1 124 124 LEU H H 1 8.610 0.04 . 1 . . . . 389 L HN . 17273 1 1353 . 1 1 124 124 LEU HA H 1 4.427 0.04 . 1 . . . . 389 L HA . 17273 1 1354 . 1 1 124 124 LEU HB2 H 1 1.725 0.04 . 2 . . . . 389 L HB1 . 17273 1 1355 . 1 1 124 124 LEU HB3 H 1 1.607 0.04 . 2 . . . . 389 L HB2 . 17273 1 1356 . 1 1 124 124 LEU HD11 H 1 0.685 0.04 . 2 . . . . 389 L HD11 . 17273 1 1357 . 1 1 124 124 LEU HD12 H 1 0.685 0.04 . 2 . . . . 389 L HD11 . 17273 1 1358 . 1 1 124 124 LEU HD13 H 1 0.685 0.04 . 2 . . . . 389 L HD11 . 17273 1 1359 . 1 1 124 124 LEU HD21 H 1 0.654 0.04 . 2 . . . . 389 L HD21 . 17273 1 1360 . 1 1 124 124 LEU HD22 H 1 0.654 0.04 . 2 . . . . 389 L HD21 . 17273 1 1361 . 1 1 124 124 LEU HD23 H 1 0.654 0.04 . 2 . . . . 389 L HD21 . 17273 1 1362 . 1 1 124 124 LEU HG H 1 1.498 0.04 . 1 . . . . 389 L HG . 17273 1 1363 . 1 1 124 124 LEU CA C 13 56.054 0.4 . 1 . . . . 389 L CA . 17273 1 1364 . 1 1 124 124 LEU CB C 13 41.890 0.4 . 1 . . . . 389 L CB . 17273 1 1365 . 1 1 124 124 LEU CD1 C 13 25.556 0.4 . 1 . . . . 389 L CD1 . 17273 1 1366 . 1 1 124 124 LEU CD2 C 13 24.180 0.4 . 1 . . . . 389 L CD2 . 17273 1 1367 . 1 1 124 124 LEU CG C 13 27.720 0.4 . 1 . . . . 389 L CG . 17273 1 1368 . 1 1 124 124 LEU N N 15 121.660 0.4 . 1 . . . . 389 L N . 17273 1 1369 . 1 1 125 125 THR H H 1 8.396 0.04 . 1 . . . . 390 T HN . 17273 1 1370 . 1 1 125 125 THR HA H 1 4.616 0.04 . 1 . . . . 390 T HA . 17273 1 1371 . 1 1 125 125 THR HB H 1 4.261 0.04 . 1 . . . . 390 T HB . 17273 1 1372 . 1 1 125 125 THR HG21 H 1 1.226 0.04 . 1 . . . . 390 T HG21 . 17273 1 1373 . 1 1 125 125 THR HG22 H 1 1.226 0.04 . 1 . . . . 390 T HG21 . 17273 1 1374 . 1 1 125 125 THR HG23 H 1 1.226 0.04 . 1 . . . . 390 T HG21 . 17273 1 1375 . 1 1 125 125 THR CA C 13 61.575 0.4 . 1 . . . . 390 T CA . 17273 1 1376 . 1 1 125 125 THR CB C 13 71.270 0.4 . 1 . . . . 390 T CB . 17273 1 1377 . 1 1 125 125 THR CG2 C 13 21.603 0.4 . 1 . . . . 390 T CG2 . 17273 1 1378 . 1 1 125 125 THR N N 15 111.240 0.4 . 1 . . . . 390 T N . 17273 1 1379 . 1 1 126 126 GLY H H 1 8.483 0.04 . 1 . . . . 391 G HN . 17273 1 1380 . 1 1 126 126 GLY HA2 H 1 4.152 0.04 . 2 . . . . 391 G HA1 . 17273 1 1381 . 1 1 126 126 GLY HA3 H 1 3.995 0.04 . 2 . . . . 391 G HA2 . 17273 1 1382 . 1 1 126 126 GLY CA C 13 45.193 0.4 . 1 . . . . 391 G CA . 17273 1 1383 . 1 1 126 126 GLY N N 15 110.100 0.4 . 1 . . . . 391 G N . 17273 1 1384 . 1 1 127 127 LEU H H 1 8.224 0.04 . 1 . . . . 392 L HN . 17273 1 1385 . 1 1 127 127 LEU HA H 1 4.600 0.04 . 1 . . . . 392 L HA . 17273 1 1386 . 1 1 127 127 LEU HB2 H 1 1.733 0.04 . 2 . . . . 392 L HB1 . 17273 1 1387 . 1 1 127 127 LEU HB3 H 1 1.578 0.04 . 2 . . . . 392 L HB2 . 17273 1 1388 . 1 1 127 127 LEU HD11 H 1 0.940 0.04 . 2 . . . . 392 L HD11 . 17273 1 1389 . 1 1 127 127 LEU HD12 H 1 0.940 0.04 . 2 . . . . 392 L HD11 . 17273 1 1390 . 1 1 127 127 LEU HD13 H 1 0.940 0.04 . 2 . . . . 392 L HD11 . 17273 1 1391 . 1 1 127 127 LEU HD21 H 1 0.907 0.04 . 2 . . . . 392 L HD21 . 17273 1 1392 . 1 1 127 127 LEU HD22 H 1 0.907 0.04 . 2 . . . . 392 L HD21 . 17273 1 1393 . 1 1 127 127 LEU HD23 H 1 0.907 0.04 . 2 . . . . 392 L HD21 . 17273 1 1394 . 1 1 127 127 LEU HG H 1 1.594 0.04 . 1 . . . . 392 L HG . 17273 1 1395 . 1 1 127 127 LEU CA C 13 54.773 0.4 . 1 . . . . 392 L CA . 17273 1 1396 . 1 1 127 127 LEU CB C 13 42.650 0.4 . 1 . . . . 392 L CB . 17273 1 1397 . 1 1 127 127 LEU CD1 C 13 25.081 0.4 . 1 . . . . 392 L CD1 . 17273 1 1398 . 1 1 127 127 LEU CD2 C 13 23.250 0.4 . 1 . . . . 392 L CD2 . 17273 1 1399 . 1 1 127 127 LEU CG C 13 27.114 0.4 . 1 . . . . 392 L CG . 17273 1 1400 . 1 1 127 127 LEU N N 15 121.429 0.4 . 1 . . . . 392 L N . 17273 1 1401 . 1 1 128 128 THR H H 1 8.196 0.04 . 1 . . . . 393 T HN . 17273 1 1402 . 1 1 128 128 THR HA H 1 4.615 0.04 . 1 . . . . 393 T HA . 17273 1 1403 . 1 1 128 128 THR HB H 1 4.236 0.04 . 1 . . . . 393 T HB . 17273 1 1404 . 1 1 128 128 THR HG21 H 1 1.223 0.04 . 1 . . . . 393 T HG21 . 17273 1 1405 . 1 1 128 128 THR HG22 H 1 1.223 0.04 . 1 . . . . 393 T HG21 . 17273 1 1406 . 1 1 128 128 THR HG23 H 1 1.223 0.04 . 1 . . . . 393 T HG21 . 17273 1 1407 . 1 1 128 128 THR CA C 13 60.799 0.4 . 1 . . . . 393 T CA . 17273 1 1408 . 1 1 128 128 THR CB C 13 70.730 0.4 . 1 . . . . 393 T CB . 17273 1 1409 . 1 1 128 128 THR CG2 C 13 21.670 0.4 . 1 . . . . 393 T CG2 . 17273 1 1410 . 1 1 128 128 THR N N 15 113.190 0.4 . 1 . . . . 393 T N . 17273 1 1411 . 1 1 129 129 ASP H H 1 8.651 0.04 . 1 . . . . 394 D HN . 17273 1 1412 . 1 1 129 129 ASP HA H 1 4.711 0.04 . 1 . . . . 394 D HA . 17273 1 1413 . 1 1 129 129 ASP HB2 H 1 2.640 0.04 . 2 . . . . 394 D HB1 . 17273 1 1414 . 1 1 129 129 ASP HB3 H 1 2.578 0.04 . 2 . . . . 394 D HB2 . 17273 1 1415 . 1 1 129 129 ASP CA C 13 54.122 0.4 . 1 . . . . 394 D CA . 17273 1 1416 . 1 1 129 129 ASP CB C 13 41.282 0.4 . 1 . . . . 394 D CB . 17273 1 1417 . 1 1 129 129 ASP N N 15 122.716 0.4 . 1 . . . . 394 D N . 17273 1 1418 . 1 1 130 130 LYS H H 1 8.331 0.04 . 1 . . . . 395 K HN . 17273 1 1419 . 1 1 130 130 LYS HA H 1 4.332 0.04 . 1 . . . . 395 K HA . 17273 1 1420 . 1 1 130 130 LYS HB2 H 1 1.897 0.04 . 2 . . . . 395 K HB1 . 17273 1 1421 . 1 1 130 130 LYS HB3 H 1 1.805 0.04 . 2 . . . . 395 K HB2 . 17273 1 1422 . 1 1 130 130 LYS HD2 H 1 1.723 0.04 . 2 . . . . 395 K HD1 . 17273 1 1423 . 1 1 130 130 LYS HE2 H 1 3.022 0.04 . 2 . . . . 395 K HE1 . 17273 1 1424 . 1 1 130 130 LYS HG2 H 1 1.481 0.04 . 2 . . . . 395 K HG1 . 17273 1 1425 . 1 1 130 130 LYS CA C 13 56.209 0.4 . 1 . . . . 395 K CA . 17273 1 1426 . 1 1 130 130 LYS CB C 13 32.901 0.4 . 1 . . . . 395 K CB . 17273 1 1427 . 1 1 130 130 LYS CD C 13 28.881 0.4 . 1 . . . . 395 K CD . 17273 1 1428 . 1 1 130 130 LYS CE C 13 41.883 0.4 . 1 . . . . 395 K CE . 17273 1 1429 . 1 1 130 130 LYS CG C 13 24.928 0.4 . 1 . . . . 395 K CG . 17273 1 1430 . 1 1 130 130 LYS N N 15 121.377 0.4 . 1 . . . . 395 K N . 17273 1 1431 . 1 1 131 131 MET H H 1 8.392 0.04 . 1 . . . . 396 M HN . 17273 1 1432 . 1 1 131 131 MET HA H 1 4.452 0.04 . 1 . . . . 396 M HA . 17273 1 1433 . 1 1 131 131 MET HB2 H 1 2.649 0.04 . 2 . . . . 396 M HB1 . 17273 1 1434 . 1 1 131 131 MET HB3 H 1 2.568 0.04 . 2 . . . . 396 M HB2 . 17273 1 1435 . 1 1 131 131 MET HE1 H 1 2.129 0.04 . 1 . . . . 396 M HE1 . 17273 1 1436 . 1 1 131 131 MET HE2 H 1 2.129 0.04 . 1 . . . . 396 M HE1 . 17273 1 1437 . 1 1 131 131 MET HE3 H 1 2.129 0.04 . 1 . . . . 396 M HE1 . 17273 1 1438 . 1 1 131 131 MET HG2 H 1 2.140 0.04 . 2 . . . . 396 M HG1 . 17273 1 1439 . 1 1 131 131 MET HG3 H 1 2.075 0.04 . 2 . . . . 396 M HG2 . 17273 1 1440 . 1 1 131 131 MET CA C 13 55.704 0.4 . 1 . . . . 396 M CA . 17273 1 1441 . 1 1 131 131 MET CB C 13 32.177 0.4 . 1 . . . . 396 M CB . 17273 1 1442 . 1 1 131 131 MET CE C 13 16.975 0.4 . 1 . . . . 396 M CE . 17273 1 1443 . 1 1 131 131 MET CG C 13 32.649 0.4 . 1 . . . . 396 M CG . 17273 1 1444 . 1 1 131 131 MET N N 15 120.490 0.4 . 1 . . . . 396 M N . 17273 1 1445 . 1 1 132 132 ARG H H 1 8.260 0.04 . 1 . . . . 397 R HN . 17273 1 1446 . 1 1 132 132 ARG HA H 1 4.382 0.04 . 1 . . . . 397 R HA . 17273 1 1447 . 1 1 132 132 ARG HB2 H 1 1.885 0.04 . 2 . . . . 397 R HB1 . 17273 1 1448 . 1 1 132 132 ARG HB3 H 1 1.814 0.04 . 2 . . . . 397 R HB2 . 17273 1 1449 . 1 1 132 132 ARG HD2 H 1 3.245 0.04 . 2 . . . . 397 R HD1 . 17273 1 1450 . 1 1 132 132 ARG HG2 H 1 1.672 0.04 . 2 . . . . 397 R HG1 . 17273 1 1451 . 1 1 132 132 ARG CA C 13 55.900 0.4 . 1 . . . . 397 R CA . 17273 1 1452 . 1 1 132 132 ARG CB C 13 30.960 0.4 . 1 . . . . 397 R CB . 17273 1 1453 . 1 1 132 132 ARG CD C 13 43.263 0.4 . 1 . . . . 397 R CD . 17273 1 1454 . 1 1 132 132 ARG CG C 13 27.243 0.4 . 1 . . . . 397 R CG . 17273 1 1455 . 1 1 132 132 ARG N N 15 121.521 0.4 . 1 . . . . 397 R N . 17273 1 1456 . 1 1 133 133 ASN H H 1 8.596 0.04 . 1 . . . . 398 N HN . 17273 1 1457 . 1 1 133 133 ASN HA H 1 4.841 0.04 . 1 . . . . 398 N HA . 17273 1 1458 . 1 1 133 133 ASN HB2 H 1 2.884 0.04 . 2 . . . . 398 N HB1 . 17273 1 1459 . 1 1 133 133 ASN HB3 H 1 2.736 0.04 . 2 . . . . 398 N HB2 . 17273 1 1460 . 1 1 133 133 ASN HD21 H 1 7.649 0.04 . 2 . . . . 398 N HD21 . 17273 1 1461 . 1 1 133 133 ASN HD22 H 1 6.900 0.04 . 2 . . . . 398 N HD22 . 17273 1 1462 . 1 1 133 133 ASN CA C 13 52.700 0.4 . 1 . . . . 398 N CA . 17273 1 1463 . 1 1 133 133 ASN CB C 13 39.330 0.4 . 1 . . . . 398 N CB . 17273 1 1464 . 1 1 133 133 ASN N N 15 120.640 0.4 . 1 . . . . 398 N N . 17273 1 1465 . 1 1 133 133 ASN ND2 N 15 112.990 0.4 . 1 . . . . 398 N ND2 . 17273 1 1466 . 1 1 134 134 ASP H H 1 8.035 0.04 . 1 . . . . 399 D HN . 17273 1 1467 . 1 1 134 134 ASP HA H 1 4.420 0.04 . 1 . . . . 399 D HA . 17273 1 1468 . 1 1 134 134 ASP HB2 H 1 2.684 0.04 . 2 . . . . 399 D HB1 . 17273 1 1469 . 1 1 134 134 ASP HB3 H 1 2.654 0.04 . 2 . . . . 399 D HB2 . 17273 1 1470 . 1 1 134 134 ASP CA C 13 55.690 0.4 . 1 . . . . 399 D CA . 17273 1 1471 . 1 1 134 134 ASP CB C 13 41.870 0.4 . 1 . . . . 399 D CB . 17273 1 1472 . 1 1 134 134 ASP N N 15 126.100 0.4 . 1 . . . . 399 D N . 17273 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_peak_list_1 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_1 _Spectral_peak_list.Entry_ID 17273 _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID . _Spectral_peak_list.Sample_label . _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID . _Spectral_peak_list.Experiment_name . _Spectral_peak_list.Number_of_spectral_dimensions . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; label dataset sw sf HN H N nnoe.nv {4008.79 } {9090.91 } {1851.85 } {800.3538 } {800.3538 } { 81.1084 } HN.L HN.P HN.W HN.B HN.E HN.J HN.U H.L H.P H.W H.B H.E H.J H.U N.L N.P N.W N.B N.E N.J N.U vol int stat comment flag0 0 {320.HN} 9.149 0.044 0.044 ? 0.000 {?} {320.HB1} 2.772 0.122 0.122 ? 0.000 {?} {320.N} 129.440 0.018 0.018 ? 0.000 {?} 68.29700 2.53510 0 {?} 0 1 {320.HN} 9.144 0.060 0.060 ++ 0.000 {?} {320.HB2} 2.470 0.168 0.168 ++ 0.000 {?} {320.N} 129.439 0.306 0.306 ++ 0.000 {?} 456.87469 3.49110 0 {?} 0 2 {320.HN} 9.142 0.049 0.059 ++ 0.000 {?} {319.HA} 3.604 0.095 0.115 ++ 0.000 {?} {320.N} 129.407 0.397 0.471 ++ 0.000 {?} 668.39978 6.32390 0 {?} 0 3 {320.HN} 9.139 0.073 0.073 ++ 0.000 {?} {319.HG21} 0.732 0.130 0.130 ++ 0.000 {?} {320.N} 129.396 0.273 0.273 ++ 0.000 {?} 446.54550 3.49880 0 {?} 0 4 {365.HN} 10.255 0.042 0.051 ++ 0.000 {?} {364.HA} 5.185 0.088 0.112 ++ 0.000 {?} {365.N} 128.486 0.457 0.551 ++ 0.000 {?} 654.73169 6.80990 0 {?} 0 5 {365.HN} 10.254 0.059 0.059 ++ 0.000 {?} {365.HA} 4.694 0.087 0.087 ++ 0.000 {?} {365.N} 128.479 0.189 0.189 ++ 0.000 {?} 171.37750 2.85960 0 {?} 0 6 {365.HN} 10.256 0.062 0.062 ++ 0.000 {?} {320.HB2} 2.465 0.099 0.099 ++ 0.000 {?} {365.N} 128.496 0.330 0.330 ++ 0.000 {?} 382.85330 3.35390 0 {?} 0 7 {365.HN} 10.254 0.043 0.043 ++ 0.000 {?} {365.HB1} 2.136 0.105 0.105 ++ 0.000 {?} {365.N} 128.474 0.240 0.240 ++ 0.000 {?} 209.38429 3.19720 0 {?} 0 8 {365.HN} 10.255 0.047 0.047 ++ 0.000 {?} {365.HB2} 1.933 0.202 0.131 ++ 0.000 {?} {365.N} 128.515 0.269 0.269 ++ 0.000 {?} 263.10400 3.58880 0 {?} 0 9 {324.HE1} 9.557 0.048 0.048 ++ 0.000 {?} {322.HB} 1.397 0.135 0.135 ++ 0.000 {?} {324.NE1} 127.981 0.064 0.064 ? 0.000 {?} 77.33120 2.69510 0 {?} 0 10 {324.HE1} 9.555 0.057 0.057 ++ 0.000 {?} {322.HD11} 0.727 0.152 0.152 ++ 0.000 {?} {324.NE1} 127.955 0.124 0.124 ++ 0.000 {?} 103.23150 2.72930 0 {?} 0 11 {319.HN} 8.971 0.038 0.058 ++ 0.000 {?} {318.HA} 4.846 0.102 0.160 ++ 0.000 {?} {319.N} 127.077 0.414 0.606 ++ 0.000 {?} 1015.09027 10.16810 0 {?} 0 12 {319.HN} 8.972 0.040 0.047 ++ 0.000 {?} {319.HB} 2.467 0.084 0.103 ++ 0.000 {?} {319.N} 127.069 0.414 0.470 ++ 0.000 {?} 505.22510 6.05550 0 {?} 0 13 {319.HN} 8.972 0.040 0.040 ? 0.000 {?} {318.HB1} 1.850 0.106 0.106 ++ 0.000 {?} {319.N} 127.069 0.038 0.038 ? 0.000 {?} 69.53860 2.56320 0 {?} 0 14 {319.HN} 8.972 0.053 0.087 ++ 0.000 {?} {319.HG11} 0.795 0.068 0.139 ? 0.000 {?} {319.N} 127.065 0.443 0.685 ++ 0.000 {?} 1071.32373 12.11390 0 {?} 0 15 {319.HN} 8.970 0.052 0.052 ++ 0.000 {?} {319.HA} 3.603 0.154 0.154 ++ 0.000 {?} {319.N} 127.079 0.238 0.238 ++ 0.000 {?} 288.46561 3.17750 0 {?} 0 16 {319.HN} 8.970 0.056 0.056 ++ 0.000 {?} {318.HG1} 1.336 0.192 0.164 ++ 0.000 {?} {319.N} 127.078 0.408 0.361 ++ 0.000 {?} 406.96420 4.36710 0 {?} 0 17 {?} 8.631 0.041 0.041 ++ 0.000 {?} {?} 4.855 0.105 0.105 ++ 0.000 {?} {?} 126.755 0.149 0.149 ++ 0.000 {?} 78.57650 2.91390 0 {?} 0 18 {?} 8.629 0.055 0.055 ++ 0.000 {?} {?} 4.337 0.215 0.135 ++ 0.000 {?} {?} 126.770 0.242 0.242 ++ 0.000 {?} 212.12630 3.34240 0 {?} 0 19 {274.HN} 8.413 0.039 0.060 ++ 0.000 {?} {274.HA} 4.404 0.103 0.173 ++ 0.000 {?} {274.N} 126.825 0.348 0.534 ++ 0.000 {?} 896.66400 12.11900 0 {?} 0 20 {274.HN} 8.413 0.034 0.065 ++ 0.000 {?} {273.HA} 4.083 0.055 0.169 ? 0.000 {?} {274.N} 126.822 0.357 0.754 ++ 0.000 {?} 2233.32812 46.59050 0 {?} 0 21 {274.HN} 8.413 0.047 0.058 ++ 0.000 {?} {273.HB} 2.049 0.116 0.152 ++ 0.000 {?} {274.N} 126.818 0.359 0.459 ++ 0.000 {?} 678.78693 7.15960 0 {?} 0 22 {274.HN} 8.413 0.036 0.068 ++ 0.000 {?} {274.HB2} 1.636 0.115 0.244 ? 0.000 {?} {274.N} 126.818 0.365 0.732 ++ 0.000 {?} 3253.45630 36.97270 0 {?} 0 23 {274.HN} 8.413 0.036 0.059 ++ 0.000 {?} {274.HD21} 0.920 0.095 0.170 ++ 0.000 {?} {274.N} 126.816 0.365 0.632 ++ 0.000 {?} 1235.67383 17.21450 0 {?} 0 24 {354.HN} 7.912 0.042 0.053 ++ 0.000 {?} {353.HN} 8.650 0.081 0.103 ++ 0.000 {?} {354.N} 126.709 0.432 0.534 ++ 0.000 {?} 125.16020 1.39390 0 {?} 0 25 {354.HN} 7.912 0.041 0.074 ++ 0.000 {?} {353.HA} 4.398 0.077 0.154 ++ 0.000 {?} {354.N} 126.717 0.417 0.701 ++ 0.000 {?} 1345.81458 16.34410 0 {?} 0 26 {354.HN} 7.912 0.054 0.054 ++ 0.000 {?} {354.HA} 3.767 0.175 0.140 ++ 0.000 {?} {354.N} 126.708 0.353 0.353 ++ 0.000 {?} 377.85641 4.01020 0 {?} 0 27 {354.HN} 7.911 0.053 0.053 ++ 0.000 {?} {353.HG1} 2.103 0.134 0.134 ++ 0.000 {?} {354.N} 126.694 0.350 0.350 ++ 0.000 {?} 437.74051 4.06160 0 {?} 0 28 {354.HN} 7.912 0.050 0.050 ++ 0.000 {?} {353.HB1} 1.926 0.111 0.111 ? 0.000 {?} {354.N} 126.719 0.327 0.327 ++ 0.000 {?} 387.51361 3.87150 0 {?} 0 29 {354.HN} 7.911 0.054 0.051 ++ 0.000 {?} {353.HB2} 1.811 0.075 0.105 ? 0.000 {?} {354.N} 126.710 0.443 0.407 ++ 0.000 {?} 265.45749 4.53920 0 {?} 0 30 {354.HN} 7.912 0.049 0.075 ++ 0.000 {?} {354.HB} 1.661 0.090 0.165 ? 0.000 {?} {354.N} 126.714 0.403 0.621 ++ 0.000 {?} 1230.51636 12.31000 0 {?} 0 31 {354.HN} 7.911 0.037 0.039 ++ 0.000 {?} {343.HD11} 1.018 0.112 0.155 ? 0.000 {?} {354.N} 126.704 0.405 0.415 ++ 0.000 {?} 511.54501 5.17440 0 {?} 0 32 {354.HN} 7.912 0.040 0.039 ++ 0.000 {?} {354.HD11} 0.882 0.067 0.155 ? 0.000 {?} {354.N} 126.721 0.433 0.422 ++ 0.000 {?} 211.79890 4.83610 0 {?} 0 33 {354.HN} 7.913 0.041 0.044 ++ 0.000 {?} {354.HG21} 0.804 0.111 0.111 ? 0.000 {?} {354.N} 126.710 0.430 0.460 ++ 0.000 {?} 654.05212 5.50750 0 {?} 0 34 {354.HN} 7.910 0.045 0.045 ++ 0.000 {?} {354.HG12} 0.589 0.146 0.146 ++ 0.000 {?} {354.N} 126.725 0.136 0.136 ++ 0.000 {?} 98.71000 2.84150 0 {?} 0 35 {323.HN} 9.063 0.043 0.043 ? 0.000 {?} {362.HA} 4.438 0.120 0.120 ? 0.000 {?} {323.N} 126.350 0.040 0.040 ? 0.000 {?} 65.52770 2.55070 0 {?} 0 36 {323.HN} 9.064 0.043 0.062 ++ 0.000 {?} {322.HA} 4.102 0.086 0.129 ++ 0.000 {?} {323.N} 126.355 0.431 0.609 ++ 0.000 {?} 893.69409 9.20330 0 {?} 0 37 {323.HN} 9.064 0.065 0.061 ++ 0.000 {?} {363.HG11} 0.749 0.136 0.125 ++ 0.000 {?} {323.N} 126.355 0.415 0.393 ++ 0.000 {?} 329.55688 4.66870 0 {?} 0 38 {323.HN} 9.064 0.058 0.058 ? 0.000 {?} {322.HG12} 0.596 0.094 0.094 ? 0.000 {?} {323.N} 126.358 0.006 0.006 ? 0.000 {?} 77.52940 2.51120 0 {?} 0 39 {323.HN} 9.065 0.040 0.041 ++ 0.000 {?} {322.HG21} -0.539 0.100 0.102 ++ 0.000 {?} {323.N} 126.353 0.430 0.443 ++ 0.000 {?} 487.10651 5.20280 0 {?} 0 40 {323.HN} 9.059 0.053 0.053 ++ 0.000 {?} {323.HA} 4.888 0.094 0.094 ++ 0.000 {?} {323.N} 126.363 0.148 0.148 ++ 0.000 {?} 117.64110 2.86700 0 {?} 0 41 {323.HN} 9.061 0.064 0.064 ++ 0.000 {?} {323.HB1} 2.856 0.131 0.131 ++ 0.000 {?} {323.N} 126.337 0.478 0.417 ++ 0.000 {?} 478.17111 4.25380 0 {?} 0 42 {323.HN} 9.062 0.057 0.057 ++ 0.000 {?} {323.HB2} 2.095 0.137 0.137 ++ 0.000 {?} {323.N} 126.355 0.328 0.328 ++ 0.000 {?} 475.38150 4.01460 0 {?} 0 43 {376.HN} 8.603 0.037 0.048 ++ 0.000 {?} {376.HA} 4.706 0.111 0.111 ? 0.000 {?} {376.N} 126.048 0.368 0.465 ++ 0.000 {?} 619.40448 7.29020 0 {?} 0 44 {376.HN} 8.604 0.034 0.070 ++ 0.000 {?} {375.HA} 4.351 0.055 0.191 ? 0.000 {?} {376.N} 126.040 0.366 0.691 ++ 0.000 {?} 1357.22095 27.76610 0 {?} 0 45 {376.HN} 8.604 0.034 0.049 ++ 0.000 {?} {375.HB} 4.181 0.091 0.132 ? 0.000 {?} {376.N} 126.038 0.345 0.481 ++ 0.000 {?} 613.20312 9.08110 0 {?} 0 46 {376.HN} 8.604 0.034 0.067 ++ 0.000 {?} {376.HB1} 1.643 0.096 0.200 ? 0.000 {?} {376.N} 126.039 0.357 0.645 ++ 0.000 {?} 1616.87366 21.38540 0 {?} 0 47 {376.HN} 8.603 0.045 0.046 ++ 0.000 {?} {375.HG21} 1.232 0.113 0.116 ++ 0.000 {?} {376.N} 126.048 0.386 0.398 ++ 0.000 {?} 456.31311 5.20380 0 {?} 0 48 {376.HN} 8.602 0.052 0.045 ++ 0.000 {?} {376.HD21} 0.934 0.176 0.148 ++ 0.000 {?} {376.N} 126.042 0.349 0.298 ++ 0.000 {?} 206.17520 4.23530 0 {?} 0 49 {399.HN} 8.035 0.032 0.054 ++ 0.000 {?} {398.HA} 4.828 0.095 0.174 ++ 0.000 {?} {399.N} 126.100 0.358 0.641 ++ 0.000 {?} 1427.54504 21.44250 0 {?} 0 50 {399.HN} 8.035 0.033 0.043 ++ 0.000 {?} {399.HA} 4.393 0.089 0.136 ++ 0.000 {?} {399.N} 126.099 0.340 0.456 ++ 0.000 {?} 541.40582 8.54430 0 {?} 0 51 {399.HN} 8.036 0.045 0.045 ++ 0.000 {?} {398.HB1} 2.856 0.113 0.113 ++ 0.000 {?} {399.N} 126.102 0.337 0.215 ++ 0.000 {?} 143.94180 3.35560 0 {?} 0 52 {399.HN} 8.035 0.032 0.051 ++ 0.000 {?} {399.HB1} 2.637 0.094 0.165 ? 0.000 {?} {399.N} 126.101 0.366 0.617 ++ 0.000 {?} 1076.98364 15.30030 0 {?} 0 53 {399.HN} 8.035 0.035 0.035 ++ 0.000 {?} {397.HB1} 1.893 0.107 0.107 ++ 0.000 {?} {399.N} 126.110 0.172 0.172 ++ 0.000 {?} 136.26041 3.14900 0 {?} 0 54 {399.HN} 8.035 0.038 0.038 ? 0.000 {?} {397.HB2} 1.801 0.095 0.095 ++ 0.000 {?} {399.N} 126.094 0.018 0.018 ? 0.000 {?} 56.85770 2.54380 0 {?} 0 55 {356.HN} 8.337 0.040 0.051 ++ 0.000 {?} {356.HB2} 2.368 0.101 0.129 ++ 0.000 {?} {356.N} 124.978 0.395 0.485 ++ 0.000 {?} 678.08752 7.11780 0 {?} 0 56 {356.HN} 8.337 0.081 0.060 ++ 0.000 {?} {354.HD11} 0.930 0.151 0.151 ? 0.000 {?} {356.N} 124.973 0.268 0.268 ++ 0.000 {?} 370.51080 3.69530 0 {?} 0 57 {356.HN} 8.334 0.035 0.054 ++ 0.000 {?} {355.HA} 4.470 0.077 0.119 ++ 0.000 {?} {356.N} 124.983 0.412 0.604 ++ 0.000 {?} 159.87170 2.13600 0 {?} 0 58 {356.HN} 8.334 0.059 0.059 ++ 0.000 {?} {354.HA} 3.764 0.112 0.112 ++ 0.000 {?} {356.N} 124.961 0.152 0.152 ++ 0.000 {?} 124.32710 3.00860 0 {?} 0 59 {356.HN} 8.335 0.045 0.050 ++ 0.000 {?} {356.HB1} 3.029 0.109 0.120 ++ 0.000 {?} {356.N} 124.983 0.403 0.440 ++ 0.000 {?} 627.96667 5.66620 0 {?} 0 60 {356.HN} 8.336 0.041 0.049 ++ 0.000 {?} {354.HG21} 0.796 0.095 0.119 ? 0.000 {?} {356.N} 124.986 0.427 0.505 ++ 0.000 {?} 682.81238 6.56840 0 {?} 0 61 {357.HN} 8.892 0.044 0.041 ++ 0.000 {?} {357.HD21} 0.789 0.089 0.089 ++ 0.000 {?} {357.N} 124.742 0.429 0.405 ++ 0.000 {?} 252.29460 4.64010 0 {?} 0 62 {357.HN} 8.891 0.062 0.062 ++ 0.000 {?} {357.HA} 4.282 0.196 0.136 ++ 0.000 {?} {357.N} 124.716 0.314 0.314 ++ 0.000 {?} 403.98901 3.78680 0 {?} 0 63 {357.HN} 8.891 0.038 0.065 ++ 0.000 {?} {357.HB1} 1.773 0.131 0.244 ? 0.000 {?} {357.N} 124.724 0.434 0.704 ++ 0.000 {?} 1983.34656 15.80030 0 {?} 0 64 {357.HN} 8.891 0.040 0.038 ++ 0.000 {?} {357.HD11} 0.987 0.088 0.088 ++ 0.000 {?} {357.N} 124.729 0.452 0.434 ++ 0.000 {?} 265.90790 4.73870 0 {?} 0 65 {357.HN} 8.885 0.048 0.048 ? 0.000 {?} {356.HB2} 2.360 0.116 0.116 ++ 0.000 {?} {357.N} 124.726 0.031 0.031 ? 0.000 {?} 74.46040 2.55570 0 {?} 0 66 {380.HN} 8.950 0.069 0.069 ++ 0.000 {?} {365.HA} 4.695 0.153 0.153 ++ 0.000 {?} {380.N} 124.520 0.119 0.119 ++ 0.000 {?} 114.58090 2.84280 0 {?} 0 67 {380.HN} 8.948 0.043 0.078 ++ 0.000 {?} {379.HA} 4.535 0.058 0.148 ? 0.000 {?} {380.N} 124.528 0.387 0.645 ++ 0.000 {?} 1045.14636 15.95910 0 {?} 0 68 {380.HN} 8.947 0.060 0.060 ? 0.000 {?} {379.HB2} 1.759 0.123 0.118 ++ 0.000 {?} {380.N} 124.553 0.468 0.455 ++ 0.000 {?} 519.24268 4.79310 0 {?} 0 69 {380.HN} 8.947 0.037 0.059 ++ 0.000 {?} {380.HB1} 1.242 0.077 0.120 ++ 0.000 {?} {380.N} 124.521 0.380 0.589 ++ 0.000 {?} 771.98340 10.71160 0 {?} 0 70 {380.HN} 8.947 0.041 0.040 ++ 0.000 {?} {379.HG1} 2.082 0.150 0.148 ++ 0.000 {?} {380.N} 124.537 0.417 0.413 ++ 0.000 {?} 330.81931 4.91490 0 {?} 0 71 {380.HN} 8.946 0.037 0.037 ? 0.000 {?} {379.HD1} 3.806 0.112 0.112 ++ 0.000 {?} {380.N} 124.503 0.045 0.045 ? 0.000 {?} 76.46660 2.57310 0 {?} 0 72 {353.HN} 8.648 0.036 0.048 ++ 0.000 {?} {353.HG1} 2.094 0.093 0.200 ? 0.000 {?} {353.N} 124.440 0.378 0.500 ++ 0.000 {?} 614.37030 7.99480 0 {?} 0 73 {353.HN} 8.643 0.048 0.048 ++ 0.000 {?} {352.HN} 7.900 0.180 0.140 ++ 0.000 {?} {353.N} 124.442 0.252 0.252 ++ 0.000 {?} 191.13670 3.00830 0 {?} 0 74 {353.HN} 8.648 0.037 0.075 ++ 0.000 {?} {352.HA} 4.544 0.085 0.201 ? 0.000 {?} {353.N} 124.443 0.402 0.717 ++ 0.000 {?} 1635.47546 21.48150 0 {?} 0 75 {353.HN} 8.645 0.042 0.048 ++ 0.000 {?} {353.HA} 4.399 0.111 0.111 ? 0.000 {?} {353.N} 124.451 0.399 0.458 ++ 0.000 {?} 655.11932 6.16400 0 {?} 0 76 {353.HN} 8.647 0.041 0.064 ++ 0.000 {?} {353.HB1} 1.930 0.111 0.200 ? 0.000 {?} {353.N} 124.431 0.377 0.548 ++ 0.000 {?} 1102.49060 9.99120 0 {?} 0 77 {353.HN} 8.647 0.037 0.059 ++ 0.000 {?} {353.HB2} 1.814 0.107 0.200 ? 0.000 {?} {353.N} 124.435 0.360 0.504 ++ 0.000 {?} 838.61493 9.64430 0 {?} 0 78 {353.HN} 8.647 0.046 0.046 ++ 0.000 {?} {352.HB2} 1.685 0.133 0.133 ? 0.000 {?} {353.N} 124.445 0.201 0.201 ++ 0.000 {?} 269.49570 3.16460 0 {?} 0 79 {335.HN} 8.865 0.053 0.053 ++ 0.000 {?} {334.HA} 4.356 0.136 0.136 ++ 0.000 {?} {335.N} 124.352 0.172 0.172 ++ 0.000 {?} 198.15770 2.94580 0 {?} 0 80 {292.HN} 8.788 0.037 0.037 ? 0.000 {?} {291.HN} 8.310 0.048 0.070 ++ 0.000 {?} {292.N} 124.357 0.414 0.580 ++ 0.000 {?} 53.37730 0.91950 0 {?} 0 81 {292.HN} 8.789 0.051 0.051 ++ 0.000 {?} {292.HA} 3.933 0.219 0.137 ++ 0.000 {?} {292.N} 124.363 0.280 0.280 ++ 0.000 {?} 244.65730 3.47180 0 {?} 0 82 {292.HN} 8.788 0.042 0.063 ++ 0.000 {?} {291.HA} 4.363 0.087 0.122 ++ 0.000 {?} {292.N} 124.353 0.393 0.529 ++ 0.000 {?} 769.66388 8.87390 0 {?} 0 83 {292.HN} 8.787 0.052 0.052 ++ 0.000 {?} {292.HG1} 2.305 0.138 0.138 ++ 0.000 {?} {292.N} 124.376 0.227 0.227 ++ 0.000 {?} 285.66739 3.02680 0 {?} 0 84 {292.HN} 8.787 0.042 0.052 ++ 0.000 {?} {292.HB1} 2.114 0.069 0.128 ? 0.000 {?} {292.N} 124.354 0.416 0.483 ++ 0.000 {?} 470.67001 6.35370 0 {?} 0 85 {292.HN} 8.786 0.050 0.050 ++ 0.000 {?} {292.HB2} 2.003 0.114 0.114 ? 0.000 {?} {292.N} 124.360 0.317 0.317 ++ 0.000 {?} 394.80310 3.84230 0 {?} 0 86 {335.HN} 8.864 0.062 0.062 ? 0.000 {?} {335.HA} 4.143 0.118 0.118 ? 0.000 {?} {335.N} 124.332 0.021 0.021 ? 0.000 {?} 82.11940 2.54640 0 {?} 0 87 {335.HN} 8.865 0.067 0.070 ++ 0.000 {?} {335.HB1} 1.507 0.109 0.114 ++ 0.000 {?} {335.N} 124.324 0.406 0.428 ++ 0.000 {?} 718.14160 5.30960 0 {?} 0 88 {382.HN} 9.075 0.054 0.054 ++ 0.000 {?} {382.HA} 4.596 0.122 0.122 ++ 0.000 {?} {382.N} 124.081 0.232 0.232 ++ 0.000 {?} 226.60381 3.04700 0 {?} 0 89 {382.HN} 9.074 0.047 0.047 ? 0.000 {?} {381.HB2} 1.410 0.111 0.111 ++ 0.000 {?} {382.N} 124.077 0.025 0.025 ? 0.000 {?} 77.19540 2.57510 0 {?} 0 90 {382.HN} 9.076 0.039 0.051 ++ 0.000 {?} {381.HA} 5.066 0.085 0.121 ++ 0.000 {?} {382.N} 124.049 0.402 0.541 ++ 0.000 {?} 693.28290 8.35050 0 {?} 0 91 {382.HN} 9.075 0.058 0.058 ++ 0.000 {?} {382.HB1} 1.258 0.146 0.146 ++ 0.000 {?} {382.N} 124.048 0.277 0.277 ++ 0.000 {?} 383.42841 3.46960 0 {?} 0 92 {382.HN} 9.077 0.069 0.061 ++ 0.000 {?} {382.HG} 0.933 0.150 0.150 ++ 0.000 {?} {382.N} 124.065 0.332 0.332 ++ 0.000 {?} 498.93188 4.14510 0 {?} 0 93 {382.HN} 9.078 0.049 0.049 ++ 0.000 {?} {361.HG11} 0.438 0.143 0.115 ++ 0.000 {?} {382.N} 124.058 0.216 0.216 ++ 0.000 {?} 182.08040 3.31690 0 {?} 0 94 {334.HN} 8.711 0.047 0.047 ++ 0.000 {?} {339.HA} 4.965 0.130 0.130 ++ 0.000 {?} {334.N} 123.954 0.233 0.233 ++ 0.000 {?} 271.53448 3.33190 0 {?} 0 95 {334.HN} 8.709 0.037 0.057 ++ 0.000 {?} {333.HA} 4.716 0.075 0.161 ? 0.000 {?} {334.N} 123.956 0.426 0.711 ++ 0.000 {?} 1091.81104 13.96020 0 {?} 0 96 {334.HN} 8.711 0.052 0.052 ++ 0.000 {?} {334.HA} 4.357 0.141 0.141 ++ 0.000 {?} {334.N} 123.947 0.451 0.371 ++ 0.000 {?} 362.52640 4.04510 0 {?} 0 97 {334.HN} 8.710 0.047 0.047 ++ 0.000 {?} {334.HB1} 1.986 0.099 0.134 ? 0.000 {?} {334.N} 123.947 0.261 0.261 ++ 0.000 {?} 250.30209 3.04340 0 {?} 0 98 {334.HN} 8.711 0.042 0.047 ++ 0.000 {?} {334.HD1} 1.658 0.121 0.143 ++ 0.000 {?} {334.N} 123.962 0.381 0.450 ++ 0.000 {?} 737.90887 6.30200 0 {?} 0 99 {334.HN} 8.711 0.040 0.045 ++ 0.000 {?} {334.HG1} 1.282 0.129 0.145 ++ 0.000 {?} {334.N} 123.953 0.428 0.492 ++ 0.000 {?} 823.38593 6.04150 0 {?} 0 100 {334.HN} 8.707 0.046 0.045 ++ 0.000 {?} {334.HB2} 1.859 0.132 0.132 ? 0.000 {?} {334.N} 123.945 0.443 0.432 ++ 0.000 {?} 448.64481 4.84040 0 {?} 0 101 {277.HN} 8.677 0.033 0.057 ++ 0.000 {?} {276.HA} 4.602 0.071 0.132 ? 0.000 {?} {277.N} 123.724 0.385 0.672 ++ 0.000 {?} 1060.48657 16.56650 0 {?} 0 102 {277.HN} 8.677 0.046 0.049 ++ 0.000 {?} {276.HB1} 3.875 0.107 0.117 ++ 0.000 {?} {277.N} 123.724 0.402 0.432 ++ 0.000 {?} 561.20923 5.34600 0 {?} 0 103 {277.HN} 8.678 0.029 0.041 ++ 0.000 {?} {277.HB2} 2.203 0.109 0.109 ? 0.000 {?} {277.N} 123.718 0.365 0.512 ++ 0.000 {?} 761.26221 8.98940 0 {?} 0 104 {277.HN} 8.677 0.040 0.052 ++ 0.000 {?} {277.HG1} 2.460 0.063 0.117 ? 0.000 {?} {277.N} 123.726 0.377 0.466 ++ 0.000 {?} 437.19699 7.03470 0 {?} 0 105 {277.HN} 8.678 0.029 0.038 ++ 0.000 {?} {277.HB1} 2.267 0.030 0.090 ? 0.000 {?} {277.N} 123.724 0.382 0.488 ++ 0.000 {?} 155.45959 7.39970 0 {?} 0 106 {268.HN} 8.612 0.038 0.045 ++ 0.000 {?} {267.HA} 4.402 0.090 0.108 ++ 0.000 {?} {268.N} 123.636 0.377 0.428 ++ 0.000 {?} 456.69891 5.94360 0 {?} 0 107 {268.HN} 8.611 0.045 0.045 ++ 0.000 {?} {268.HB2} 2.663 0.071 0.071 ++ 0.000 {?} {268.N} 123.630 0.153 0.153 ++ 0.000 {?} 86.10300 2.94970 0 {?} 0 108 {324.HN} 8.215 0.057 0.057 ++ 0.000 {?} {324.HB1} 3.606 0.163 0.163 ++ 0.000 {?} {324.N} 123.417 0.195 0.195 ++ 0.000 {?} 288.17160 3.04670 0 {?} 0 109 {324.HN} 8.213 0.045 0.071 ++ 0.000 {?} {323.HA} 4.887 0.079 0.133 ++ 0.000 {?} {324.N} 123.416 0.411 0.634 ++ 0.000 {?} 1072.85486 12.12460 0 {?} 0 110 {324.HN} 8.212 0.038 0.038 ++ 0.000 {?} {324.HA} 4.473 0.091 0.091 ++ 0.000 {?} {324.N} 123.410 0.077 0.077 ++ 0.000 {?} 58.43040 2.63980 0 {?} 0 111 {324.HN} 8.211 0.049 0.049 ++ 0.000 {?} {324.HB2} 2.995 0.128 0.128 ++ 0.000 {?} {324.N} 123.411 0.327 0.327 ++ 0.000 {?} 499.98459 4.18370 0 {?} 0 112 {318.HN} 8.892 0.047 0.063 ++ 0.000 {?} {318.HA} 4.847 0.100 0.131 ++ 0.000 {?} {318.N} 123.138 0.428 0.527 ++ 0.000 {?} 883.69208 7.54970 0 {?} 0 113 {318.HN} 8.893 0.043 0.070 ++ 0.000 {?} {317.HA} 4.648 0.088 0.150 ++ 0.000 {?} {318.N} 123.153 0.415 0.637 ++ 0.000 {?} 1072.95349 11.56590 0 {?} 0 114 {318.HN} 8.894 0.054 0.054 ++ 0.000 {?} {317.HB1} 2.898 0.116 0.116 ++ 0.000 {?} {318.N} 123.151 0.162 0.162 ++ 0.000 {?} 199.60300 2.83120 0 {?} 0 115 {318.HN} 8.892 0.036 0.040 ++ 0.000 {?} {318.HB1} 1.874 0.117 0.130 ++ 0.000 {?} {318.N} 123.138 0.485 0.532 ++ 0.000 {?} 680.38171 5.71780 0 {?} 0 116 {318.HN} 8.893 0.044 0.041 ++ 0.000 {?} {318.HB2} 1.625 0.120 0.109 ++ 0.000 {?} {318.N} 123.129 0.481 0.456 ++ 0.000 {?} 280.59079 4.64610 0 {?} 0 117 {318.HN} 8.891 0.053 0.053 ++ 0.000 {?} {317.HB2} 2.219 0.103 0.103 ++ 0.000 {?} {318.N} 123.169 0.072 0.072 ? 0.000 {?} 79.18560 2.68110 0 {?} 0 118 {318.HN} 8.891 0.068 0.068 ++ 0.000 {?} {319.HG11} 0.783 0.145 0.145 ++ 0.000 {?} {318.N} 123.120 0.343 0.343 ++ 0.000 {?} 586.88623 3.74520 0 {?} 0 119 {?} 8.520 0.024 0.052 ? 0.000 {?} {?} 1.822 0.110 0.166 ++ 0.000 {?} {?} 123.008 0.424 0.735 ? 0.000 {?} 173.04691 2.06100 0 {?} 0 120 {?} 8.523 0.053 0.053 ++ 0.000 {?} {?} 4.343 0.164 0.140 ++ 0.000 {?} {?} 123.005 0.288 0.288 ++ 0.000 {?} 295.16089 3.61590 0 {?} 0 121 {369.HN} 8.429 0.035 0.068 ++ 0.000 {?} {369.HA} 4.347 0.076 0.158 ++ 0.000 {?} {369.N} 122.923 0.372 0.656 ++ 0.000 {?} 1339.94910 20.31190 0 {?} 0 122 {369.HN} 8.429 0.034 0.042 ++ 0.000 {?} {369.HG1} 1.653 0.131 0.153 ? 0.000 {?} {369.N} 122.913 0.375 0.449 ++ 0.000 {?} 706.87958 6.45920 0 {?} 0 123 {369.HN} 8.428 0.037 0.055 ++ 0.000 {?} {369.HB1} 1.799 0.076 0.143 ? 0.000 {?} {369.N} 122.921 0.366 0.524 ++ 0.000 {?} 786.16479 10.45640 0 {?} 0 124 {362.HN} 8.868 0.036 0.036 ++ 0.000 {?} {361.HG21} 0.184 0.073 0.073 ++ 0.000 {?} {362.N} 122.853 0.170 0.170 ++ 0.000 {?} 103.29530 2.73020 0 {?} 0 125 {362.HN} 8.864 0.049 0.049 ++ 0.000 {?} {384.HD1} 4.145 0.132 0.132 ++ 0.000 {?} {362.N} 122.846 0.206 0.206 ++ 0.000 {?} 292.57391 2.94820 0 {?} 0 126 {362.HN} 8.865 0.044 0.058 ++ 0.000 {?} {361.HA} 3.991 0.087 0.125 ++ 0.000 {?} {362.N} 122.879 0.428 0.562 ++ 0.000 {?} 800.39032 8.24140 0 {?} 0 127 {362.HN} 8.866 0.046 0.051 ++ 0.000 {?} {362.HG} 1.395 0.130 0.157 ++ 0.000 {?} {362.N} 122.876 0.462 0.506 ++ 0.000 {?} 960.88953 5.70850 0 {?} 0 128 {362.HN} 8.863 0.043 0.043 ++ 0.000 {?} {362.HD11} 0.691 0.106 0.106 ++ 0.000 {?} {362.N} 122.872 0.448 0.380 ++ 0.000 {?} 334.46329 4.12700 0 {?} 0 129 {362.HN} 8.865 0.045 0.048 ++ 0.000 {?} {361.HG11} 0.438 0.113 0.119 ? 0.000 {?} {362.N} 122.880 0.428 0.453 ++ 0.000 {?} 681.85211 5.41370 0 {?} 0 130 {394.HN} 8.651 0.051 0.083 ++ 0.000 {?} {394.HA} 4.673 0.064 0.150 ? 0.000 {?} {394.N} 122.760 0.419 0.696 ++ 0.000 {?} 656.76642 8.06670 0 {?} 0 131 {394.HN} 8.652 0.037 0.063 ++ 0.000 {?} {393.HA} 4.580 0.056 0.113 ? 0.000 {?} {394.N} 122.756 0.404 0.688 ++ 0.000 {?} 1185.07568 19.08050 0 {?} 0 132 {394.HN} 8.652 0.041 0.054 ++ 0.000 {?} {393.HB} 4.217 0.079 0.117 ++ 0.000 {?} {394.N} 122.767 0.443 0.577 ++ 0.000 {?} 714.24780 8.19070 0 {?} 0 133 {394.HN} 8.651 0.041 0.056 ++ 0.000 {?} {394.HB1} 2.583 0.124 0.170 ++ 0.000 {?} {394.N} 122.758 0.406 0.554 ++ 0.000 {?} 1096.55176 9.21150 0 {?} 0 134 {394.HN} 8.652 0.040 0.038 ++ 0.000 {?} {393.HG21} 1.196 0.079 0.075 ++ 0.000 {?} {394.N} 122.763 0.443 0.428 ++ 0.000 {?} 154.16370 4.78170 0 {?} 0 135 {394.HN} 8.651 0.056 0.056 ++ 0.000 {?} {307.HG11} 0.790 0.137 0.126 ++ 0.000 {?} {394.N} 122.755 0.406 0.373 ++ 0.000 {?} 294.64871 4.51200 0 {?} 0 136 {309.HN} 9.099 0.087 0.058 ++ 0.000 {?} {308.HB} 1.972 0.114 0.114 ++ 0.000 {?} {309.N} 122.679 0.331 0.331 ++ 0.000 {?} 347.11450 3.52390 0 {?} 0 137 {309.HN} 9.100 0.057 0.057 ++ 0.000 {?} {390.HG21} 1.197 0.112 0.112 ++ 0.000 {?} {309.N} 122.690 0.259 0.259 ++ 0.000 {?} 269.63431 3.16650 0 {?} 0 138 {309.HN} 9.100 0.055 0.055 ++ 0.000 {?} {308.HG11} 0.612 0.110 0.110 ++ 0.000 {?} {309.N} 122.678 0.300 0.300 ++ 0.000 {?} 349.66980 3.36240 0 {?} 0 139 {309.HN} 9.098 0.049 0.061 ++ 0.000 {?} {308.HA} 5.276 0.087 0.116 ++ 0.000 {?} {309.N} 122.676 0.463 0.600 ++ 0.000 {?} 912.90820 7.74880 0 {?} 0 140 {309.HN} 9.095 0.058 0.058 ++ 0.000 {?} {309.HB1} 1.675 0.110 0.110 ++ 0.000 {?} {309.N} 122.660 0.231 0.231 ++ 0.000 {?} 298.82281 3.22200 0 {?} 0 141 {309.HN} 9.097 0.040 0.040 ++ 0.000 {?} {309.HB2} 1.337 0.069 0.069 ++ 0.000 {?} {309.N} 122.665 0.306 0.306 ++ 0.000 {?} 240.86090 3.75420 0 {?} 0 142 {309.HN} 9.099 0.051 0.052 ++ 0.000 {?} {309.HD21} 0.751 0.112 0.115 ++ 0.000 {?} {309.N} 122.692 0.434 0.441 ++ 0.000 {?} 654.50098 5.11230 0 {?} 0 143 {272.HN} 8.243 0.045 0.064 ++ 0.000 {?} {271.HA} 4.691 0.162 0.162 ? 0.000 {?} {272.N} 122.563 0.367 0.580 ++ 0.000 {?} 1459.93311 11.91930 0 {?} 0 144 {272.HN} 8.242 0.033 0.048 ++ 0.000 {?} {272.HD1} 1.749 0.132 0.200 ++ 0.000 {?} {272.N} 122.561 0.385 0.981 ? 0.000 {?} 1003.95380 10.31540 0 {?} 0 145 {272.HN} 8.243 0.050 0.050 ++ 0.000 {?} {272.HG1} 1.391 0.184 0.160 ++ 0.000 {?} {272.N} 122.575 0.317 0.317 ++ 0.000 {?} 386.80380 4.22870 0 {?} 0 146 {311.HN} 9.002 0.057 0.057 ++ 0.000 {?} {310.HG21} 1.234 0.163 0.163 ++ 0.000 {?} {311.N} 122.241 0.479 0.361 ++ 0.000 {?} 384.28680 3.71970 0 {?} 0 147 {311.HN} 8.999 0.037 0.037 ++ 0.000 {?} {310.HA} 4.909 0.127 0.105 ++ 0.000 {?} {311.N} 122.228 0.472 0.376 ++ 0.000 {?} 207.72411 3.66090 0 {?} 0 148 {291.HN} 8.315 0.041 0.068 ? 0.000 {?} {290.HA} 4.464 0.033 0.098 ? 0.000 {?} {291.N} 122.239 0.466 0.732 ++ 0.000 {?} 517.01343 15.33800 0 {?} 0 149 {291.HN} 8.310 0.039 0.038 ++ 0.000 {?} {290.HB} 3.959 0.093 0.090 ++ 0.000 {?} {291.N} 122.241 0.431 0.422 ++ 0.000 {?} 183.83279 4.83720 0 {?} 0 150 {291.HN} 8.310 0.041 0.058 ++ 0.000 {?} {291.HG1} 2.319 0.094 0.244 ? 0.000 {?} {291.N} 122.260 0.416 0.587 ++ 0.000 {?} 862.80652 8.92450 0 {?} 0 151 {291.HN} 8.312 0.039 0.045 ++ 0.000 {?} {291.HB1} 2.133 0.113 0.139 ? 0.000 {?} {291.N} 122.259 0.401 0.459 ++ 0.000 {?} 651.44263 6.11230 0 {?} 0 152 {291.HN} 8.310 0.036 0.050 ++ 0.000 {?} {291.HB2} 1.740 0.065 0.146 ? 0.000 {?} {291.N} 122.262 0.388 0.523 ++ 0.000 {?} 538.51038 8.36580 0 {?} 0 153 {291.HN} 8.312 0.035 0.043 ++ 0.000 {?} {290.HG21} 1.206 0.095 0.118 ++ 0.000 {?} {291.N} 122.250 0.442 0.523 ++ 0.000 {?} 596.07941 6.51440 0 {?} 0 154 {275.HN} 8.389 0.050 0.050 ++ 0.000 {?} {276.HA} 4.586 0.107 0.107 ++ 0.000 {?} {275.N} 122.154 0.069 0.069 ? 0.000 {?} 85.51860 2.65170 0 {?} 0 155 {275.HN} 8.389 0.025 0.064 ? 0.000 {?} {275.HA} 4.401 0.061 0.187 ? 0.000 {?} {275.N} 122.176 0.375 0.758 ++ 0.000 {?} 2140.87183 48.52550 0 {?} 0 156 {275.HN} 8.391 0.029 0.050 ++ 0.000 {?} {275.HB1} 1.840 0.055 0.071 ? 0.000 {?} {275.N} 122.177 0.369 0.589 ++ 0.000 {?} 618.22461 11.90830 0 {?} 0 157 {275.HN} 8.389 0.023 0.049 ? 0.000 {?} {275.HG1} 1.616 0.090 0.166 ? 0.000 {?} {275.N} 122.174 0.374 0.635 ++ 0.000 {?} 999.15839 17.28550 0 {?} 0 158 {275.HN} 8.389 0.031 0.040 ++ 0.000 {?} {274.HD21} 0.902 0.112 0.136 ++ 0.000 {?} {275.N} 122.187 0.363 0.464 ++ 0.000 {?} 607.22803 7.05620 0 {?} 0 159 {363.HN} 8.335 0.053 0.053 ++ 0.000 {?} {363.HA} 4.585 0.108 0.137 ? 0.000 {?} {363.N} 122.126 0.269 0.269 ++ 0.000 {?} 350.86090 3.52760 0 {?} 0 160 {363.HN} 8.335 0.048 0.067 ++ 0.000 {?} {363.HG11} 0.747 0.106 0.172 ? 0.000 {?} {363.N} 122.123 0.430 0.596 ++ 0.000 {?} 1144.92566 8.60380 0 {?} 0 161 {363.HN} 8.333 0.052 0.052 ++ 0.000 {?} {362.HD21} 0.526 0.163 0.163 ++ 0.000 {?} {363.N} 122.147 0.115 0.115 ++ 0.000 {?} 135.13429 2.65460 0 {?} 0 162 {363.HN} 8.330 0.055 0.055 ? 0.000 {?} {363.HB} 1.642 0.099 0.122 ? 0.000 {?} {363.N} 122.173 0.416 0.497 ++ 0.000 {?} 955.72418 6.70970 0 {?} 0 163 {273.HN} 8.226 0.032 0.064 ++ 0.000 {?} {272.HA} 4.310 0.059 0.190 ? 0.000 {?} {273.N} 122.034 0.381 1.284 ? 0.000 {?} 2033.27356 42.03120 0 {?} 0 164 {273.HN} 8.226 0.041 0.064 ++ 0.000 {?} {273.HA} 4.087 0.077 0.152 ++ 0.000 {?} {273.N} 122.030 0.367 0.981 ? 0.000 {?} 717.24512 10.47120 0 {?} 0 165 {273.HN} 8.226 0.032 0.056 ++ 0.000 {?} {273.HB} 2.047 0.086 0.181 ++ 0.000 {?} {273.N} 122.032 0.368 0.658 ++ 0.000 {?} 1297.38184 20.16980 0 {?} 0 166 {273.HN} 8.226 0.039 0.053 ++ 0.000 {?} {272.HB1} 1.779 0.077 0.179 ? 0.000 {?} {273.N} 122.025 0.483 0.803 ? 0.000 {?} 806.80353 8.21220 0 {?} 0 167 {273.HN} 8.223 0.034 0.034 ++ 0.000 {?} {272.HG1} 1.394 0.110 0.110 ++ 0.000 {?} {273.N} 122.029 0.110 0.110 ++ 0.000 {?} 67.93100 2.74110 0 {?} 0 168 {273.HN} 8.226 0.026 0.049 ++ 0.000 {?} {273.HG11} 0.941 0.085 0.171 ++ 0.000 {?} {273.N} 122.033 0.375 0.981 ? 0.000 {?} 1226.25220 23.22050 0 {?} 0 169 {359.HN} 7.232 0.071 0.080 ++ 0.000 {?} {359.HB2} 1.836 0.116 0.116 ? 0.000 {?} {359.N} 121.850 0.405 0.447 ++ 0.000 {?} 870.77881 5.67420 0 {?} 0 170 {359.HN} 7.233 0.061 0.062 ++ 0.000 {?} {359.HA} 4.549 0.228 0.233 ++ 0.000 {?} {359.N} 121.831 0.382 0.394 ++ 0.000 {?} 1033.92053 5.17010 0 {?} 0 171 {359.HN} 7.236 0.064 0.064 ++ 0.000 {?} {354.HD11} 0.928 0.131 0.131 ++ 0.000 {?} {359.N} 121.834 0.180 0.180 ++ 0.000 {?} 269.54361 3.08490 0 {?} 0 172 {359.HN} 7.232 0.054 0.072 ++ 0.000 {?} {359.HB1} 2.184 0.090 0.162 ? 0.000 {?} {359.N} 121.818 0.420 0.523 ++ 0.000 {?} 873.23370 7.07720 0 {?} 0 173 {389.HN} 8.621 0.052 0.052 ++ 0.000 {?} {278.HA} 5.014 0.130 0.130 ++ 0.000 {?} {389.N} 121.668 0.184 0.184 ++ 0.000 {?} 214.51230 3.14330 0 {?} 0 174 {389.HN} 8.618 0.041 0.058 ++ 0.000 {?} {388.HA} 4.772 0.090 0.153 ? 0.000 {?} {389.N} 121.660 0.374 0.524 ++ 0.000 {?} 788.12207 9.09270 0 {?} 0 175 {389.HN} 8.618 0.043 0.053 ++ 0.000 {?} {389.HG} 1.475 0.080 0.098 ? 0.000 {?} {389.N} 121.669 0.399 0.505 ++ 0.000 {?} 684.01208 7.25060 0 {?} 0 176 {389.HN} 8.618 0.040 0.040 ? 0.000 {?} {279.HG11} 0.771 0.082 0.082 ++ 0.000 {?} {389.N} 121.672 0.017 0.017 ? 0.000 {?} 64.98170 2.53700 0 {?} 0 177 {389.HN} 8.618 0.075 0.082 ++ 0.000 {?} {389.HD21} 0.632 0.126 0.142 ++ 0.000 {?} {389.N} 121.674 0.394 0.432 ++ 0.000 {?} 807.89008 5.63110 0 {?} 0 178 {389.HN} 8.615 0.000 0.042 ? 0.000 {?} {388.HB1} 3.070 0.000 0.069 ? 0.000 {?} {389.N} 121.668 0.000 0.000 ? 0.000 {?} 0.00000 2.50060 0 {?} 0 179 {389.HN} 8.617 0.043 0.051 ++ 0.000 {?} {389.HB1} 1.699 0.077 0.101 ? 0.000 {?} {389.N} 121.670 0.374 0.426 ++ 0.000 {?} 517.18738 5.91560 0 {?} 0 180 {364.HN} 8.790 0.042 0.065 ++ 0.000 {?} {363.HA} 4.593 0.087 0.153 ++ 0.000 {?} {364.N} 121.586 0.395 0.592 ++ 0.000 {?} 1025.86108 11.24060 0 {?} 0 181 {364.HN} 8.794 0.062 0.062 ++ 0.000 {?} {363.HG11} 0.760 0.077 0.141 ? 0.000 {?} {364.N} 121.575 0.371 0.370 ++ 0.000 {?} 219.82449 2.73830 0 {?} 0 182 {?} 8.732 0.055 0.055 ++ 0.000 {?} {?} 4.846 0.168 0.130 ++ 0.000 {?} {?} 121.599 0.256 0.256 ++ 0.000 {?} 225.99420 3.56000 0 {?} 0 183 {389.HN} 8.619 0.038 0.040 ++ 0.000 {?} {389.HB2} 1.561 0.067 0.155 ? 0.000 {?} {389.N} 121.654 0.373 0.398 ++ 0.000 {?} 368.68030 5.42820 0 {?} 0 184 {389.HN} 8.616 0.042 0.042 ++ 0.000 {?} {389.HA} 4.402 0.144 0.114 ++ 0.000 {?} {389.N} 121.658 0.343 0.190 ++ 0.000 {?} 69.64650 3.17370 0 {?} 0 185 {370.HN} 8.496 0.046 0.068 ++ 0.000 {?} {370.HB1} 1.833 0.156 0.244 ? 0.000 {?} {370.N} 121.617 0.457 0.749 ++ 0.000 {?} 3120.94092 16.05270 0 {?} 0 186 {370.HN} 8.493 0.036 0.060 ++ 0.000 {?} {370.HA} 4.359 0.107 0.195 ? 0.000 {?} {370.N} 121.630 0.420 0.726 ++ 0.000 {?} 1884.04749 20.00930 0 {?} 0 187 {370.HN} 8.495 0.036 0.046 ++ 0.000 {?} {370.HG1} 1.680 0.111 0.111 ? 0.000 {?} {370.N} 121.621 0.451 0.570 ++ 0.000 {?} 996.23969 7.89840 0 {?} 0 188 {364.HN} 8.793 0.049 0.049 ++ 0.000 {?} {364.HB1} 3.651 0.142 0.142 ++ 0.000 {?} {364.N} 121.559 0.122 0.122 ++ 0.000 {?} 85.87850 2.82520 0 {?} 0 189 {367.HN} 8.529 0.036 0.073 ++ 0.000 {?} {366.HA} 4.540 0.062 0.160 ? 0.000 {?} {367.N} 121.493 0.375 0.671 ++ 0.000 {?} 1173.40100 19.72010 0 {?} 0 190 {367.HN} 8.528 0.050 0.050 ++ 0.000 {?} {366.HB1} 2.320 0.168 0.151 ++ 0.000 {?} {367.N} 121.498 0.333 0.333 ++ 0.000 {?} 407.51260 4.46300 0 {?} 0 191 {367.HN} 8.529 0.069 0.076 ++ 0.000 {?} {367.HG1} 1.501 0.156 0.169 ? 0.000 {?} {367.N} 121.502 0.408 0.456 ++ 0.000 {?} 1183.25842 5.81700 0 {?} 0 192 {367.HN} 8.525 0.046 0.046 ++ 0.000 {?} {366.HB2} 2.040 0.110 0.110 ++ 0.000 {?} {367.N} 121.502 0.203 0.203 ++ 0.000 {?} 221.20509 3.06420 0 {?} 0 193 {367.HN} 8.524 0.034 0.053 ++ 0.000 {?} {367.HB2} 1.764 0.081 0.178 ? 0.000 {?} {367.N} 121.518 0.452 0.670 ++ 0.000 {?} 1234.19434 11.84020 0 {?} 0 194 {340.HN} 8.277 0.044 0.079 ++ 0.000 {?} {331.HA} 4.966 0.111 0.184 ? 0.000 {?} {340.N} 121.554 0.406 0.734 ++ 0.000 {?} 2198.23462 17.26970 0 {?} 0 195 {340.HN} 8.281 0.055 0.055 ++ 0.000 {?} {338.HB1} 3.826 0.094 0.094 ++ 0.000 {?} {340.N} 121.563 0.165 0.165 ++ 0.000 {?} 125.79110 2.99500 0 {?} 0 196 {340.HN} 8.281 0.052 0.052 ++ 0.000 {?} {340.HG21} 0.816 0.133 0.108 ++ 0.000 {?} {340.N} 121.555 0.330 0.330 ++ 0.000 {?} 350.05960 3.98410 0 {?} 0 197 {340.HN} 8.281 0.062 0.067 ++ 0.000 {?} {340.HG11} 0.445 0.120 0.129 ++ 0.000 {?} {340.N} 121.537 0.424 0.449 ++ 0.000 {?} 692.62402 5.41040 0 {?} 0 198 {397.HN} 8.261 0.036 0.081 ? 0.000 {?} {397.HA} 4.362 0.039 0.111 ? 0.000 {?} {397.N} 121.514 0.420 1.873 ? 0.000 {?} 761.84998 17.31690 0 {?} 0 199 {397.HN} 8.260 0.028 0.049 ++ 0.000 {?} {396.HA} 4.432 0.057 0.123 ? 0.000 {?} {397.N} 121.521 0.417 0.738 ++ 0.000 {?} 1311.04407 27.29190 0 {?} 0 200 {397.HN} 8.262 0.036 0.048 ++ 0.000 {?} {396.HG1} 2.105 0.136 0.244 ? 0.000 {?} {397.N} 121.528 0.438 0.534 ++ 0.000 {?} 941.30981 7.26740 0 {?} 0 201 {397.HN} 8.260 0.031 0.062 ? 0.000 {?} {397.HB1} 1.887 0.088 0.107 ? 0.000 {?} {397.N} 121.517 0.436 0.702 ? 0.000 {?} 1121.13379 10.91140 0 {?} 0 202 {397.HN} 8.260 0.040 0.056 ++ 0.000 {?} {397.HG1} 1.644 0.133 0.155 ? 0.000 {?} {397.N} 121.512 0.422 0.803 ? 0.000 {?} 1580.54773 9.86340 0 {?} 0 203 {388.HN} 9.708 0.078 0.071 ++ 0.000 {?} {387.HA} 5.014 0.149 0.129 ++ 0.000 {?} {388.N} 121.453 0.441 0.390 ++ 0.000 {?} 329.17291 4.33100 0 {?} 0 204 {392.HN} 8.225 0.040 0.061 ++ 0.000 {?} {392.HA} 4.573 0.080 0.200 ? 0.000 {?} {392.N} 121.439 0.453 0.657 ++ 0.000 {?} 948.07843 10.25550 0 {?} 0 205 {392.HN} 8.225 0.046 0.049 ++ 0.000 {?} {390.HB} 4.245 0.155 0.155 ? 0.000 {?} {392.N} 121.412 0.446 0.446 ? 0.000 {?} 1180.82056 5.35930 0 {?} 0 206 {392.HN} 8.224 0.041 0.048 ++ 0.000 {?} {391.HA1} 4.137 0.111 0.111 ? 0.000 {?} {392.N} 121.438 0.430 0.506 ? 0.000 {?} 702.84131 6.52490 0 {?} 0 207 {392.HN} 8.224 0.039 0.044 ++ 0.000 {?} {391.HA2} 3.973 0.091 0.116 ++ 0.000 {?} {392.N} 121.425 0.396 0.460 ++ 0.000 {?} 536.93982 6.41570 0 {?} 0 208 {392.HN} 8.226 0.034 0.067 ? 0.000 {?} {392.HB1} 1.708 0.098 0.154 ? 0.000 {?} {392.N} 121.437 0.481 0.948 ? 0.000 {?} 1376.73840 13.66200 0 {?} 0 209 {392.HN} 8.225 0.028 0.063 ++ 0.000 {?} {392.HB2} 1.560 0.049 0.116 ? 0.000 {?} {392.N} 121.434 0.435 0.728 ++ 0.000 {?} 988.56732 18.98850 0 {?} 0 210 {392.HN} 8.225 0.043 0.043 ++ 0.000 {?} {390.HG21} 1.204 0.109 0.109 ++ 0.000 {?} {392.N} 121.428 0.202 0.202 ++ 0.000 {?} 194.87621 3.00910 0 {?} 0 211 {392.HN} 8.224 0.041 0.057 ++ 0.000 {?} {392.HD21} 0.897 0.033 0.091 ? 0.000 {?} {392.N} 121.427 0.491 0.624 ? 0.000 {?} 294.46790 9.06710 0 {?} 0 212 {383.HN} 8.337 0.045 0.045 ++ 0.000 {?} {382.HD21} 0.069 0.106 0.106 ++ 0.000 {?} {383.N} 121.332 0.200 0.200 ++ 0.000 {?} 207.74890 2.94700 0 {?} 0 213 {383.HN} 8.332 0.030 0.072 ? 0.000 {?} {383.HA} 4.580 0.040 0.095 ? 0.000 {?} {383.N} 121.355 0.414 0.804 ++ 0.000 {?} 383.96979 9.73450 0 {?} 0 214 {395.HN} 8.331 0.030 0.056 ++ 0.000 {?} {394.HA} 4.681 0.059 0.133 ? 0.000 {?} {395.N} 121.370 0.386 0.704 ++ 0.000 {?} 1220.37634 25.16500 0 {?} 0 215 {395.HN} 8.331 0.034 0.053 ++ 0.000 {?} {395.HA} 4.302 0.054 0.135 ? 0.000 {?} {395.N} 121.377 0.353 0.535 ++ 0.000 {?} 626.33942 12.85510 0 {?} 0 216 {395.HN} 8.331 0.032 0.046 ++ 0.000 {?} {395.HB1} 1.892 0.050 0.109 ? 0.000 {?} {395.N} 121.369 0.364 0.514 ++ 0.000 {?} 415.56201 9.63930 0 {?} 0 217 {395.HN} 8.331 0.019 0.056 ? 0.000 {?} {395.HD1} 1.751 0.060 0.121 ? 0.000 {?} {395.N} 121.373 0.378 0.653 ++ 0.000 {?} 651.58423 17.81920 0 {?} 0 218 {395.HN} 8.331 0.038 0.044 ++ 0.000 {?} {393.HG21} 1.207 0.098 0.121 ++ 0.000 {?} {395.N} 121.339 0.446 0.509 ++ 0.000 {?} 635.34650 6.12250 0 {?} 0 219 {383.HN} 8.331 0.044 0.044 ++ 0.000 {?} {383.HG12} 0.801 0.030 0.078 ? 0.000 {?} {383.N} 121.334 0.471 0.385 ++ 0.000 {?} 84.40100 3.89130 0 {?} 0 220 {395.HN} 8.331 0.041 0.042 ++ 0.000 {?} {394.HB2} 2.582 0.123 0.124 ++ 0.000 {?} {395.N} 121.358 0.420 0.425 ++ 0.000 {?} 574.23792 5.01000 0 {?} 0 221 {395.HN} 8.331 0.032 0.052 ++ 0.000 {?} {395.HG1} 1.464 0.064 0.115 ++ 0.000 {?} {395.N} 121.371 0.385 0.596 ++ 0.000 {?} 597.89008 11.94070 0 {?} 0 222 {381.HN} 7.971 0.052 0.052 ++ 0.000 {?} {381.HA} 5.064 0.225 0.149 ++ 0.000 {?} {381.N} 121.371 0.253 0.253 ++ 0.000 {?} 249.78430 3.36500 0 {?} 0 223 {381.HN} 7.969 0.044 0.089 ++ 0.000 {?} {380.HA} 4.454 0.086 0.174 ++ 0.000 {?} {381.N} 121.373 0.392 0.704 ++ 0.000 {?} 1776.53979 20.59470 0 {?} 0 224 {381.HN} 7.969 0.057 0.057 ++ 0.000 {?} {381.HG1} 2.686 0.134 0.134 ++ 0.000 {?} {381.N} 121.355 0.186 0.186 ++ 0.000 {?} 222.34790 2.91280 0 {?} 0 225 {381.HN} 7.970 0.061 0.055 ++ 0.000 {?} {381.HG2} 2.384 0.146 0.131 ++ 0.000 {?} {381.N} 121.386 0.334 0.334 ++ 0.000 {?} 316.35089 4.46560 0 {?} 0 226 {381.HN} 7.969 0.043 0.051 ++ 0.000 {?} {381.HB1} 1.908 0.093 0.112 ++ 0.000 {?} {381.N} 121.374 0.423 0.496 ++ 0.000 {?} 640.53833 6.22590 0 {?} 0 227 {381.HN} 7.970 0.054 0.054 ++ 0.000 {?} {381.HB2} 1.420 0.133 0.133 ++ 0.000 {?} {381.N} 121.375 0.266 0.266 ++ 0.000 {?} 366.68491 3.67140 0 {?} 0 228 {381.HN} 7.968 0.045 0.058 ++ 0.000 {?} {380.HB1} 1.240 0.083 0.118 ++ 0.000 {?} {381.N} 121.369 0.406 0.539 ++ 0.000 {?} 720.91687 8.09400 0 {?} 0 229 {383.HN} 8.331 0.036 0.036 ? 0.000 {?} {382.HB2} 1.000 0.078 0.078 ++ 0.000 {?} {383.N} 121.316 0.012 0.012 ? 0.000 {?} 52.83060 2.37460 0 {?} 0 230 {308.HN} 9.344 0.047 0.076 ++ 0.000 {?} {307.HA} 4.869 0.100 0.168 ++ 0.000 {?} {308.N} 121.128 0.378 0.604 ++ 0.000 {?} 1304.97620 12.40230 0 {?} 0 231 {308.HN} 9.345 0.048 0.051 ++ 0.000 {?} {308.HG11} 0.616 0.108 0.111 ? 0.000 {?} {308.N} 121.147 0.424 0.455 ++ 0.000 {?} 653.48138 5.45480 0 {?} 0 232 {308.HN} 9.343 0.039 0.069 ++ 0.000 {?} {308.HG21} 0.775 0.106 0.244 ? 0.000 {?} {308.N} 121.124 0.378 0.645 ++ 0.000 {?} 1629.19507 16.28500 0 {?} 0 233 {345.HN} 8.925 0.059 0.059 ++ 0.000 {?} {340.HA} 4.556 0.138 0.138 ++ 0.000 {?} {345.N} 121.176 0.067 0.067 ? 0.000 {?} 78.41230 2.66740 0 {?} 0 234 {345.HN} 8.925 0.067 0.077 ++ 0.000 {?} {345.HA} 4.288 0.058 0.145 ? 0.000 {?} {345.N} 121.170 0.446 0.497 ++ 0.000 {?} 485.39099 6.03740 0 {?} 0 235 {345.HN} 8.923 0.070 0.070 ++ 0.000 {?} {344.HA} 4.159 0.130 0.130 ? 0.000 {?} {345.N} 121.163 0.200 0.200 ++ 0.000 {?} 298.24060 2.92330 0 {?} 0 236 {345.HN} 8.925 0.041 0.051 ++ 0.000 {?} {345.HB1} 3.276 0.126 0.163 ? 0.000 {?} {345.N} 121.173 0.446 0.545 ++ 0.000 {?} 912.48260 7.25630 0 {?} 0 237 {345.HN} 8.926 0.040 0.050 ++ 0.000 {?} {345.HB2} 3.129 0.121 0.165 ? 0.000 {?} {345.N} 121.162 0.438 0.538 ++ 0.000 {?} 917.15143 7.33180 0 {?} 0 238 {345.HN} 8.926 0.052 0.052 ++ 0.000 {?} {344.HB1} 2.160 0.080 0.101 ? 0.000 {?} {345.N} 121.176 0.317 0.317 ++ 0.000 {?} 314.06110 3.72800 0 {?} 0 239 {345.HN} 8.927 0.081 0.060 ++ 0.000 {?} {344.HB2} 2.064 0.111 0.111 ? 0.000 {?} {345.N} 121.165 0.323 0.323 ++ 0.000 {?} 352.46390 3.78810 0 {?} 0 240 {345.HN} 8.925 0.040 0.045 ++ 0.000 {?} {340.HG21} 0.824 0.076 0.089 ++ 0.000 {?} {345.N} 121.173 0.444 0.504 ++ 0.000 {?} 478.87680 6.04110 0 {?} 0 241 {345.HN} 8.928 0.060 0.060 ++ 0.000 {?} {340.HG11} 0.441 0.140 0.140 ++ 0.000 {?} {345.N} 121.134 0.207 0.207 ++ 0.000 {?} 228.04849 3.03170 0 {?} 0 242 {368.HN} 8.248 0.017 0.032 ++ 0.000 {?} {366.HA} 4.549 0.040 0.086 ++ 0.000 {?} {368.N} 121.053 0.268 0.981 ? 0.000 {?} 46.44100 2.32450 0 {?} 0 243 {368.HN} 8.249 0.042 0.051 ++ 0.000 {?} {368.HG1} 1.642 0.111 0.244 ? 0.000 {?} {368.N} 121.057 0.446 0.446 ? 0.000 {?} 1066.81055 7.33770 0 {?} 0 244 {368.HN} 8.249 0.040 0.067 ++ 0.000 {?} {368.HA} 4.311 0.094 0.191 ++ 0.000 {?} {368.N} 121.015 0.396 0.708 ? 0.000 {?} 1875.75879 21.10650 0 {?} 0 245 {368.HN} 8.249 0.041 0.063 ++ 0.000 {?} {368.HB1} 1.823 0.136 0.244 ? 0.000 {?} {368.N} 121.019 0.383 0.639 ? 0.000 {?} 2117.12134 15.46870 0 {?} 0 246 {306.HN} 8.062 0.053 0.053 ++ 0.000 {?} {305.HA1} 4.489 0.075 0.116 ? 0.000 {?} {306.N} 120.777 0.274 0.274 ++ 0.000 {?} 250.03090 3.64620 0 {?} 0 247 {306.HN} 8.063 0.043 0.037 ++ 0.000 {?} {304.HA} 3.557 0.086 0.086 ++ 0.000 {?} {306.N} 120.768 0.338 0.338 ++ 0.000 {?} 225.99789 4.34330 0 {?} 0 248 {306.HN} 8.061 0.055 0.053 ++ 0.000 {?} {319.HB} 2.467 0.144 0.138 ++ 0.000 {?} {306.N} 120.775 0.420 0.403 ++ 0.000 {?} 319.22519 4.79530 0 {?} 0 249 {306.HN} 8.061 0.036 0.071 ++ 0.000 {?} {306.HB1} 1.834 0.107 0.244 ? 0.000 {?} {306.N} 120.770 0.387 0.707 ++ 0.000 {?} 1819.84509 20.67690 0 {?} 0 250 {306.HN} 8.061 0.058 0.058 ++ 0.000 {?} {304.HD11} 0.932 0.095 0.130 ? 0.000 {?} {306.N} 120.785 0.237 0.237 ++ 0.000 {?} 261.61279 3.29760 0 {?} 0 251 {347.HN} 7.577 0.040 0.047 ++ 0.000 {?} {346.HD1} 7.185 0.087 0.109 ++ 0.000 {?} {347.N} 120.795 0.487 0.584 ++ 0.000 {?} 217.01540 2.01530 0 {?} 0 252 {347.HN} 7.576 0.038 0.059 ++ 0.000 {?} {347.HA} 4.157 0.083 0.133 ++ 0.000 {?} {347.N} 120.793 0.416 0.620 ++ 0.000 {?} 840.68188 10.73350 0 {?} 0 253 {347.HN} 7.575 0.067 0.053 ++ 0.000 {?} {346.HB1} 3.074 0.124 0.124 ++ 0.000 {?} {347.N} 120.781 0.289 0.289 ++ 0.000 {?} 331.52911 3.74230 0 {?} 0 254 {347.HN} 7.576 0.052 0.074 ++ 0.000 {?} {347.HB1} 2.102 0.074 0.141 ? 0.000 {?} {347.N} 120.784 0.395 0.599 ++ 0.000 {?} 1045.46667 11.42110 0 {?} 0 255 {347.HN} 7.575 0.049 0.075 ++ 0.000 {?} {347.HB2} 1.989 0.070 0.127 ? 0.000 {?} {347.N} 120.782 0.398 0.599 ++ 0.000 {?} 982.17419 11.01960 0 {?} 0 256 {347.HN} 7.574 0.095 0.077 ++ 0.000 {?} {347.HG2} 1.639 0.141 0.116 ? 0.000 {?} {347.N} 120.787 0.334 0.334 ++ 0.000 {?} 371.76740 4.08920 0 {?} 0 257 {347.HN} 7.573 0.062 0.065 ++ 0.000 {?} {347.HG1} 1.784 0.110 0.142 ? 0.000 {?} {347.N} 120.783 0.407 0.425 ++ 0.000 {?} 722.80212 5.28690 0 {?} 0 258 {306.HN} 8.062 0.043 0.053 ++ 0.000 {?} {306.HA} 4.369 0.096 0.127 ? 0.000 {?} {306.N} 120.761 0.388 0.473 ++ 0.000 {?} 637.24011 6.50500 0 {?} 0 259 {306.HN} 8.062 0.056 0.056 ++ 0.000 {?} {303.HA} 4.238 0.126 0.126 ++ 0.000 {?} {306.N} 120.748 0.117 0.117 ++ 0.000 {?} 91.22450 2.75520 0 {?} 0 260 {306.HN} 8.063 0.052 0.052 ++ 0.000 {?} {305.HA2} 3.416 0.136 0.136 ? 0.000 {?} {306.N} 120.757 0.243 0.243 ++ 0.000 {?} 326.84641 3.42510 0 {?} 0 261 {306.HN} 8.062 0.033 0.044 ++ 0.000 {?} {306.HB2} 1.340 0.103 0.143 ++ 0.000 {?} {306.N} 120.766 0.371 0.494 ++ 0.000 {?} 645.48993 7.82920 0 {?} 0 262 {306.HN} 8.062 0.035 0.062 ++ 0.000 {?} {306.HD21} 0.780 0.093 0.244 ? 0.000 {?} {306.N} 120.762 0.388 0.669 ++ 0.000 {?} 1208.81335 14.55590 0 {?} 0 263 {306.HN} 8.061 0.051 0.051 ++ 0.000 {?} {306.HD11} 0.620 0.116 0.116 ? 0.000 {?} {306.N} 120.752 0.269 0.269 ++ 0.000 {?} 323.54330 3.55460 0 {?} 0 264 {347.HN} 7.574 0.050 0.050 ++ 0.000 {?} {347.HD1} 3.202 0.134 0.134 ++ 0.000 {?} {347.N} 120.759 0.100 0.100 ++ 0.000 {?} 92.36930 2.75310 0 {?} 0 265 {398.HN} 8.596 0.009 0.038 ? 0.000 {?} {397.HB2} 1.800 0.034 0.098 ? 0.000 {?} {398.N} 120.645 0.401 0.885 ++ 0.000 {?} 10.72940 1.42890 0 {?} 0 266 {398.HN} 8.596 0.049 0.074 ++ 0.000 {?} {397.HA} 4.354 0.067 0.128 ++ 0.000 {?} {398.N} 120.640 0.428 0.648 ++ 0.000 {?} 917.73822 12.46330 0 {?} 0 267 {398.HN} 8.597 0.057 0.057 ++ 0.000 {?} {398.HB2} 2.712 0.138 0.130 ++ 0.000 {?} {398.N} 120.636 0.420 0.401 ++ 0.000 {?} 334.60489 4.68970 0 {?} 0 268 {398.HN} 8.596 0.048 0.048 ++ 0.000 {?} {397.HB1} 1.903 0.120 0.120 ++ 0.000 {?} {398.N} 120.626 0.190 0.190 ++ 0.000 {?} 193.41280 2.90510 0 {?} 0 269 {282.HN} 8.169 0.055 0.064 ++ 0.000 {?} {282.HA} 4.318 0.120 0.139 ? 0.000 {?} {282.N} 120.644 0.463 0.529 ++ 0.000 {?} 903.74951 6.19200 0 {?} 0 270 {282.HN} 8.169 0.048 0.043 ++ 0.000 {?} {279.HA} 3.570 0.062 0.106 ? 0.000 {?} {282.N} 120.627 0.446 0.398 ++ 0.000 {?} 177.12801 4.30660 0 {?} 0 271 {282.HN} 8.169 0.040 0.048 ++ 0.000 {?} {282.HB1} 3.453 0.066 0.102 ? 0.000 {?} {282.N} 120.651 0.428 0.525 ++ 0.000 {?} 469.86279 6.85770 0 {?} 0 272 {282.HN} 8.169 0.044 0.060 ++ 0.000 {?} {282.HB2} 3.288 0.067 0.123 ? 0.000 {?} {282.N} 120.640 0.450 0.588 ++ 0.000 {?} 672.45789 7.90460 0 {?} 0 273 {282.HN} 8.169 0.054 0.053 ++ 0.000 {?} {281.HB1} 3.155 0.150 0.147 ? 0.000 {?} {282.N} 120.636 0.455 0.449 ++ 0.000 {?} 439.68539 4.89170 0 {?} 0 274 {282.HN} 8.169 0.042 0.042 ++ 0.000 {?} {283.HB2} 2.455 0.114 0.114 ++ 0.000 {?} {282.N} 120.653 0.120 0.120 ++ 0.000 {?} 84.03500 2.74170 0 {?} 0 275 {282.HN} 8.165 0.040 0.040 ? 0.000 {?} {280.HD21} 0.935 0.111 0.111 ++ 0.000 {?} {282.N} 120.615 0.066 0.066 ? 0.000 {?} 73.99050 2.60130 0 {?} 0 276 {282.HN} 8.169 0.045 0.045 ++ 0.000 {?} {281.HB2} 2.854 0.119 0.119 ++ 0.000 {?} {282.N} 120.608 0.263 0.263 ++ 0.000 {?} 327.43481 3.35150 0 {?} 0 277 {282.HN} 8.169 0.036 0.036 ++ 0.000 {?} {389.HD21} 0.642 0.106 0.106 ++ 0.000 {?} {282.N} 120.627 0.140 0.140 ++ 0.000 {?} 92.65370 2.78420 0 {?} 0 278 {396.HN} 8.392 0.039 0.064 ++ 0.000 {?} {396.HA} 4.434 0.109 0.175 ? 0.000 {?} {396.N} 120.509 0.379 0.634 ++ 0.000 {?} 1364.63184 13.65330 0 {?} 0 279 {396.HN} 8.392 0.034 0.044 ++ 0.000 {?} {396.HB1} 2.599 0.117 0.244 ? 0.000 {?} {396.N} 120.504 0.350 0.435 ++ 0.000 {?} 698.65613 6.86530 0 {?} 0 280 {396.HN} 8.391 0.048 0.048 ++ 0.000 {?} {394.HA} 4.689 0.121 0.121 ? 0.000 {?} {396.N} 120.527 0.221 0.221 ++ 0.000 {?} 252.07840 3.19920 0 {?} 0 281 {396.HN} 8.391 0.032 0.055 ++ 0.000 {?} {396.HG2} 2.056 0.109 0.244 ? 0.000 {?} {396.N} 120.507 0.354 0.614 ++ 0.000 {?} 1477.48926 17.47690 0 {?} 0 282 {396.HN} 8.391 0.032 0.038 ++ 0.000 {?} {395.HB1} 1.895 0.133 0.155 ? 0.000 {?} {396.N} 120.502 0.339 0.409 ++ 0.000 {?} 594.91138 6.46730 0 {?} 0 283 {396.HN} 8.390 0.048 0.048 ++ 0.000 {?} {395.HG1} 1.461 0.228 0.153 ++ 0.000 {?} {396.N} 120.509 0.326 0.196 ++ 0.000 {?} 111.26930 3.26560 0 {?} 0 284 {287.HN} 8.227 0.042 0.042 ++ 0.000 {?} {287.HB1} 2.825 0.112 0.112 ++ 0.000 {?} {287.N} 120.555 0.221 0.221 ++ 0.000 {?} 226.64481 3.09920 0 {?} 0 285 {287.HN} 8.222 0.044 0.044 ++ 0.000 {?} {287.HB2} 2.709 0.121 0.121 ++ 0.000 {?} {287.N} 120.546 0.285 0.285 ++ 0.000 {?} 336.29620 3.35080 0 {?} 0 286 {396.HN} 8.394 0.043 0.070 ++ 0.000 {?} {395.HA} 4.308 0.093 0.155 ? 0.000 {?} {396.N} 120.493 0.388 0.727 ++ 0.000 {?} 2339.16333 22.04650 0 {?} 0 287 {339.HN} 8.426 0.039 0.078 ++ 0.000 {?} {338.HA} 4.343 0.081 0.187 ? 0.000 {?} {339.N} 120.321 0.380 0.789 ++ 0.000 {?} 2199.61182 26.30240 0 {?} 0 288 {339.HN} 8.426 0.039 0.073 ++ 0.000 {?} {339.HB1} 1.745 0.080 0.186 ? 0.000 {?} {339.N} 120.321 0.375 0.673 ++ 0.000 {?} 1449.08582 17.70920 0 {?} 0 289 {280.HN} 6.843 0.057 0.057 ++ 0.000 {?} {278.HB} 4.650 0.167 0.151 ++ 0.000 {?} {280.N} 120.271 0.444 0.405 ++ 0.000 {?} 414.56140 4.46210 0 {?} 0 290 {280.HN} 6.843 0.054 0.054 ++ 0.000 {?} {280.HA} 4.105 0.121 0.121 ++ 0.000 {?} {280.N} 120.305 0.255 0.255 ++ 0.000 {?} 313.95239 3.60150 0 {?} 0 291 {280.HN} 6.843 0.037 0.059 ++ 0.000 {?} {280.HD11} 0.947 0.078 0.163 ? 0.000 {?} {280.N} 120.307 0.393 0.639 ++ 0.000 {?} 927.66467 11.88630 0 {?} 0 292 {280.HN} 6.843 0.036 0.036 ++ 0.000 {?} {279.HB} 2.190 0.109 0.109 ++ 0.000 {?} {280.N} 120.300 0.215 0.215 ++ 0.000 {?} 195.80270 3.24410 0 {?} 0 293 {339.HN} 8.426 0.042 0.045 ++ 0.000 {?} {339.HA} 4.965 0.111 0.126 ? 0.000 {?} {339.N} 120.318 0.355 0.382 ++ 0.000 {?} 628.19379 5.45400 0 {?} 0 294 {339.HN} 8.427 0.036 0.059 ++ 0.000 {?} {338.HB1} 3.839 0.090 0.175 ++ 0.000 {?} {339.N} 120.311 0.375 0.619 ++ 0.000 {?} 1051.10669 13.70860 0 {?} 0 295 {269.HN} 8.270 0.033 0.038 ++ 0.000 {?} {269.HA} 4.184 0.110 0.126 ++ 0.000 {?} {269.N} 120.239 0.335 0.380 ++ 0.000 {?} 402.90039 5.97260 0 {?} 0 296 {269.HN} 8.268 0.032 0.057 ++ 0.000 {?} {268.HA} 4.688 0.082 0.155 ? 0.000 {?} {269.N} 120.258 0.381 0.682 ++ 0.000 {?} 1464.43872 23.53210 0 {?} 0 297 {269.HN} 8.269 0.029 0.029 ? 0.000 {?} {268.HB1} 2.735 0.021 0.104 ? 0.000 {?} {269.N} 120.271 0.058 0.058 ? 0.000 {?} 13.08680 2.61950 0 {?} 0 298 {269.HN} 8.264 0.037 0.037 ++ 0.000 {?} {268.HB2} 2.662 0.122 0.122 ? 0.000 {?} {269.N} 120.277 0.201 0.201 ++ 0.000 {?} 174.43620 2.96700 0 {?} 0 299 {269.HN} 8.268 0.034 0.047 ++ 0.000 {?} {269.HB} 2.165 0.091 0.123 ++ 0.000 {?} {269.N} 120.246 0.366 0.491 ++ 0.000 {?} 576.00378 8.50960 0 {?} 0 300 {269.HN} 8.268 0.032 0.053 ++ 0.000 {?} {269.HG21} 0.922 0.082 0.150 ++ 0.000 {?} {269.N} 120.256 0.366 0.606 ++ 0.000 {?} 1023.43927 17.17880 0 {?} 0 301 {280.HN} 6.843 0.034 0.034 ++ 0.000 {?} {283.HA} 3.985 0.093 0.093 ++ 0.000 {?} {280.N} 120.309 0.356 0.241 ++ 0.000 {?} 148.75400 3.59740 0 {?} 0 302 {280.HN} 6.843 0.047 0.049 ++ 0.000 {?} {280.HB1} 1.872 0.180 0.185 ++ 0.000 {?} {280.N} 120.311 0.404 0.414 ++ 0.000 {?} 840.61420 5.13900 0 {?} 0 303 {280.HN} 6.843 0.036 0.036 ++ 0.000 {?} {279.HG11} 0.790 0.105 0.105 ? 0.000 {?} {280.N} 120.315 0.261 0.261 ++ 0.000 {?} 248.47420 3.50080 0 {?} 0 304 {297.HN} 8.313 0.037 0.037 ? 0.000 {?} {296.HB2} 0.751 0.088 0.088 ? 0.000 {?} {297.N} 119.988 0.009 0.009 ? 0.000 {?} 55.89660 2.51710 0 {?} 0 305 {297.HN} 8.311 0.040 0.047 ++ 0.000 {?} {297.HA} 4.028 0.093 0.109 ++ 0.000 {?} {297.N} 119.983 0.425 0.500 ++ 0.000 {?} 555.83392 6.24310 0 {?} 0 306 {297.HN} 8.309 0.059 0.059 ++ 0.000 {?} {297.HG1} 2.315 0.046 0.123 ? 0.000 {?} {297.N} 119.969 0.229 0.229 ++ 0.000 {?} 164.86620 3.42660 0 {?} 0 307 {297.HN} 8.309 0.037 0.056 ++ 0.000 {?} {297.HB2} 2.027 0.050 0.099 ? 0.000 {?} {297.N} 119.975 0.395 0.552 ++ 0.000 {?} 496.51660 8.45950 0 {?} 0 308 {295.HN} 7.565 0.046 0.046 ++ 0.000 {?} {294.HA} 4.446 0.112 0.112 ++ 0.000 {?} {295.N} 119.985 0.249 0.249 ++ 0.000 {?} 275.00891 3.43380 0 {?} 0 309 {295.HN} 7.564 0.048 0.048 ++ 0.000 {?} {295.HA} 4.268 0.092 0.092 ++ 0.000 {?} {295.N} 119.998 0.338 0.338 ++ 0.000 {?} 344.55350 3.78100 0 {?} 0 310 {295.HN} 7.562 0.042 0.047 ++ 0.000 {?} {295.HB1} 3.317 0.094 0.103 ++ 0.000 {?} {295.N} 119.998 0.404 0.433 ++ 0.000 {?} 522.30322 5.58910 0 {?} 0 311 {295.HN} 7.564 0.044 0.048 ++ 0.000 {?} {295.HB2} 2.987 0.116 0.126 ++ 0.000 {?} {295.N} 120.003 0.455 0.492 ++ 0.000 {?} 708.74658 5.64300 0 {?} 0 312 {295.HN} 7.568 0.045 0.045 ++ 0.000 {?} {294.HB2} 1.664 0.099 0.099 ++ 0.000 {?} {295.N} 119.985 0.118 0.118 ++ 0.000 {?} 80.65900 2.82860 0 {?} 0 313 {299.HN} 8.911 0.057 0.057 ++ 0.000 {?} {298.HB2} 2.238 0.120 0.120 ++ 0.000 {?} {299.N} 119.876 0.048 0.048 ? 0.000 {?} 98.94000 2.62980 0 {?} 0 314 {299.HN} 8.908 0.073 0.067 ++ 0.000 {?} {299.HB} 1.724 0.134 0.121 ++ 0.000 {?} {299.N} 119.878 0.336 0.337 ++ 0.000 {?} 355.73480 4.39810 0 {?} 0 315 {297.HN} 8.312 0.053 0.053 ++ 0.000 {?} {296.HB1} 1.472 0.123 0.123 ++ 0.000 {?} {297.N} 119.940 0.437 0.365 ++ 0.000 {?} 338.41309 4.12060 0 {?} 0 316 {307.HN} 7.933 0.069 0.069 ++ 0.000 {?} {393.HA} 4.578 0.148 0.148 ++ 0.000 {?} {307.N} 119.918 0.197 0.197 ++ 0.000 {?} 301.44019 2.85160 0 {?} 0 317 {307.HN} 7.932 0.044 0.076 ++ 0.000 {?} {306.HA} 4.370 0.081 0.148 ++ 0.000 {?} {307.N} 119.885 0.384 0.607 ++ 0.000 {?} 1109.69116 12.76810 0 {?} 0 318 {307.HN} 7.931 0.045 0.068 ++ 0.000 {?} {307.HB} 1.801 0.127 0.191 ++ 0.000 {?} {307.N} 119.886 0.391 0.560 ++ 0.000 {?} 1248.42627 9.66290 0 {?} 0 319 {307.HN} 7.932 0.064 0.067 ++ 0.000 {?} {306.HB2} 1.346 0.146 0.157 ++ 0.000 {?} {307.N} 119.880 0.392 0.419 ++ 0.000 {?} 761.64587 5.41390 0 {?} 0 320 {307.HN} 7.933 0.045 0.080 ++ 0.000 {?} {307.HG11} 0.790 0.098 0.191 ++ 0.000 {?} {307.N} 119.889 0.406 0.704 ++ 0.000 {?} 1722.04724 17.40680 0 {?} 0 321 {299.HN} 8.906 0.046 0.046 ++ 0.000 {?} {299.HG21} 0.805 0.113 0.113 ++ 0.000 {?} {299.N} 119.869 0.077 0.077 ++ 0.000 {?} 74.01400 2.68810 0 {?} 0 322 {299.HN} 8.905 0.056 0.056 ++ 0.000 {?} {299.HG11} 0.657 0.133 0.133 ++ 0.000 {?} {299.N} 119.874 0.179 0.179 ++ 0.000 {?} 228.25050 3.03830 0 {?} 0 323 {286.HN} 8.198 0.070 0.070 ++ 0.000 {?} {286.HA} 4.139 0.130 0.130 ++ 0.000 {?} {286.N} 119.827 0.508 0.624 ? 0.000 {?} 848.39862 4.44400 0 {?} 0 324 {286.HN} 8.195 0.053 0.048 ++ 0.000 {?} {286.HB1} 3.167 0.116 0.116 ++ 0.000 {?} {286.N} 119.819 0.435 0.383 ++ 0.000 {?} 281.13370 4.28820 0 {?} 0 325 {286.HN} 8.195 0.047 0.053 ++ 0.000 {?} {286.HB2} 2.897 0.102 0.200 ? 0.000 {?} {286.N} 119.817 0.453 0.505 ++ 0.000 {?} 710.84521 5.90840 0 {?} 0 326 {286.HN} 8.194 0.050 0.050 ++ 0.000 {?} {285.HB1} 2.759 0.096 0.096 ? 0.000 {?} {286.N} 119.830 0.264 0.264 ++ 0.000 {?} 275.73199 3.16370 0 {?} 0 327 {286.HN} 8.194 0.050 0.050 ++ 0.000 {?} {285.HB2} 2.684 0.095 0.095 ? 0.000 {?} {286.N} 119.833 0.247 0.247 ++ 0.000 {?} 226.41209 3.10470 0 {?} 0 328 {322.HN} 8.770 0.036 0.058 ++ 0.000 {?} {321.HA} 4.720 0.087 0.159 ++ 0.000 {?} {322.N} 119.671 0.407 0.655 ++ 0.000 {?} 1127.19910 14.39910 0 {?} 0 329 {322.HN} 8.773 0.050 0.050 ++ 0.000 {?} {322.HA} 4.104 0.158 0.131 ++ 0.000 {?} {322.N} 119.679 0.337 0.337 ++ 0.000 {?} 359.46909 4.17190 0 {?} 0 330 {322.HN} 8.770 0.034 0.041 ++ 0.000 {?} {322.HB} 1.394 0.103 0.155 ? 0.000 {?} {322.N} 119.661 0.441 0.522 ++ 0.000 {?} 591.24530 6.65770 0 {?} 0 331 {322.HN} 8.771 0.060 0.044 ++ 0.000 {?} {322.HG11} 1.252 0.116 0.116 ? 0.000 {?} {322.N} 119.667 0.295 0.295 ++ 0.000 {?} 252.60640 3.77840 0 {?} 0 332 {322.HN} 8.772 0.047 0.047 ++ 0.000 {?} {322.HG21} -0.537 0.154 0.116 ++ 0.000 {?} {322.N} 119.642 0.297 0.297 ++ 0.000 {?} 259.22461 3.59120 0 {?} 0 333 {322.HN} 8.769 0.058 0.058 ++ 0.000 {?} {321.HB1} 2.677 0.162 0.162 ++ 0.000 {?} {322.N} 119.651 0.223 0.223 ++ 0.000 {?} 276.66071 2.96890 0 {?} 0 334 {322.HN} 8.766 0.049 0.059 ++ 0.000 {?} {304.HD11} 0.938 0.085 0.115 ++ 0.000 {?} {322.N} 119.648 0.471 0.569 ++ 0.000 {?} 901.42542 6.85420 0 {?} 0 335 {322.HN} 8.769 0.050 0.052 ++ 0.000 {?} {322.HD11} 0.730 0.132 0.171 ++ 0.000 {?} {322.N} 119.659 0.457 0.479 ++ 0.000 {?} 978.75763 5.35100 0 {?} 0 336 {322.HN} 8.768 0.048 0.048 ++ 0.000 {?} {322.HG12} 0.581 0.111 0.111 ++ 0.000 {?} {322.N} 119.657 0.305 0.305 ++ 0.000 {?} 363.33939 3.38910 0 {?} 0 337 {279.HN} 8.734 0.055 0.047 ++ 0.000 {?} {279.HB} 2.201 0.113 0.113 ++ 0.000 {?} {279.N} 119.568 0.440 0.384 ++ 0.000 {?} 290.34131 4.12560 0 {?} 0 338 {279.HN} 8.734 0.034 0.034 ? 0.000 {?} {279.HG21} 0.945 0.076 0.132 ? 0.000 {?} {279.N} 119.577 0.465 0.529 ++ 0.000 {?} 517.05200 6.04610 0 {?} 0 339 {279.HN} 8.734 0.035 0.042 ++ 0.000 {?} {279.HG11} 0.776 0.078 0.128 ? 0.000 {?} {279.N} 119.545 0.425 0.493 ++ 0.000 {?} 521.26172 6.31440 0 {?} 0 340 {279.HN} 8.734 0.034 0.034 ? 0.000 {?} {389.HD21} 0.645 0.101 0.101 ++ 0.000 {?} {279.N} 119.547 0.042 0.042 ? 0.000 {?} 72.60880 2.56410 0 {?} 0 341 {279.HN} 8.734 0.053 0.052 ++ 0.000 {?} {278.HA} 5.012 0.148 0.148 ++ 0.000 {?} {279.N} 119.561 0.412 0.399 ++ 0.000 {?} 402.91089 4.65730 0 {?} 0 342 {330.HN} 8.652 0.039 0.066 ++ 0.000 {?} {330.HA} 4.524 0.112 0.208 ? 0.000 {?} {330.N} 119.511 0.399 0.681 ++ 0.000 {?} 1603.54211 14.83470 0 {?} 0 343 {330.HN} 8.652 0.036 0.032 ++ 0.000 {?} {329.HB1} 2.097 0.113 0.099 ++ 0.000 {?} {330.N} 119.507 0.348 0.348 ++ 0.000 {?} 197.91270 4.30300 0 {?} 0 344 {281.HN} 7.749 0.032 0.032 ++ 0.000 {?} {278.HA} 5.037 0.086 0.086 ++ 0.000 {?} {281.N} 119.431 0.195 0.195 ++ 0.000 {?} 50.09240 1.30520 0 {?} 0 345 {281.HN} 7.752 0.063 0.063 ++ 0.000 {?} {280.HB1} 1.856 0.121 0.121 ++ 0.000 {?} {281.N} 119.435 0.245 0.245 ++ 0.000 {?} 292.40839 3.56650 0 {?} 0 346 {281.HN} 7.752 0.044 0.053 ++ 0.000 {?} {280.HD21} 0.947 0.125 0.153 ++ 0.000 {?} {281.N} 119.430 0.373 0.464 ++ 0.000 {?} 799.28418 6.85710 0 {?} 0 347 {344.HN} 8.184 0.041 0.051 ++ 0.000 {?} {344.HA} 4.163 0.100 0.119 ++ 0.000 {?} {344.N} 119.361 0.522 0.610 ++ 0.000 {?} 790.50513 6.58900 0 {?} 0 348 {344.HN} 8.183 0.058 0.076 ++ 0.000 {?} {344.HG1} 2.317 0.085 0.133 ? 0.000 {?} {344.N} 119.349 0.425 0.611 ++ 0.000 {?} 481.58441 3.20580 0 {?} 0 349 {344.HN} 8.183 0.055 0.073 ++ 0.000 {?} {344.HB2} 2.065 0.079 0.095 ? 0.000 {?} {344.N} 119.342 0.385 0.516 ++ 0.000 {?} 755.46112 7.68150 0 {?} 0 350 {281.HN} 7.752 0.059 0.059 ++ 0.000 {?} {281.HA} 4.417 0.147 0.136 ++ 0.000 {?} {281.N} 119.451 0.336 0.336 ++ 0.000 {?} 434.10950 4.53090 0 {?} 0 351 {281.HN} 7.752 0.053 0.055 ++ 0.000 {?} {281.HB1} 3.141 0.122 0.129 ++ 0.000 {?} {281.N} 119.452 0.420 0.438 ++ 0.000 {?} 635.14722 4.97880 0 {?} 0 352 {281.HN} 7.752 0.051 0.051 ++ 0.000 {?} {281.HB2} 2.861 0.151 0.135 ++ 0.000 {?} {281.N} 119.452 0.339 0.339 ++ 0.000 {?} 409.52090 4.43580 0 {?} 0 353 {?} 7.752 0.054 0.054 ++ 0.000 {?} {?} 5.603 0.142 0.142 ++ 0.000 {?} {?} 119.455 0.311 0.311 ++ 0.000 {?} 394.25980 3.75320 0 {?} 0 354 {355.HN} 9.612 0.058 0.065 ++ 0.000 {?} {354.HA} 3.766 0.116 0.134 ++ 0.000 {?} {355.N} 119.252 0.364 0.415 ++ 0.000 {?} 678.51959 5.91550 0 {?} 0 355 {355.HN} 9.613 0.054 0.054 ++ 0.000 {?} {355.HG21} 1.183 0.196 0.140 ++ 0.000 {?} {355.N} 119.253 0.298 0.298 ++ 0.000 {?} 319.86020 3.62840 0 {?} 0 356 {355.HN} 9.613 0.062 0.062 ++ 0.000 {?} {354.HG21} 0.804 0.096 0.096 ++ 0.000 {?} {355.N} 119.251 0.223 0.223 ++ 0.000 {?} 272.09311 3.29600 0 {?} 0 357 {342.HN} 8.215 0.055 0.055 ++ 0.000 {?} {342.HB1} 3.623 0.141 0.141 ++ 0.000 {?} {342.N} 119.258 0.102 0.102 ++ 0.000 {?} 102.51890 2.83900 0 {?} 0 358 {344.HN} 8.185 0.084 0.084 ++ 0.000 {?} {343.HG} 1.645 0.154 0.132 ? 0.000 {?} {344.N} 119.334 0.409 0.368 ++ 0.000 {?} 339.16339 2.99290 0 {?} 0 359 {344.HN} 8.185 0.062 0.062 ++ 0.000 {?} {343.HD21} 0.970 0.113 0.113 ++ 0.000 {?} {344.N} 119.314 0.255 0.255 ++ 0.000 {?} 395.71201 3.41300 0 {?} 0 360 {344.HN} 8.185 0.074 0.074 ++ 0.000 {?} {340.HG21} 0.824 0.121 0.121 ++ 0.000 {?} {344.N} 119.329 0.091 0.091 ++ 0.000 {?} 107.64170 2.74220 0 {?} 0 361 {344.HN} 8.182 0.045 0.056 ++ 0.000 {?} {343.HB1} 1.832 0.114 0.146 ++ 0.000 {?} {344.N} 119.336 0.393 0.495 ++ 0.000 {?} 806.89471 7.03280 0 {?} 0 362 {342.HN} 8.214 0.042 0.057 ++ 0.000 {?} {341.HA} 5.153 0.082 0.112 ++ 0.000 {?} {342.N} 119.228 0.403 0.520 ++ 0.000 {?} 674.53448 7.76340 0 {?} 0 363 {342.HN} 8.213 0.044 0.050 ++ 0.000 {?} {342.HA} 4.541 0.129 0.200 ? 0.000 {?} {342.N} 119.232 0.400 0.472 ++ 0.000 {?} 828.47192 6.31020 0 {?} 0 364 {342.HN} 8.212 0.045 0.042 ++ 0.000 {?} {341.HB1} 4.406 0.111 0.111 ? 0.000 {?} {342.N} 119.236 0.347 0.347 ++ 0.000 {?} 403.42361 4.60670 0 {?} 0 365 {342.HN} 8.209 0.046 0.046 ++ 0.000 {?} {341.HB2} 3.950 0.117 0.117 ++ 0.000 {?} {342.N} 119.233 0.265 0.265 ++ 0.000 {?} 282.86349 3.50990 0 {?} 0 366 {342.HN} 8.212 0.053 0.053 ++ 0.000 {?} {342.HB2} 3.133 0.176 0.121 ++ 0.000 {?} {342.N} 119.228 0.298 0.298 ++ 0.000 {?} 295.79431 3.62390 0 {?} 0 367 {351.HN} 7.630 0.057 0.057 ++ 0.000 {?} {351.HB1} 3.244 0.186 0.154 ++ 0.000 {?} {351.N} 118.906 0.308 0.308 ++ 0.000 {?} 363.93530 4.18870 0 {?} 0 368 {351.HN} 7.633 0.055 0.055 ++ 0.000 {?} {350.HA} 5.046 0.107 0.145 ? 0.000 {?} {351.N} 118.888 0.346 0.346 ++ 0.000 {?} 467.06271 4.09460 0 {?} 0 369 {351.HN} 7.632 0.043 0.079 ++ 0.000 {?} {351.HA} 4.897 0.086 0.190 ? 0.000 {?} {351.N} 118.886 0.378 0.693 ++ 0.000 {?} 1702.64819 21.10100 0 {?} 0 370 {351.HN} 7.632 0.063 0.063 ++ 0.000 {?} {347.HA} 4.155 0.160 0.107 ++ 0.000 {?} {351.N} 118.878 0.262 0.262 ++ 0.000 {?} 224.73100 3.60750 0 {?} 0 371 {351.HN} 7.631 0.040 0.044 ++ 0.000 {?} {351.HB2} 2.787 0.088 0.097 ++ 0.000 {?} {351.N} 118.880 0.401 0.442 ++ 0.000 {?} 438.30869 5.65800 0 {?} 0 372 {294.HN} 7.478 0.060 0.060 ++ 0.000 {?} {294.HB1} 1.920 0.182 0.182 ++ 0.000 {?} {294.N} 118.823 0.243 0.243 ++ 0.000 {?} 438.93369 3.43510 0 {?} 0 373 {332.HN} 8.556 0.063 0.063 ++ 0.000 {?} {341.HA} 5.155 0.136 0.136 ++ 0.000 {?} {332.N} 118.734 0.144 0.144 ++ 0.000 {?} 165.93381 2.83030 0 {?} 0 374 {332.HN} 8.561 0.064 0.064 ++ 0.000 {?} {331.HG21} 0.961 0.215 0.141 ++ 0.000 {?} {332.N} 118.720 0.269 0.269 ++ 0.000 {?} 334.03201 3.49810 0 {?} 0 375 {332.HN} 8.556 0.044 0.057 ++ 0.000 {?} {331.HA} 4.941 0.092 0.134 ? 0.000 {?} {332.N} 118.740 0.453 0.551 ++ 0.000 {?} 879.38739 6.89510 0 {?} 0 376 {332.HN} 8.556 0.036 0.039 ++ 0.000 {?} {331.HB} 3.824 0.087 0.100 ++ 0.000 {?} {332.N} 118.726 0.425 0.466 ++ 0.000 {?} 480.67810 5.68010 0 {?} 0 377 {270.HN} 8.434 0.030 0.033 ++ 0.000 {?} {270.HA} 4.389 0.088 0.101 ++ 0.000 {?} {270.N} 118.784 0.473 0.527 ++ 0.000 {?} 443.97549 5.76880 0 {?} 0 378 {270.HN} 8.430 0.035 0.058 ++ 0.000 {?} {269.HA} 4.184 0.086 0.160 ++ 0.000 {?} {270.N} 118.788 0.383 0.667 ++ 0.000 {?} 1073.56946 16.04950 0 {?} 0 379 {270.HN} 8.431 0.036 0.053 ++ 0.000 {?} {270.HB1} 3.854 0.091 0.145 ++ 0.000 {?} {270.N} 118.794 0.366 0.575 ++ 0.000 {?} 778.48633 11.30760 0 {?} 0 380 {270.HN} 8.431 0.035 0.036 ++ 0.000 {?} {269.HG21} 0.919 0.082 0.084 ++ 0.000 {?} {270.N} 118.791 0.451 0.467 ++ 0.000 {?} 383.09470 5.18230 0 {?} 0 381 {315.HN} 7.471 0.045 0.062 ++ 0.000 {?} {315.HG2} 1.125 0.109 0.150 ? 0.000 {?} {315.N} 118.753 0.487 0.640 ++ 0.000 {?} 1146.65039 8.06070 0 {?} 0 382 {283.HN} 8.707 0.048 0.048 ++ 0.000 {?} {283.HA} 3.961 0.100 0.100 ++ 0.000 {?} {283.N} 118.703 0.063 0.063 ? 0.000 {?} 63.43530 2.68660 0 {?} 0 383 {283.HN} 8.707 0.048 0.048 ++ 0.000 {?} {282.HB1} 3.451 0.123 0.123 ++ 0.000 {?} {283.N} 118.671 0.208 0.208 ++ 0.000 {?} 235.92210 2.93600 0 {?} 0 384 {283.HN} 8.707 0.056 0.058 ++ 0.000 {?} {283.HB1} 3.239 0.137 0.139 ++ 0.000 {?} {283.N} 118.679 0.464 0.471 ++ 0.000 {?} 934.17627 5.09990 0 {?} 0 385 {283.HN} 8.707 0.055 0.049 ++ 0.000 {?} {283.HG1} 2.546 0.107 0.127 ? 0.000 {?} {283.N} 118.658 0.441 0.392 ++ 0.000 {?} 355.68240 4.39020 0 {?} 0 386 {283.HN} 8.707 0.044 0.049 ++ 0.000 {?} {283.HB2} 2.434 0.102 0.114 ? 0.000 {?} {283.N} 118.690 0.412 0.454 ++ 0.000 {?} 630.60010 5.76970 0 {?} 0 387 {284.HN} 8.582 0.046 0.040 ++ 0.000 {?} {284.HA} 4.364 0.114 0.102 ++ 0.000 {?} {284.N} 118.702 0.456 0.390 ++ 0.000 {?} 193.84869 4.30780 0 {?} 0 388 {284.HN} 8.582 0.048 0.073 ++ 0.000 {?} {284.HB1} 3.288 0.082 0.129 ++ 0.000 {?} {284.N} 118.707 0.414 0.612 ++ 0.000 {?} 1041.76123 10.12080 0 {?} 0 389 {284.HN} 8.577 0.044 0.044 ++ 0.000 {?} {283.HG1} 2.549 0.117 0.117 ++ 0.000 {?} {284.N} 118.678 0.251 0.251 ++ 0.000 {?} 292.05670 3.11680 0 {?} 0 390 {284.HN} 8.576 0.037 0.037 ++ 0.000 {?} {283.HB2} 2.437 0.105 0.105 ++ 0.000 {?} {284.N} 118.702 0.117 0.117 ++ 0.000 {?} 77.39830 2.83860 0 {?} 0 391 {332.HN} 8.559 0.053 0.053 ++ 0.000 {?} {340.HA} 4.516 0.089 0.165 ? 0.000 {?} {332.N} 118.643 0.233 0.233 ++ 0.000 {?} 239.11659 3.05440 0 {?} 0 392 {315.HN} 7.468 0.041 0.066 ++ 0.000 {?} {314.HA} 4.460 0.101 0.175 ? 0.000 {?} {315.N} 118.709 0.409 0.673 ++ 0.000 {?} 1568.69653 14.18990 0 {?} 0 393 {315.HN} 7.466 0.055 0.055 ++ 0.000 {?} {310.HB} 3.363 0.148 0.148 ++ 0.000 {?} {315.N} 118.704 0.252 0.252 ++ 0.000 {?} 311.48431 3.37480 0 {?} 0 394 {315.HN} 7.467 0.053 0.076 ++ 0.000 {?} {315.HB1} 1.562 0.089 0.124 ? 0.000 {?} {315.N} 118.691 0.433 0.593 ++ 0.000 {?} 1140.69299 9.09240 0 {?} 0 395 {315.HN} 7.465 0.044 0.064 ++ 0.000 {?} {315.HG1} 1.318 0.064 0.115 ? 0.000 {?} {315.N} 118.666 0.434 0.602 ++ 0.000 {?} 731.29449 9.62580 0 {?} 0 396 {315.HN} 7.465 0.064 0.064 ++ 0.000 {?} {309.HD21} 0.738 0.142 0.138 ++ 0.000 {?} {315.N} 118.673 0.430 0.422 ++ 0.000 {?} 443.91171 4.86920 0 {?} 0 397 {348.HN} 8.398 0.040 0.061 ++ 0.000 {?} {348.HA} 4.048 0.101 0.135 ? 0.000 {?} {348.N} 118.606 0.407 0.553 ++ 0.000 {?} 847.93030 8.73120 0 {?} 0 398 {348.HN} 8.399 0.071 0.075 ++ 0.000 {?} {347.HB1} 2.105 0.125 0.165 ? 0.000 {?} {348.N} 118.595 0.419 0.451 ++ 0.000 {?} 967.66638 5.50680 0 {?} 0 399 {348.HN} 8.399 0.046 0.083 ++ 0.000 {?} {348.HB1} 1.902 0.094 0.148 ? 0.000 {?} {348.N} 118.599 0.420 0.664 ++ 0.000 {?} 1407.63098 13.33550 0 {?} 0 400 {348.HN} 8.399 0.046 0.071 ++ 0.000 {?} {348.HB2} 1.796 0.066 0.136 ? 0.000 {?} {348.N} 118.600 0.419 0.645 ++ 0.000 {?} 877.40222 11.12760 0 {?} 0 401 {348.HN} 8.396 0.060 0.050 ++ 0.000 {?} {347.HG2} 1.654 0.095 0.095 ? 0.000 {?} {348.N} 118.610 0.311 0.311 ++ 0.000 {?} 293.94241 4.00700 0 {?} 0 402 {348.HN} 8.396 0.051 0.055 ++ 0.000 {?} {348.HG1} 1.534 0.093 0.093 ? 0.000 {?} {348.N} 118.597 0.429 0.458 ++ 0.000 {?} 648.76147 5.48200 0 {?} 0 403 {348.HN} 8.397 0.082 0.082 ++ 0.000 {?} {348.HG2} 1.454 0.127 0.127 ? 0.000 {?} {348.N} 118.598 0.404 0.369 ++ 0.000 {?} 595.77222 4.51880 0 {?} 0 404 {333.HN} 8.265 0.040 0.060 ++ 0.000 {?} {332.HA} 4.795 0.081 0.244 ? 0.000 {?} {333.N} 118.470 0.397 0.599 ++ 0.000 {?} 953.26202 11.62320 0 {?} 0 405 {333.HN} 8.265 0.060 0.063 ++ 0.000 {?} {332.HB1} 2.899 0.160 0.165 ++ 0.000 {?} {333.N} 118.474 0.425 0.437 ++ 0.000 {?} 883.22882 5.18650 0 {?} 0 406 {333.HN} 8.266 0.057 0.057 ++ 0.000 {?} {332.HB2} 2.630 0.140 0.139 ++ 0.000 {?} {333.N} 118.469 0.406 0.403 ++ 0.000 {?} 443.62219 4.94260 0 {?} 0 407 {333.HN} 8.265 0.040 0.062 ++ 0.000 {?} {333.HD1} 1.663 0.088 0.158 ++ 0.000 {?} {333.N} 118.469 0.402 0.624 ++ 0.000 {?} 1114.39282 12.47920 0 {?} 0 408 {333.HN} 8.265 0.052 0.048 ++ 0.000 {?} {333.HG1} 1.342 0.176 0.161 ++ 0.000 {?} {333.N} 118.471 0.392 0.362 ++ 0.000 {?} 283.14420 4.57540 0 {?} 0 409 {301.HN} 7.263 0.036 0.053 ++ 0.000 {?} {300.HA} 4.152 0.109 0.160 ? 0.000 {?} {301.N} 118.444 0.373 0.524 ++ 0.000 {?} 916.97412 8.87020 0 {?} 0 410 {301.HN} 7.264 0.075 0.061 ++ 0.000 {?} {301.HD1} 1.717 0.055 0.093 ? 0.000 {?} {301.N} 118.421 0.312 0.312 ++ 0.000 {?} 196.76410 3.67440 0 {?} 0 411 {301.HN} 7.264 0.073 0.081 ++ 0.000 {?} {301.HG1} 1.630 0.068 0.107 ? 0.000 {?} {301.N} 118.433 0.521 0.624 ? 0.000 {?} 662.07819 5.70880 0 {?} 0 412 {301.HN} 7.262 0.038 0.070 ++ 0.000 {?} {301.HA} 4.051 0.104 0.155 ? 0.000 {?} {301.N} 118.433 0.418 0.749 ++ 0.000 {?} 1645.95703 15.85100 0 {?} 0 413 {301.HN} 7.262 0.040 0.081 ++ 0.000 {?} {301.HB1} 1.976 0.084 0.244 ? 0.000 {?} {301.N} 118.438 0.400 0.804 ++ 0.000 {?} 1613.35474 19.59780 0 {?} 0 414 {341.HN} 8.453 0.048 0.048 ++ 0.000 {?} {341.HB2} 3.951 0.099 0.099 ++ 0.000 {?} {341.N} 118.289 0.201 0.201 ++ 0.000 {?} 201.94690 2.95320 0 {?} 0 415 {341.HN} 8.451 0.037 0.064 ++ 0.000 {?} {340.HA} 4.498 0.057 0.163 ? 0.000 {?} {341.N} 118.315 0.471 0.774 ++ 0.000 {?} 1097.47693 16.50020 0 {?} 0 416 {341.HN} 8.449 0.049 0.067 ? 0.000 {?} {340.HB} 1.757 0.141 0.142 ++ 0.000 {?} {341.N} 118.317 0.495 0.503 ++ 0.000 {?} 787.89832 5.10100 0 {?} 0 417 {341.HN} 8.449 0.043 0.043 ++ 0.000 {?} {331.HG21} 0.973 0.083 0.083 ++ 0.000 {?} {341.N} 118.302 0.195 0.195 ++ 0.000 {?} 148.68990 2.85930 0 {?} 0 418 {341.HN} 8.451 0.041 0.052 ++ 0.000 {?} {340.HG21} 0.822 0.073 0.094 ++ 0.000 {?} {341.N} 118.313 0.481 0.598 ++ 0.000 {?} 624.09387 7.09890 0 {?} 0 419 {325.HN} 8.771 0.055 0.075 ++ 0.000 {?} {325.HA} 4.901 0.107 0.158 ++ 0.000 {?} {325.N} 118.229 0.441 0.593 ++ 0.000 {?} 1041.21301 8.84720 0 {?} 0 420 {325.HN} 8.770 0.035 0.056 ++ 0.000 {?} {325.HB1} 2.932 0.116 0.208 ++ 0.000 {?} {325.N} 118.225 0.455 0.696 ++ 0.000 {?} 1459.62219 12.85550 0 {?} 0 421 {317.HN} 8.887 0.042 0.065 ++ 0.000 {?} {316.HA} 5.581 0.097 0.155 ++ 0.000 {?} {317.N} 118.112 0.396 0.583 ++ 0.000 {?} 1052.91296 10.95060 0 {?} 0 422 {317.HN} 8.888 0.045 0.045 ++ 0.000 {?} {307.HA} 4.856 0.136 0.136 ++ 0.000 {?} {317.N} 118.107 0.230 0.230 ++ 0.000 {?} 251.57381 3.33050 0 {?} 0 423 {317.HN} 8.887 0.059 0.059 ++ 0.000 {?} {317.HA} 4.650 0.118 0.118 ++ 0.000 {?} {317.N} 118.108 0.139 0.139 ++ 0.000 {?} 114.60760 2.86060 0 {?} 0 424 {317.HN} 8.886 0.041 0.046 ++ 0.000 {?} {316.HB} 3.873 0.088 0.100 ++ 0.000 {?} {317.N} 118.127 0.433 0.482 ++ 0.000 {?} 544.06873 5.95180 0 {?} 0 425 {317.HN} 8.886 0.058 0.058 ++ 0.000 {?} {316.HG21} 1.022 0.178 0.138 ++ 0.000 {?} {317.N} 118.119 0.313 0.313 ++ 0.000 {?} 354.86179 3.98670 0 {?} 0 426 {317.HN} 8.885 0.043 0.043 ++ 0.000 {?} {317.HB2} 2.220 0.170 0.170 ++ 0.000 {?} {317.N} 118.136 0.309 0.309 ++ 0.000 {?} 359.30029 3.49690 0 {?} 0 427 {317.HN} 8.886 0.039 0.053 ++ 0.000 {?} {308.HG21} 0.768 0.120 0.171 ++ 0.000 {?} {317.N} 118.118 0.429 0.582 ++ 0.000 {?} 1056.55432 8.38400 0 {?} 0 428 {358.HN} 8.592 0.074 0.074 ++ 0.000 {?} {356.HA} 4.864 0.216 0.156 ++ 0.000 {?} {358.N} 118.121 0.352 0.352 ++ 0.000 {?} 559.91711 3.79190 0 {?} 0 429 {358.HN} 8.591 0.046 0.056 ++ 0.000 {?} {358.HA} 4.591 0.111 0.132 ++ 0.000 {?} {358.N} 118.099 0.385 0.453 ++ 0.000 {?} 732.12341 6.40260 0 {?} 0 430 {358.HN} 8.590 0.058 0.074 ++ 0.000 {?} {359.HB1} 2.187 0.030 0.108 ? 0.000 {?} {358.N} 118.096 0.394 0.499 ++ 0.000 {?} 86.38260 2.84120 0 {?} 0 431 {358.HN} 8.592 0.045 0.065 ++ 0.000 {?} {358.HB2} 1.944 0.104 0.135 ? 0.000 {?} {358.N} 118.101 0.417 0.594 ++ 0.000 {?} 1050.81482 8.87720 0 {?} 0 432 {358.HN} 8.590 0.048 0.055 ++ 0.000 {?} {357.HB1} 1.775 0.122 0.154 ? 0.000 {?} {358.N} 118.092 0.362 0.427 ++ 0.000 {?} 840.51001 6.28850 0 {?} 0 433 {358.HN} 8.591 0.044 0.047 ++ 0.000 {?} {358.HG2} 1.475 0.130 0.142 ++ 0.000 {?} {358.N} 118.110 0.402 0.432 ++ 0.000 {?} 714.83539 5.52260 0 {?} 0 434 {298.HN} 8.229 0.049 0.060 ++ 0.000 {?} {297.HB1} 2.099 0.059 0.089 ? 0.000 {?} {298.N} 118.021 0.447 0.567 ++ 0.000 {?} 505.19199 6.17520 0 {?} 0 435 {298.HN} 8.226 0.041 0.056 ++ 0.000 {?} {298.HA} 4.071 0.106 0.148 ++ 0.000 {?} {298.N} 118.025 0.420 0.565 ++ 0.000 {?} 939.43799 8.39840 0 {?} 0 436 {298.HN} 8.227 0.038 0.041 ++ 0.000 {?} {298.HG1} 2.622 0.081 0.086 ++ 0.000 {?} {298.N} 118.043 0.509 0.536 ++ 0.000 {?} 542.47339 5.36250 0 {?} 0 437 {298.HN} 8.226 0.057 0.057 ++ 0.000 {?} {298.HG2} 2.470 0.124 0.124 ++ 0.000 {?} {298.N} 118.055 0.428 0.378 ++ 0.000 {?} 398.35681 4.33940 0 {?} 0 438 {298.HN} 8.227 0.032 0.053 ++ 0.000 {?} {298.HB1} 2.301 0.034 0.064 ? 0.000 {?} {298.N} 118.043 0.465 0.669 ++ 0.000 {?} 322.61530 9.89290 0 {?} 0 439 {298.HN} 8.226 0.038 0.038 ? 0.000 {?} {299.HB} 1.713 0.152 0.152 ++ 0.000 {?} {298.N} 117.994 0.059 0.059 ? 0.000 {?} 97.02920 2.62900 0 {?} 0 440 {338.HN} 8.235 0.038 0.055 ++ 0.000 {?} {338.HA} 4.356 0.104 0.205 ++ 0.000 {?} {338.N} 117.851 0.408 0.575 ++ 0.000 {?} 1005.09583 10.26980 0 {?} 0 441 {338.HN} 8.235 0.037 0.049 ++ 0.000 {?} {338.HB1} 3.840 0.096 0.158 ++ 0.000 {?} {338.N} 117.845 0.413 0.577 ++ 0.000 {?} 798.73682 9.23890 0 {?} 0 442 {338.HN} 8.235 0.064 0.056 ++ 0.000 {?} {337.HA2} 3.559 0.160 0.138 ++ 0.000 {?} {338.N} 117.864 0.459 0.399 ++ 0.000 {?} 268.14780 4.22240 0 {?} 0 443 {338.HN} 8.234 0.043 0.043 ++ 0.000 {?} {334.HB2} 1.859 0.099 0.099 ? 0.000 {?} {338.N} 117.882 0.238 0.238 ++ 0.000 {?} 205.85429 3.10680 0 {?} 0 444 {326.HN} 7.268 0.038 0.048 ++ 0.000 {?} {325.HA} 4.905 0.098 0.145 ++ 0.000 {?} {326.N} 117.873 0.433 0.526 ++ 0.000 {?} 691.79449 7.19250 0 {?} 0 445 {326.HN} 7.267 0.037 0.044 ++ 0.000 {?} {326.HA} 4.719 0.105 0.131 ++ 0.000 {?} {326.N} 117.879 0.428 0.511 ++ 0.000 {?} 662.44531 6.75620 0 {?} 0 446 {326.HN} 7.268 0.056 0.056 ++ 0.000 {?} {324.HA} 4.481 0.133 0.133 ++ 0.000 {?} {326.N} 117.871 0.256 0.256 ++ 0.000 {?} 299.91199 3.22690 0 {?} 0 447 {326.HN} 7.267 0.042 0.052 ++ 0.000 {?} {325.HB1} 2.927 0.151 0.182 ++ 0.000 {?} {326.N} 117.877 0.440 0.524 ++ 0.000 {?} 1037.37256 6.76840 0 {?} 0 448 {326.HN} 7.267 0.053 0.053 ++ 0.000 {?} {326.HG1} 2.422 0.140 0.143 ++ 0.000 {?} {326.N} 117.880 0.413 0.418 ++ 0.000 {?} 655.74823 5.08570 0 {?} 0 449 {326.HN} 7.268 0.053 0.053 ++ 0.000 {?} {326.HB1} 2.263 0.132 0.134 ? 0.000 {?} {326.N} 117.876 0.412 0.415 ++ 0.000 {?} 662.55823 5.05920 0 {?} 0 450 {326.HN} 7.268 0.047 0.055 ++ 0.000 {?} {326.HG2} 2.120 0.105 0.120 ? 0.000 {?} {326.N} 117.878 0.446 0.505 ++ 0.000 {?} 706.18488 6.08210 0 {?} 0 451 {326.HN} 7.267 0.040 0.054 ++ 0.000 {?} {326.HB2} 1.573 0.111 0.200 ? 0.000 {?} {326.N} 117.880 0.439 0.563 ? 0.000 {?} 929.75330 7.70700 0 {?} 0 452 {326.HN} 7.269 0.061 0.061 ? 0.000 {?} {361.HB} 1.439 0.126 0.126 ? 0.000 {?} {326.N} 117.877 0.097 0.097 ++ 0.000 {?} 100.40520 2.65640 0 {?} 0 453 {326.HN} 7.269 0.064 0.064 ++ 0.000 {?} {361.HG21} 0.180 0.130 0.130 ++ 0.000 {?} {326.N} 117.848 0.266 0.266 ++ 0.000 {?} 289.11749 3.33700 0 {?} 0 454 {285.HN} 8.164 0.051 0.051 ++ 0.000 {?} {284.HA} 4.341 0.129 0.129 ++ 0.000 {?} {285.N} 117.655 0.266 0.266 ++ 0.000 {?} 308.02670 3.45610 0 {?} 0 455 {304.HN} 7.697 0.055 0.055 ++ 0.000 {?} {301.HA} 4.056 0.135 0.135 ++ 0.000 {?} {304.N} 117.669 0.148 0.148 ++ 0.000 {?} 156.72380 2.80170 0 {?} 0 456 {304.HN} 7.696 0.045 0.080 ++ 0.000 {?} {304.HB} 1.855 0.058 0.112 ? 0.000 {?} {304.N} 117.657 0.397 0.667 ++ 0.000 {?} 1016.21588 14.87440 0 {?} 0 457 {304.HN} 7.696 0.038 0.059 ++ 0.000 {?} {304.HD11} 0.935 0.081 0.200 ? 0.000 {?} {304.N} 117.670 0.421 0.624 ++ 0.000 {?} 827.59668 10.11140 0 {?} 0 458 {304.HN} 7.694 0.047 0.062 ++ 0.000 {?} {303.HD21} 0.621 0.076 0.103 ? 0.000 {?} {304.N} 117.655 0.372 0.493 ++ 0.000 {?} 232.22440 2.23190 0 {?} 0 459 {304.HN} 7.694 0.066 0.066 ++ 0.000 {?} {304.HA} 3.551 0.119 0.119 ++ 0.000 {?} {304.N} 117.673 0.459 0.383 ++ 0.000 {?} 385.10571 4.08760 0 {?} 0 460 {304.HN} 7.695 0.054 0.076 ++ 0.000 {?} {304.HG11} 1.740 0.055 0.121 ? 0.000 {?} {304.N} 117.655 0.368 0.513 ++ 0.000 {?} 713.77899 9.46600 0 {?} 0 461 {305.HN} 9.545 0.042 0.056 ++ 0.000 {?} {304.HA} 3.554 0.089 0.200 ? 0.000 {?} {305.N} 117.588 0.423 0.531 ++ 0.000 {?} 753.97137 7.57220 0 {?} 0 462 {305.HN} 9.545 0.054 0.054 ++ 0.000 {?} {319.HB} 2.464 0.102 0.102 ++ 0.000 {?} {305.N} 117.571 0.158 0.158 ++ 0.000 {?} 160.39420 2.94330 0 {?} 0 463 {305.HN} 9.546 0.040 0.042 ++ 0.000 {?} {304.HG21} 0.933 0.109 0.124 ++ 0.000 {?} {305.N} 117.604 0.460 0.481 ++ 0.000 {?} 586.91418 5.33480 0 {?} 0 464 {305.HN} 9.544 0.049 0.049 ++ 0.000 {?} {305.HA1} 4.496 0.126 0.126 ++ 0.000 {?} {305.N} 117.601 0.484 0.381 ++ 0.000 {?} 319.53409 3.82690 0 {?} 0 465 {305.HN} 9.543 0.045 0.042 ++ 0.000 {?} {305.HA2} 3.417 0.102 0.089 ? 0.000 {?} {305.N} 117.593 0.459 0.427 ++ 0.000 {?} 189.08580 4.55320 0 {?} 0 466 {305.HN} 9.540 0.057 0.057 ++ 0.000 {?} {306.HB1} 1.836 0.132 0.132 ++ 0.000 {?} {305.N} 117.588 0.150 0.150 ++ 0.000 {?} 184.41589 2.79200 0 {?} 0 467 {305.HN} 9.546 0.049 0.049 ++ 0.000 {?} {319.HG21} 0.720 0.092 0.092 ++ 0.000 {?} {305.N} 117.598 0.357 0.357 ++ 0.000 {?} 380.15369 3.71100 0 {?} 0 468 {343.HN} 8.558 0.061 0.061 ++ 0.000 {?} {341.HB1} 4.406 0.136 0.118 ? 0.000 {?} {343.N} 117.561 0.355 0.254 ++ 0.000 {?} 236.71300 3.71230 0 {?} 0 469 {276.HN} 8.465 0.045 0.060 ++ 0.000 {?} {276.HA} 4.604 0.076 0.147 ? 0.000 {?} {276.N} 117.617 0.393 0.510 ++ 0.000 {?} 647.52252 7.87350 0 {?} 0 470 {276.HN} 8.465 0.036 0.072 ++ 0.000 {?} {275.HA} 4.401 0.081 0.198 ++ 0.000 {?} {276.N} 117.630 0.380 0.687 ++ 0.000 {?} 1563.70361 23.19350 0 {?} 0 471 {276.HN} 8.465 0.036 0.056 ++ 0.000 {?} {276.HB1} 3.876 0.094 0.144 ++ 0.000 {?} {276.N} 117.625 0.382 0.552 ++ 0.000 {?} 770.29028 10.29630 0 {?} 0 472 {276.HN} 8.465 0.036 0.036 ++ 0.000 {?} {275.HB1} 1.841 0.050 0.094 ? 0.000 {?} {276.N} 117.621 0.412 0.377 ++ 0.000 {?} 185.83051 4.49830 0 {?} 0 473 {276.HN} 8.465 0.039 0.039 ++ 0.000 {?} {275.HB2} 1.787 0.027 0.081 ? 0.000 {?} {276.N} 117.623 0.398 0.363 ++ 0.000 {?} 72.02170 4.47980 0 {?} 0 474 {276.HN} 8.465 0.041 0.033 ++ 0.000 {?} {275.HG1} 1.618 0.131 0.131 ? 0.000 {?} {276.N} 117.626 0.425 0.361 ++ 0.000 {?} 257.69421 4.15800 0 {?} 0 475 {285.HN} 8.162 0.044 0.049 ++ 0.000 {?} {285.HA} 4.511 0.073 0.082 ++ 0.000 {?} {285.N} 117.629 0.415 0.466 ++ 0.000 {?} 489.27441 5.88390 0 {?} 0 476 {285.HN} 8.162 0.041 0.046 ++ 0.000 {?} {284.HB1} 3.287 0.079 0.091 ++ 0.000 {?} {285.N} 117.627 0.441 0.501 ++ 0.000 {?} 558.55188 6.05570 0 {?} 0 477 {285.HN} 8.163 0.044 0.057 ++ 0.000 {?} {285.HB1} 2.763 0.104 0.155 ? 0.000 {?} {285.N} 117.624 0.432 0.571 ++ 0.000 {?} 918.47980 7.92120 0 {?} 0 478 {285.HN} 8.162 0.042 0.048 ++ 0.000 {?} {285.HB2} 2.667 0.067 0.067 ? 0.000 {?} {285.N} 117.634 0.403 0.463 ++ 0.000 {?} 452.96350 6.08110 0 {?} 0 479 {304.HN} 7.695 0.053 0.053 ++ 0.000 {?} {302.HA} 4.186 0.130 0.130 ++ 0.000 {?} {304.N} 117.645 0.149 0.149 ++ 0.000 {?} 161.16750 2.96930 0 {?} 0 480 {304.HN} 7.695 0.049 0.049 ++ 0.000 {?} {303.HB2} 1.298 0.182 0.182 ++ 0.000 {?} {304.N} 117.633 0.098 0.098 ++ 0.000 {?} 106.96540 2.77060 0 {?} 0 481 {343.HN} 8.557 0.065 0.061 ++ 0.000 {?} {329.HA} 4.521 0.089 0.124 ? 0.000 {?} {343.N} 117.529 0.432 0.410 ++ 0.000 {?} 412.89481 4.70500 0 {?} 0 482 {343.HN} 8.557 0.039 0.046 ++ 0.000 {?} {343.HA} 4.193 0.086 0.108 ++ 0.000 {?} {343.N} 117.535 0.411 0.479 ++ 0.000 {?} 512.82709 6.24970 0 {?} 0 483 {343.HN} 8.559 0.046 0.046 ++ 0.000 {?} {342.HB1} 3.622 0.147 0.147 ++ 0.000 {?} {343.N} 117.532 0.205 0.205 ++ 0.000 {?} 252.44650 3.04690 0 {?} 0 484 {343.HN} 8.557 0.051 0.051 ++ 0.000 {?} {342.HB2} 3.132 0.163 0.163 ++ 0.000 {?} {343.N} 117.547 0.238 0.238 ++ 0.000 {?} 307.79929 3.33630 0 {?} 0 485 {343.HN} 8.558 0.040 0.058 ++ 0.000 {?} {343.HB1} 1.828 0.097 0.244 ? 0.000 {?} {343.N} 117.540 0.391 0.534 ++ 0.000 {?} 834.03082 9.12420 0 {?} 0 486 {343.HN} 8.557 0.038 0.058 ++ 0.000 {?} {343.HB2} 1.552 0.092 0.141 ? 0.000 {?} {343.N} 117.529 0.418 0.596 ++ 0.000 {?} 855.23682 9.65470 0 {?} 0 487 {343.HN} 8.557 0.036 0.034 ++ 0.000 {?} {343.HD21} 0.988 0.133 0.127 ++ 0.000 {?} {343.N} 117.520 0.451 0.430 ++ 0.000 {?} 255.73570 4.69410 0 {?} 0 488 {289.HN} 7.766 0.054 0.054 ++ 0.000 {?} {288.HA} 4.427 0.055 0.075 ? 0.000 {?} {289.N} 117.494 0.328 0.328 ++ 0.000 {?} 231.28140 3.79790 0 {?} 0 489 {289.HN} 7.764 0.039 0.039 ++ 0.000 {?} {289.HB2} 1.914 0.097 0.097 ++ 0.000 {?} {289.N} 117.482 0.253 0.253 ++ 0.000 {?} 197.43910 3.27720 0 {?} 0 490 {289.HN} 7.761 0.053 0.053 ++ 0.000 {?} {289.HA} 4.365 0.097 0.097 ? 0.000 {?} {289.N} 117.494 0.325 0.325 ++ 0.000 {?} 385.69559 3.67660 0 {?} 0 491 {289.HN} 7.762 0.046 0.046 ? 0.000 {?} {289.HB1} 2.096 0.099 0.099 ++ 0.000 {?} {289.N} 117.480 0.043 0.043 ? 0.000 {?} 64.23200 2.59410 0 {?} 0 492 {289.HN} 7.763 0.052 0.052 ++ 0.000 {?} {289.HG1} 2.258 0.176 0.131 ++ 0.000 {?} {289.N} 117.449 0.230 0.230 ++ 0.000 {?} 229.09790 3.13740 0 {?} 0 493 {313.HN} 6.740 0.055 0.055 ++ 0.000 {?} {313.HB1} 3.381 0.149 0.149 ++ 0.000 {?} {313.N} 117.372 0.169 0.169 ++ 0.000 {?} 226.27200 2.92210 0 {?} 0 494 {313.HN} 6.736 0.050 0.080 ++ 0.000 {?} {313.HA} 4.843 0.085 0.135 ++ 0.000 {?} {313.N} 117.370 0.403 0.621 ++ 0.000 {?} 1109.22644 10.56730 0 {?} 0 495 {296.HN} 8.420 0.066 0.066 ++ 0.000 {?} {296.HA} 3.001 0.185 0.140 ++ 0.000 {?} {296.N} 117.232 0.322 0.322 ++ 0.000 {?} 449.43390 3.83110 0 {?} 0 496 {296.HN} 8.422 0.050 0.050 ++ 0.000 {?} {296.HG1} 1.656 0.111 0.111 ++ 0.000 {?} {296.N} 117.241 0.214 0.214 ++ 0.000 {?} 256.70920 2.92570 0 {?} 0 497 {296.HN} 8.421 0.061 0.061 ++ 0.000 {?} {296.HB1} 1.474 0.125 0.125 ++ 0.000 {?} {296.N} 117.258 0.211 0.211 ++ 0.000 {?} 278.10739 3.09880 0 {?} 0 498 {296.HN} 8.418 0.049 0.049 ? 0.000 {?} {296.HB2} 0.751 0.095 0.095 ? 0.000 {?} {296.N} 117.200 0.020 0.020 ? 0.000 {?} 67.83110 2.53830 0 {?} 0 499 {300.HN} 7.825 0.040 0.056 ++ 0.000 {?} {300.HA} 4.155 0.093 0.155 ? 0.000 {?} {300.N} 117.052 0.439 0.607 ++ 0.000 {?} 887.52838 8.91960 0 {?} 0 500 {300.HN} 7.826 0.050 0.055 ++ 0.000 {?} {300.HB1} 4.062 0.086 0.086 ? 0.000 {?} {300.N} 117.072 0.449 0.488 ++ 0.000 {?} 608.24158 5.63090 0 {?} 0 501 {300.HN} 7.825 0.050 0.050 ++ 0.000 {?} {299.HB} 1.728 0.163 0.163 ++ 0.000 {?} {300.N} 117.068 0.207 0.207 ++ 0.000 {?} 264.99460 2.90150 0 {?} 0 502 {300.HN} 7.825 0.044 0.044 ++ 0.000 {?} {299.HG21} 0.804 0.052 0.120 ? 0.000 {?} {300.N} 117.026 0.408 0.378 ++ 0.000 {?} 219.18761 4.58160 0 {?} 0 503 {300.HN} 7.824 0.054 0.054 ++ 0.000 {?} {299.HG11} 0.711 0.089 0.089 ? 0.000 {?} {300.N} 117.034 0.173 0.173 ++ 0.000 {?} 188.17599 3.01490 0 {?} 0 504 {321.HN} 8.359 0.061 0.061 ++ 0.000 {?} {319.HA} 3.604 0.153 0.149 ++ 0.000 {?} {321.N} 116.844 0.343 0.336 ++ 0.000 {?} 362.09940 4.88870 0 {?} 0 505 {321.HN} 8.357 0.047 0.047 ++ 0.000 {?} {320.HB1} 2.765 0.114 0.114 ? 0.000 {?} {321.N} 116.860 0.261 0.261 ++ 0.000 {?} 319.21851 3.73030 0 {?} 0 506 {321.HN} 8.358 0.051 0.051 ++ 0.000 {?} {321.HB2} 2.244 0.248 0.138 ++ 0.000 {?} {321.N} 116.847 0.232 0.232 ++ 0.000 {?} 235.27251 3.40390 0 {?} 0 507 {303.HN} 7.732 0.042 0.046 ++ 0.000 {?} {302.HB2} 1.852 0.126 0.155 ? 0.000 {?} {303.N} 116.844 0.402 0.434 ++ 0.000 {?} 683.63782 5.45630 0 {?} 0 508 {303.HN} 7.732 0.052 0.052 ++ 0.000 {?} {303.HD21} 0.612 0.103 0.103 ? 0.000 {?} {303.N} 116.847 0.194 0.194 ++ 0.000 {?} 231.76210 3.03030 0 {?} 0 509 {303.HN} 7.726 0.049 0.049 ? 0.000 {?} {302.HB1} 2.195 0.101 0.101 ++ 0.000 {?} {303.N} 116.850 0.042 0.042 ? 0.000 {?} 82.10240 2.59200 0 {?} 0 510 {321.HN} 8.360 0.052 0.052 ++ 0.000 {?} {320.HA} 5.026 0.122 0.122 ++ 0.000 {?} {321.N} 116.821 0.214 0.214 ++ 0.000 {?} 242.93401 3.09860 0 {?} 0 511 {321.HN} 8.359 0.054 0.058 ++ 0.000 {?} {321.HA} 4.722 0.118 0.129 ++ 0.000 {?} {321.N} 116.833 0.398 0.430 ++ 0.000 {?} 650.87079 5.50100 0 {?} 0 512 {321.HN} 8.357 0.045 0.045 ++ 0.000 {?} {321.HB1} 2.660 0.104 0.104 ? 0.000 {?} {321.N} 116.831 0.296 0.296 ++ 0.000 {?} 330.16879 3.94520 0 {?} 0 513 {321.HN} 8.358 0.075 0.066 ++ 0.000 {?} {320.HB2} 2.469 0.127 0.127 ++ 0.000 {?} {321.N} 116.841 0.341 0.294 ++ 0.000 {?} 329.34839 4.29060 0 {?} 0 514 {321.HN} 8.359 0.046 0.050 ++ 0.000 {?} {363.HB} 1.635 0.116 0.125 ++ 0.000 {?} {321.N} 116.840 0.384 0.417 ++ 0.000 {?} 644.99921 5.53470 0 {?} 0 515 {321.HN} 8.359 0.038 0.056 ++ 0.000 {?} {304.HD11} 0.917 0.082 0.141 ? 0.000 {?} {321.N} 116.837 0.414 0.632 ++ 0.000 {?} 377.31760 3.93260 0 {?} 0 516 {303.HN} 7.728 0.046 0.055 ++ 0.000 {?} {302.HA} 4.192 0.134 0.194 ++ 0.000 {?} {303.N} 116.835 0.407 0.482 ++ 0.000 {?} 955.03711 6.33040 0 {?} 0 517 {303.HN} 7.729 0.044 0.064 ++ 0.000 {?} {303.HG} 1.702 0.115 0.172 ? 0.000 {?} {303.N} 116.835 0.403 0.624 ++ 0.000 {?} 1275.70459 10.49470 0 {?} 0 518 {303.HN} 7.730 0.061 0.057 ++ 0.000 {?} {303.HB2} 1.299 0.162 0.153 ++ 0.000 {?} {303.N} 116.834 0.395 0.370 ++ 0.000 {?} 317.30130 4.66220 0 {?} 0 519 {303.HN} 7.730 0.055 0.058 ++ 0.000 {?} {303.HD11} 0.729 0.129 0.158 ? 0.000 {?} {303.N} 116.836 0.419 0.444 ++ 0.000 {?} 870.39587 5.38630 0 {?} 0 520 {314.HN} 7.797 0.047 0.078 ++ 0.000 {?} {313.HA} 4.849 0.087 0.158 ++ 0.000 {?} {314.N} 116.545 0.435 0.746 ? 0.000 {?} 1785.40845 16.96270 0 {?} 0 521 {314.HN} 7.795 0.041 0.047 ++ 0.000 {?} {314.HA} 4.447 0.090 0.106 ++ 0.000 {?} {314.N} 116.534 0.463 0.521 ++ 0.000 {?} 608.49579 6.03730 0 {?} 0 522 {385.HN} 9.135 0.041 0.038 ++ 0.000 {?} {383.HG21} 0.692 0.128 0.106 ++ 0.000 {?} {385.N} 116.405 0.417 0.379 ++ 0.000 {?} 183.34660 4.51560 0 {?} 0 523 {385.HN} 9.131 0.050 0.050 ++ 0.000 {?} {385.HA} 3.982 0.118 0.118 ++ 0.000 {?} {385.N} 116.370 0.069 0.069 ? 0.000 {?} 81.24230 2.64720 0 {?} 0 524 {385.HN} 9.136 0.062 0.062 ++ 0.000 {?} {385.HB1} 2.654 0.177 0.177 ++ 0.000 {?} {385.N} 116.388 0.246 0.246 ++ 0.000 {?} 420.09698 3.44420 0 {?} 0 525 {385.HN} 9.136 0.062 0.062 ++ 0.000 {?} {385.HG2} 2.409 0.133 0.133 ++ 0.000 {?} {385.N} 116.364 0.338 0.338 ++ 0.000 {?} 520.41852 3.58560 0 {?} 0 526 {385.HN} 9.134 0.051 0.051 ++ 0.000 {?} {385.HB2} 1.638 0.136 0.136 ++ 0.000 {?} {385.N} 116.440 0.267 0.267 ++ 0.000 {?} 336.11591 3.60750 0 {?} 0 527 {385.HN} 9.135 0.045 0.047 ++ 0.000 {?} {280.HD11} 0.937 0.111 0.116 ++ 0.000 {?} {385.N} 116.387 0.393 0.414 ++ 0.000 {?} 598.68237 5.32540 0 {?} 0 528 {349.HN} 8.798 0.044 0.044 ++ 0.000 {?} {348.HA} 4.048 0.147 0.147 ++ 0.000 {?} {349.N} 116.066 0.166 0.166 ++ 0.000 {?} 186.13901 2.93620 0 {?} 0 529 {349.HN} 8.798 0.039 0.044 ++ 0.000 {?} {349.HA} 3.776 0.087 0.103 ++ 0.000 {?} {349.N} 116.089 0.432 0.481 ++ 0.000 {?} 503.43481 5.90180 0 {?} 0 530 {349.HN} 8.798 0.041 0.042 ++ 0.000 {?} {348.HB1} 1.901 0.111 0.144 ? 0.000 {?} {349.N} 116.084 0.425 0.437 ++ 0.000 {?} 582.20868 5.21250 0 {?} 0 531 {349.HN} 8.796 0.040 0.043 ++ 0.000 {?} {348.HB2} 1.792 0.113 0.125 ? 0.000 {?} {349.N} 116.085 0.443 0.471 ++ 0.000 {?} 650.59479 5.50380 0 {?} 0 532 {349.HN} 8.797 0.040 0.047 ++ 0.000 {?} {349.HB1} 1.141 0.099 0.122 ++ 0.000 {?} {349.N} 116.082 0.440 0.514 ++ 0.000 {?} 667.41382 6.54660 0 {?} 0 533 {349.HN} 8.798 0.041 0.047 ++ 0.000 {?} {349.HB2} 0.676 0.098 0.112 ++ 0.000 {?} {349.N} 116.079 0.437 0.488 ++ 0.000 {?} 599.67041 5.96500 0 {?} 0 534 {327.HN} 8.780 0.033 0.033 ++ 0.000 {?} {326.HG2} 2.115 0.114 0.114 ++ 0.000 {?} {327.N} 116.076 0.152 0.152 ++ 0.000 {?} 111.24500 2.74760 0 {?} 0 535 {327.HN} 8.779 0.044 0.041 ++ 0.000 {?} {326.HB2} 1.581 0.153 0.141 ++ 0.000 {?} {327.N} 116.082 0.452 0.421 ++ 0.000 {?} 294.28241 4.21180 0 {?} 0 536 {327.HN} 8.779 0.043 0.058 ++ 0.000 {?} {326.HA} 4.719 0.096 0.150 ? 0.000 {?} {327.N} 116.080 0.457 0.615 ++ 0.000 {?} 887.67407 8.72980 0 {?} 0 537 {327.HN} 8.779 0.063 0.065 ++ 0.000 {?} {328.HA} 4.533 0.132 0.139 ++ 0.000 {?} {327.N} 116.087 0.418 0.430 ++ 0.000 {?} 738.89783 5.22580 0 {?} 0 538 {327.HN} 8.779 0.042 0.039 ++ 0.000 {?} {326.HB1} 2.264 0.087 0.087 ++ 0.000 {?} {327.N} 116.079 0.438 0.403 ++ 0.000 {?} 249.81670 4.48630 0 {?} 0 539 {310.HN} 9.363 0.054 0.054 ? 0.000 {?} {316.HA} 5.581 0.100 0.100 ++ 0.000 {?} {310.N} 115.992 0.062 0.062 ? 0.000 {?} 62.89450 2.60270 0 {?} 0 540 {310.HN} 9.364 0.044 0.069 ++ 0.000 {?} {309.HA} 5.287 0.084 0.142 ++ 0.000 {?} {310.N} 115.970 0.426 0.655 ++ 0.000 {?} 1110.80701 11.76970 0 {?} 0 541 {310.HN} 9.366 0.062 0.062 ++ 0.000 {?} {310.HA} 4.903 0.082 0.083 ++ 0.000 {?} {310.N} 115.972 0.399 0.401 ++ 0.000 {?} 401.78641 3.99890 0 {?} 0 542 {310.HN} 9.363 0.060 0.060 ++ 0.000 {?} {309.HB1} 1.663 0.123 0.123 ++ 0.000 {?} {310.N} 115.973 0.081 0.081 ++ 0.000 {?} 94.21010 2.64780 0 {?} 0 543 {310.HN} 9.364 0.041 0.046 ++ 0.000 {?} {309.HB2} 1.328 0.056 0.128 ? 0.000 {?} {310.N} 115.960 0.415 0.470 ++ 0.000 {?} 418.14029 5.91650 0 {?} 0 544 {310.HN} 9.366 0.039 0.046 ++ 0.000 {?} {310.HG21} 1.244 0.073 0.091 ? 0.000 {?} {310.N} 115.978 0.458 0.538 ++ 0.000 {?} 600.53943 6.42040 0 {?} 0 545 {310.HN} 9.364 0.045 0.060 ++ 0.000 {?} {309.HD21} 0.740 0.097 0.143 ++ 0.000 {?} {310.N} 115.976 0.443 0.597 ++ 0.000 {?} 941.27942 8.50900 0 {?} 0 546 {352.HN} 7.892 0.035 0.046 ++ 0.000 {?} {351.HA} 4.895 0.093 0.123 ++ 0.000 {?} {352.N} 115.738 0.423 0.534 ++ 0.000 {?} 622.83740 7.86520 0 {?} 0 547 {352.HN} 7.893 0.057 0.053 ++ 0.000 {?} {352.HA} 4.543 0.105 0.105 ++ 0.000 {?} {352.N} 115.745 0.436 0.409 ++ 0.000 {?} 326.17249 4.63130 0 {?} 0 548 {352.HN} 7.893 0.040 0.057 ++ 0.000 {?} {347.HA} 4.156 0.078 0.120 ++ 0.000 {?} {352.N} 115.737 0.428 0.613 ++ 0.000 {?} 800.55029 9.98850 0 {?} 0 549 {352.HN} 7.894 0.050 0.050 ++ 0.000 {?} {352.HG1} 2.367 0.122 0.122 ++ 0.000 {?} {352.N} 115.747 0.137 0.137 ++ 0.000 {?} 114.54790 2.77070 0 {?} 0 550 {352.HN} 7.892 0.051 0.051 ++ 0.000 {?} {352.HB1} 2.072 0.069 0.123 ? 0.000 {?} {352.N} 115.740 0.442 0.436 ++ 0.000 {?} 339.62671 4.91420 0 {?} 0 551 {352.HN} 7.893 0.060 0.060 ++ 0.000 {?} {352.HG2} 1.967 0.097 0.097 ? 0.000 {?} {352.N} 115.746 0.295 0.217 ++ 0.000 {?} 197.54370 3.32970 0 {?} 0 552 {352.HN} 7.893 0.061 0.061 ++ 0.000 {?} {352.HB2} 1.677 0.149 0.137 ++ 0.000 {?} {352.N} 115.736 0.475 0.444 ++ 0.000 {?} 447.08621 4.61420 0 {?} 0 553 {288.HN} 7.584 0.020 0.033 ++ 0.000 {?} {284.HA} 4.332 0.050 0.086 ++ 0.000 {?} {288.N} 115.447 0.501 0.860 ++ 0.000 {?} 43.01170 1.02600 0 {?} 0 554 {302.HN} 7.286 0.045 0.060 ++ 0.000 {?} {302.HA} 4.179 0.084 0.200 ? 0.000 {?} {302.N} 115.429 0.384 0.498 ++ 0.000 {?} 688.88062 7.68310 0 {?} 0 555 {302.HN} 7.287 0.057 0.057 ++ 0.000 {?} {299.HA} 3.170 0.133 0.133 ++ 0.000 {?} {302.N} 115.464 0.216 0.216 ++ 0.000 {?} 221.08020 3.01390 0 {?} 0 556 {302.HN} 7.286 0.049 0.061 ++ 0.000 {?} {302.HG1} 2.287 0.082 0.137 ? 0.000 {?} {302.N} 115.420 0.389 0.490 ++ 0.000 {?} 714.19781 7.08200 0 {?} 0 557 {302.HN} 7.287 0.068 0.082 ++ 0.000 {?} {302.HB1} 2.198 0.090 0.125 ? 0.000 {?} {302.N} 115.437 0.412 0.485 ++ 0.000 {?} 875.77100 6.46010 0 {?} 0 558 {302.HN} 7.287 0.047 0.068 ++ 0.000 {?} {301.HB1} 1.984 0.097 0.118 ? 0.000 {?} {302.N} 115.432 0.379 0.500 ++ 0.000 {?} 865.33472 7.98360 0 {?} 0 559 {302.HN} 7.287 0.044 0.057 ++ 0.000 {?} {302.HB2} 1.851 0.111 0.200 ? 0.000 {?} {302.N} 115.422 0.387 0.495 ++ 0.000 {?} 870.55420 7.20830 0 {?} 0 560 {302.HN} 7.287 0.036 0.027 ++ 0.000 {?} {301.HD1} 1.714 0.111 0.111 ? 0.000 {?} {302.N} 115.436 0.286 0.286 ++ 0.000 {?} 181.98801 3.86980 0 {?} 0 561 {387.HN} 7.370 0.052 0.052 ++ 0.000 {?} {387.HA} 5.016 0.132 0.136 ++ 0.000 {?} {387.N} 115.346 0.416 0.421 ++ 0.000 {?} 627.73969 5.06680 0 {?} 0 562 {387.HN} 7.368 0.040 0.063 ++ 0.000 {?} {387.HB1} 2.757 0.087 0.150 ++ 0.000 {?} {387.N} 115.357 0.440 0.667 ++ 0.000 {?} 1173.50293 11.90380 0 {?} 0 563 {387.HN} 7.369 0.044 0.047 ++ 0.000 {?} {387.HB2} 2.207 0.104 0.112 ++ 0.000 {?} {387.N} 115.364 0.431 0.461 ++ 0.000 {?} 607.04742 5.49830 0 {?} 0 564 {387.HN} 7.368 0.048 0.048 ++ 0.000 {?} {278.HG21} 0.940 0.072 0.099 ? 0.000 {?} {387.N} 115.364 0.343 0.343 ++ 0.000 {?} 333.58249 4.10710 0 {?} 0 565 {387.HN} 7.367 0.056 0.056 ++ 0.000 {?} {279.HG11} 0.770 0.088 0.088 ? 0.000 {?} {387.N} 115.367 0.485 0.482 ++ 0.000 {?} 548.56567 4.96510 0 {?} 0 566 {387.HN} 7.366 0.071 0.059 ++ 0.000 {?} {386.HA} 4.583 0.170 0.146 ++ 0.000 {?} {387.N} 115.363 0.463 0.396 ++ 0.000 {?} 343.21490 4.12800 0 {?} 0 567 {387.HN} 7.365 0.055 0.055 ++ 0.000 {?} {386.HB2} 1.966 0.153 0.153 ++ 0.000 {?} {387.N} 115.340 0.292 0.292 ++ 0.000 {?} 421.31271 3.72770 0 {?} 0 568 {387.HN} 7.364 0.056 0.056 ++ 0.000 {?} {386.HG} 1.208 0.115 0.115 ++ 0.000 {?} {387.N} 115.356 0.200 0.200 ++ 0.000 {?} 238.61980 2.95260 0 {?} 0 569 {302.HN} 7.285 0.055 0.049 ++ 0.000 {?} {301.HA} 4.055 0.106 0.106 ? 0.000 {?} {302.N} 115.405 0.431 0.376 ++ 0.000 {?} 290.41110 4.36210 0 {?} 0 570 {346.HN} 8.972 0.066 0.066 ++ 0.000 {?} {345.HB1} 3.268 0.170 0.170 ++ 0.000 {?} {346.N} 115.282 0.351 0.351 ++ 0.000 {?} 590.24042 3.72280 0 {?} 0 571 {346.HN} 8.971 0.062 0.062 ++ 0.000 {?} {346.HA} 3.803 0.172 0.133 ++ 0.000 {?} {346.N} 115.280 0.309 0.309 ++ 0.000 {?} 317.18011 3.49060 0 {?} 0 572 {346.HN} 8.971 0.037 0.047 ++ 0.000 {?} {346.HB1} 3.083 0.137 0.244 ? 0.000 {?} {346.N} 115.276 0.455 0.563 ++ 0.000 {?} 1010.02972 7.22790 0 {?} 0 573 {346.HN} 8.971 0.061 0.051 ++ 0.000 {?} {346.HB2} 2.898 0.145 0.119 ? 0.000 {?} {346.N} 115.278 0.350 0.350 ++ 0.000 {?} 323.20370 4.05050 0 {?} 0 574 {352.HE21} 7.545 0.053 0.053 ++ 0.000 {?} {352.HG2} 1.943 0.165 0.165 ++ 0.000 {?} {352.NE2} 115.245 0.240 0.240 ++ 0.000 {?} 308.77191 3.39680 0 {?} 0 575 {352.HE21} 7.546 0.044 0.044 ++ 0.000 {?} {352.HG1} 2.357 0.132 0.132 ++ 0.000 {?} {352.NE2} 115.285 0.072 0.072 ? 0.000 {?} 77.64030 2.62630 0 {?} 0 576 {?} 8.113 0.070 0.070 ++ 0.000 {?} {?} 4.011 0.138 0.138 ++ 0.000 {?} {?} 114.582 0.200 0.200 ++ 0.000 {?} 230.59680 2.95640 0 {?} 0 577 {327.HD22} 6.701 0.058 0.058 ? 0.000 {?} {327.HB2} 2.773 0.156 0.156 ? 0.000 {?} {327.ND2} 114.349 0.015 0.015 ? 0.000 {?} 86.15110 2.45650 0 {?} 0 578 {285.HD21} 7.556 0.059 0.048 ++ 0.000 {?} {285.HB1} 2.763 0.072 0.137 ? 0.000 {?} {285.ND2} 113.985 0.311 0.311 ++ 0.000 {?} 207.85500 3.94160 0 {?} 0 579 {285.HD21} 7.556 0.050 0.050 ++ 0.000 {?} {285.HB2} 2.662 0.111 0.111 ? 0.000 {?} {285.ND2} 113.972 0.147 0.147 ++ 0.000 {?} 160.39349 2.88580 0 {?} 0 580 {285.HD22} 7.065 0.045 0.045 ++ 0.000 {?} {285.HB1} 2.761 0.150 0.150 ++ 0.000 {?} {285.ND2} 113.981 0.307 0.307 ++ 0.000 {?} 443.01639 3.99740 0 {?} 0 581 {278.HN} 9.123 0.000 0.029 ? 0.000 {?} {277.HB1} 2.271 0.068 0.068 ? 0.000 {?} {278.N} 113.800 0.002 0.002 ? 0.000 {?} 0.00000 2.43650 0 {?} 0 582 {375.HN} 7.889 0.035 0.042 ++ 0.000 {?} {375.HB} 4.175 0.078 0.155 ? 0.000 {?} {375.N} 113.813 0.333 0.408 ++ 0.000 {?} 415.49500 6.66140 0 {?} 0 583 {375.HN} 7.890 0.033 0.041 ++ 0.000 {?} {375.HG21} 1.234 0.089 0.113 ++ 0.000 {?} {375.N} 113.814 0.383 0.489 ++ 0.000 {?} 487.33939 7.07440 0 {?} 0 584 {278.HN} 9.123 0.048 0.048 ++ 0.000 {?} {281.HB1} 3.145 0.119 0.119 ++ 0.000 {?} {278.N} 113.786 0.180 0.180 ++ 0.000 {?} 206.29449 2.98350 0 {?} 0 585 {278.HN} 9.123 0.041 0.041 ++ 0.000 {?} {277.HG1} 2.457 0.106 0.106 ++ 0.000 {?} {278.N} 113.778 0.117 0.117 ++ 0.000 {?} 63.16590 2.63110 0 {?} 0 586 {278.HN} 9.123 0.047 0.072 ++ 0.000 {?} {277.HA} 4.751 0.097 0.200 ++ 0.000 {?} {278.N} 113.786 0.445 0.653 ++ 0.000 {?} 1184.40381 10.23770 0 {?} 0 587 {278.HN} 9.123 0.048 0.048 ++ 0.000 {?} {281.HB2} 2.853 0.132 0.132 ++ 0.000 {?} {278.N} 113.774 0.193 0.193 ++ 0.000 {?} 217.86330 2.90520 0 {?} 0 588 {278.HN} 9.123 0.052 0.066 ++ 0.000 {?} {278.HG21} 0.927 0.109 0.136 ++ 0.000 {?} {278.N} 113.773 0.448 0.528 ++ 0.000 {?} 844.56427 6.57080 0 {?} 0 589 {375.HN} 7.891 0.033 0.040 ++ 0.000 {?} {375.HA} 4.352 0.075 0.092 ++ 0.000 {?} {375.N} 113.808 0.339 0.405 ++ 0.000 {?} 397.53781 6.49800 0 {?} 0 590 {375.HN} 7.890 0.054 0.080 ++ 0.000 {?} {374.HA1} 4.049 0.067 0.094 ? 0.000 {?} {375.N} 113.803 0.355 0.526 ++ 0.000 {?} 714.24579 10.11930 0 {?} 0 591 {375.HN} 7.891 0.032 0.048 ++ 0.000 {?} {374.HA2} 3.973 0.087 0.111 ? 0.000 {?} {375.N} 113.804 0.340 0.509 ++ 0.000 {?} 705.55579 10.71080 0 {?} 0 592 {393.HN} 8.194 0.026 0.050 ++ 0.000 {?} {306.HA} 4.382 0.063 0.120 ++ 0.000 {?} {393.N} 113.188 0.364 0.679 ++ 0.000 {?} 96.21600 1.98860 0 {?} 0 593 {393.HN} 8.195 0.038 0.075 ++ 0.000 {?} {393.HA} 4.570 0.077 0.212 ? 0.000 {?} {393.N} 113.191 0.362 0.743 ++ 0.000 {?} 2475.07495 35.78930 0 {?} 0 594 {393.HN} 8.196 0.036 0.058 ++ 0.000 {?} {392.HB2} 1.553 0.083 0.139 ? 0.000 {?} {393.N} 113.188 0.355 0.532 ++ 0.000 {?} 797.88379 10.87570 0 {?} 0 595 {393.HN} 8.196 0.038 0.056 ++ 0.000 {?} {393.HG21} 1.196 0.078 0.117 ++ 0.000 {?} {393.N} 113.189 0.381 0.528 ++ 0.000 {?} 669.25861 9.16880 0 {?} 0 596 {393.HN} 8.195 0.051 0.072 ++ 0.000 {?} {392.HD21} 0.891 0.034 0.110 ? 0.000 {?} {393.N} 113.195 0.377 0.507 ++ 0.000 {?} 262.32809 8.12630 0 {?} 0 597 {393.HN} 8.197 0.055 0.055 ++ 0.000 {?} {393.HB} 4.222 0.113 0.115 ++ 0.000 {?} {393.N} 113.182 0.350 0.356 ++ 0.000 {?} 536.28607 5.10440 0 {?} 0 598 {393.HN} 8.195 0.039 0.037 ++ 0.000 {?} {392.HB1} 1.711 0.151 0.155 ? 0.000 {?} {393.N} 113.185 0.336 0.320 ++ 0.000 {?} 306.60580 4.69800 0 {?} 0 599 {290.HN} 7.399 0.069 0.062 ++ 0.000 {?} {290.HA} 4.464 0.068 0.123 ? 0.000 {?} {290.N} 113.068 0.448 0.408 ++ 0.000 {?} 259.67361 4.47550 0 {?} 0 600 {290.HN} 7.398 0.054 0.052 ++ 0.000 {?} {289.HA} 4.360 0.095 0.092 ? 0.000 {?} {290.N} 113.082 0.403 0.385 ++ 0.000 {?} 222.01140 4.75810 0 {?} 0 601 {290.HN} 7.395 0.066 0.059 ++ 0.000 {?} {290.HG21} 1.207 0.173 0.150 ++ 0.000 {?} {290.N} 113.085 0.341 0.341 ++ 0.000 {?} 371.99179 4.30740 0 {?} 0 602 {398.HD21} 7.649 0.060 0.060 ++ 0.000 {?} {398.HB2} 2.712 0.184 0.143 ++ 0.000 {?} {398.ND2} 112.985 0.283 0.283 ++ 0.000 {?} 266.29471 3.96280 0 {?} 0 603 {386.HN} 8.043 0.060 0.060 ++ 0.000 {?} {278.HG21} 0.927 0.119 0.128 ? 0.000 {?} {386.N} 112.479 0.147 0.147 ++ 0.000 {?} 174.68449 2.98110 0 {?} 0 604 {386.HN} 8.044 0.067 0.067 ++ 0.000 {?} {386.HA} 4.573 0.199 0.167 ++ 0.000 {?} {386.N} 112.446 0.460 0.390 ++ 0.000 {?} 457.55051 4.21040 0 {?} 0 605 {386.HN} 8.045 0.052 0.052 ++ 0.000 {?} {387.HB1} 2.753 0.123 0.123 ++ 0.000 {?} {386.N} 112.452 0.257 0.257 ++ 0.000 {?} 294.73700 3.48400 0 {?} 0 606 {386.HN} 8.046 0.045 0.049 ++ 0.000 {?} {386.HG} 1.198 0.090 0.104 ++ 0.000 {?} {386.N} 112.450 0.446 0.496 ++ 0.000 {?} 635.66870 5.78480 0 {?} 0 607 {386.HN} 8.044 0.042 0.044 ++ 0.000 {?} {386.HD21} 0.816 0.155 0.200 ? 0.000 {?} {386.N} 112.458 0.384 0.401 ++ 0.000 {?} 797.62299 5.29170 0 {?} 0 608 {386.HN} 8.046 0.045 0.044 ++ 0.000 {?} {383.HG21} 0.692 0.111 0.111 ? 0.000 {?} {386.N} 112.448 0.424 0.413 ++ 0.000 {?} 372.80341 4.84990 0 {?} 0 609 {386.HN} 8.047 0.054 0.054 ++ 0.000 {?} {386.HD11} 0.271 0.122 0.122 ++ 0.000 {?} {386.N} 112.462 0.175 0.175 ++ 0.000 {?} 193.06911 3.09620 0 {?} 0 610 {386.HN} 8.043 0.037 0.041 ++ 0.000 {?} {386.HB2} 1.979 0.122 0.142 ++ 0.000 {?} {386.N} 112.449 0.436 0.480 ++ 0.000 {?} 708.54633 5.73920 0 {?} 0 611 {386.HN} 8.042 0.057 0.057 ++ 0.000 {?} {383.HB} 1.664 0.147 0.147 ++ 0.000 {?} {386.N} 112.436 0.264 0.264 ++ 0.000 {?} 338.41479 3.30560 0 {?} 0 612 {351.HD21} 7.625 0.033 0.036 ++ 0.000 {?} {351.HB1} 3.239 0.075 0.081 ++ 0.000 {?} {351.ND2} 112.166 0.435 0.460 ++ 0.000 {?} 335.84821 5.47280 0 {?} 0 613 {351.HD21} 7.626 0.033 0.026 ++ 0.000 {?} {351.HB2} 2.790 0.085 0.069 ++ 0.000 {?} {351.ND2} 112.166 0.445 0.364 ++ 0.000 {?} 89.61150 3.92940 0 {?} 0 614 {349.HE21} 7.053 0.062 0.062 ++ 0.000 {?} {349.HG1} 1.632 0.132 0.132 ++ 0.000 {?} {349.NE2} 112.185 0.123 0.123 ++ 0.000 {?} 80.44000 2.78440 0 {?} 0 615 {349.HE21} 7.055 0.064 0.049 ++ 0.000 {?} {349.HG2} 0.993 0.149 0.115 ++ 0.000 {?} {349.NE2} 112.169 0.349 0.349 ++ 0.000 {?} 253.44479 3.82020 0 {?} 0 616 {351.HD22} 6.875 0.037 0.037 ++ 0.000 {?} {351.HB1} 3.235 0.212 0.153 ++ 0.000 {?} {351.ND2} 112.165 0.274 0.274 ++ 0.000 {?} 187.09019 3.48230 0 {?} 0 617 {351.HD22} 6.872 0.044 0.044 ++ 0.000 {?} {351.HB2} 2.796 0.114 0.114 ++ 0.000 {?} {351.ND2} 112.161 0.239 0.239 ++ 0.000 {?} 187.02190 3.19870 0 {?} 0 618 {349.HE22} 6.810 0.050 0.050 ++ 0.000 {?} {349.HG2} 0.992 0.148 0.148 ++ 0.000 {?} {349.NE2} 112.173 0.262 0.262 ++ 0.000 {?} 260.52441 3.34560 0 {?} 0 619 {289.HE21} 7.318 0.057 0.055 ++ 0.000 {?} {289.HG1} 2.257 0.133 0.128 ++ 0.000 {?} {289.NE2} 111.974 0.405 0.391 ++ 0.000 {?} 278.55051 4.77670 0 {?} 0 620 {289.HE22} 6.726 0.060 0.060 ++ 0.000 {?} {289.HG1} 2.253 0.153 0.153 ++ 0.000 {?} {289.NE2} 111.986 0.216 0.216 ++ 0.000 {?} 267.93930 3.11050 0 {?} 0 621 {?} 7.731 0.039 0.046 ++ 0.000 {?} {?} 2.385 0.106 0.124 ++ 0.000 {?} {?} 111.861 0.403 0.473 ++ 0.000 {?} 655.58862 6.33440 0 {?} 0 622 {312.HN} 6.927 0.054 0.058 ++ 0.000 {?} {352.HG1} 2.384 0.170 0.183 ++ 0.000 {?} {312.N} 111.883 0.439 0.467 ++ 0.000 {?} 789.08728 5.41570 0 {?} 0 623 {314.HD21} 7.555 0.049 0.054 ++ 0.000 {?} {314.HB1} 3.081 0.159 0.178 ++ 0.000 {?} {314.ND2} 111.817 0.492 0.542 ++ 0.000 {?} 721.35822 5.79580 0 {?} 0 624 {314.HD21} 7.555 0.057 0.054 ++ 0.000 {?} {314.HB2} 2.638 0.129 0.119 ++ 0.000 {?} {314.ND2} 111.805 0.443 0.417 ++ 0.000 {?} 263.77191 4.60530 0 {?} 0 625 {312.HN} 6.928 0.034 0.039 ++ 0.000 {?} {312.HA} 4.602 0.104 0.125 ++ 0.000 {?} {312.N} 111.817 0.435 0.491 ++ 0.000 {?} 536.74573 6.03230 0 {?} 0 626 {312.HN} 6.929 0.045 0.045 ++ 0.000 {?} {312.HB1} 3.066 0.106 0.106 ++ 0.000 {?} {312.N} 111.822 0.189 0.189 ++ 0.000 {?} 177.09230 3.00280 0 {?} 0 627 {312.HN} 6.928 0.055 0.055 ++ 0.000 {?} {312.HB2} 2.768 0.149 0.130 ++ 0.000 {?} {312.N} 111.835 0.347 0.347 ++ 0.000 {?} 457.96231 4.44640 0 {?} 0 628 {312.HN} 6.925 0.052 0.052 ++ 0.000 {?} {311.HA} 4.082 0.136 0.136 ++ 0.000 {?} {312.N} 111.819 0.092 0.092 ++ 0.000 {?} 69.70110 2.73360 0 {?} 0 629 {312.HN} 6.925 0.042 0.042 ++ 0.000 {?} {310.HB} 3.373 0.123 0.123 ++ 0.000 {?} {312.N} 111.828 0.311 0.311 ++ 0.000 {?} 317.38690 3.92750 0 {?} 0 630 {?} 6.928 0.058 0.058 ++ 0.000 {?} {?} 2.043 0.081 0.115 ? 0.000 {?} {?} 111.838 0.163 0.163 ++ 0.000 {?} 160.18700 2.87560 0 {?} 0 631 {312.HN} 6.927 0.046 0.046 ? 0.000 {?} {352.HG2} 1.959 0.110 0.110 ? 0.000 {?} {312.N} 111.808 0.101 0.101 ++ 0.000 {?} 88.60540 2.68230 0 {?} 0 632 {312.HN} 6.926 0.048 0.039 ++ 0.000 {?} {311.HB2} 1.699 0.132 0.132 ++ 0.000 {?} {312.N} 111.820 0.290 0.290 ++ 0.000 {?} 248.07600 3.64300 0 {?} 0 633 {312.HN} 6.926 0.051 0.051 ++ 0.000 {?} {311.HG1} 1.233 0.142 0.126 ++ 0.000 {?} {312.N} 111.808 0.474 0.429 ++ 0.000 {?} 363.82431 4.39600 0 {?} 0 634 {314.HD22} 6.757 0.065 0.061 ++ 0.000 {?} {314.HB1} 3.073 0.152 0.152 ++ 0.000 {?} {314.ND2} 111.838 0.337 0.337 ++ 0.000 {?} 414.37030 4.59250 0 {?} 0 635 {314.HD22} 6.758 0.057 0.057 ++ 0.000 {?} {314.HB2} 2.633 0.210 0.143 ++ 0.000 {?} {314.ND2} 111.817 0.293 0.293 ++ 0.000 {?} 276.76501 3.56070 0 {?} 0 636 {298.HE21} 7.664 0.042 0.042 ++ 0.000 {?} {298.HG1} 2.615 0.152 0.152 ++ 0.000 {?} {298.NE2} 111.723 0.355 0.355 ++ 0.000 {?} 439.47610 3.89460 0 {?} 0 637 {298.HE21} 7.664 0.055 0.051 ++ 0.000 {?} {298.HG2} 2.473 0.131 0.131 ++ 0.000 {?} {298.NE2} 111.691 0.357 0.357 ++ 0.000 {?} 388.37619 4.44870 0 {?} 0 638 {298.HE22} 6.986 0.048 0.048 ++ 0.000 {?} {298.HG1} 2.618 0.118 0.118 ++ 0.000 {?} {298.NE2} 111.703 0.144 0.144 ++ 0.000 {?} 123.36050 2.79540 0 {?} 0 639 {298.HE22} 6.986 0.036 0.036 ++ 0.000 {?} {298.HG2} 2.467 0.115 0.115 ++ 0.000 {?} {298.NE2} 111.681 0.080 0.080 ++ 0.000 {?} 64.98980 2.80320 0 {?} 0 640 {329.HN} 8.467 0.041 0.058 ++ 0.000 {?} {329.HA} 4.496 0.122 0.176 ? 0.000 {?} {329.N} 111.456 0.441 0.620 ++ 0.000 {?} 1205.11255 9.43700 0 {?} 0 641 {329.HN} 8.468 0.053 0.053 ++ 0.000 {?} {329.HE1} 3.120 0.153 0.153 ++ 0.000 {?} {329.N} 111.471 0.082 0.082 ++ 0.000 {?} 87.61680 2.67460 0 {?} 0 642 {329.HN} 8.467 0.042 0.066 ++ 0.000 {?} {329.HB1} 2.089 0.097 0.244 ? 0.000 {?} {329.N} 111.458 0.439 0.695 ++ 0.000 {?} 1488.19763 13.88420 0 {?} 0 643 {329.HN} 8.466 0.043 0.058 ++ 0.000 {?} {329.HG1} 1.683 0.155 0.200 ? 0.000 {?} {329.N} 111.465 0.405 0.511 ++ 0.000 {?} 1150.99414 7.51500 0 {?} 0 644 {329.HN} 8.466 0.041 0.047 ++ 0.000 {?} {329.HG2} 1.548 0.098 0.111 ? 0.000 {?} {329.N} 111.453 0.448 0.502 ++ 0.000 {?} 662.20300 5.98650 0 {?} 0 645 {329.HN} 8.464 0.038 0.037 ++ 0.000 {?} {329.HD1} 1.840 0.155 0.157 ? 0.000 {?} {329.N} 111.452 0.448 0.437 ++ 0.000 {?} 436.25900 4.84760 0 {?} 0 646 {390.HN} 8.398 0.045 0.045 ++ 0.000 {?} {390.HB} 4.254 0.105 0.105 ? 0.000 {?} {390.N} 111.234 0.149 0.149 ++ 0.000 {?} 113.52710 2.84620 0 {?} 0 647 {390.HN} 8.398 0.054 0.054 ++ 0.000 {?} {389.HB1} 1.688 0.115 0.120 ? 0.000 {?} {390.N} 111.248 0.284 0.284 ++ 0.000 {?} 366.25461 3.54740 0 {?} 0 648 {390.HN} 8.399 0.047 0.043 ++ 0.000 {?} {389.HB2} 1.572 0.128 0.128 ? 0.000 {?} {390.N} 111.242 0.463 0.430 ++ 0.000 {?} 383.11591 4.60020 0 {?} 0 649 {390.HN} 8.394 0.060 0.060 ++ 0.000 {?} {308.HA} 5.275 0.109 0.109 ++ 0.000 {?} {390.N} 111.247 0.144 0.144 ++ 0.000 {?} 139.06799 2.74460 0 {?} 0 650 {390.HN} 8.396 0.055 0.050 ++ 0.000 {?} {390.HA} 4.582 0.089 0.089 ++ 0.000 {?} {390.N} 111.238 0.400 0.359 ++ 0.000 {?} 241.81520 4.42780 0 {?} 0 651 {390.HN} 8.397 0.033 0.055 ++ 0.000 {?} {389.HA} 4.405 0.057 0.152 ? 0.000 {?} {390.N} 111.253 0.440 0.680 ++ 0.000 {?} 717.20392 12.06740 0 {?} 0 652 {390.HN} 8.397 0.056 0.062 ++ 0.000 {?} {390.HG21} 1.200 0.105 0.116 ++ 0.000 {?} {390.N} 111.243 0.415 0.451 ++ 0.000 {?} 656.72498 5.62300 0 {?} 0 653 {390.HN} 8.397 0.045 0.045 ++ 0.000 {?} {308.HG21} 0.775 0.142 0.142 ++ 0.000 {?} {390.N} 111.232 0.231 0.231 ++ 0.000 {?} 296.04230 3.30900 0 {?} 0 654 {390.HN} 8.397 0.046 0.056 ++ 0.000 {?} {389.HD21} 0.623 0.081 0.099 ++ 0.000 {?} {390.N} 111.246 0.437 0.517 ++ 0.000 {?} 676.28778 6.45650 0 {?} 0 655 {361.HN} 6.300 0.042 0.063 ++ 0.000 {?} {360.HA} 5.147 0.077 0.121 ++ 0.000 {?} {361.N} 110.900 0.422 0.578 ++ 0.000 {?} 803.73853 9.30170 0 {?} 0 656 {361.HN} 6.300 0.049 0.049 ++ 0.000 {?} {361.HA} 3.993 0.221 0.142 ++ 0.000 {?} {361.N} 110.912 0.329 0.329 ++ 0.000 {?} 312.92740 3.50360 0 {?} 0 657 {361.HN} 6.300 0.066 0.060 ++ 0.000 {?} {360.HB1} 1.610 0.114 0.159 ? 0.000 {?} {361.N} 110.914 0.443 0.414 ++ 0.000 {?} 462.48010 4.58300 0 {?} 0 658 {361.HN} 6.300 0.042 0.058 ++ 0.000 {?} {361.HB} 1.427 0.088 0.154 ? 0.000 {?} {361.N} 110.901 0.461 0.629 ++ 0.000 {?} 868.24469 8.59200 0 {?} 0 659 {361.HN} 6.301 0.051 0.055 ++ 0.000 {?} {360.HB2} 0.960 0.128 0.143 ++ 0.000 {?} {361.N} 110.898 0.424 0.461 ++ 0.000 {?} 748.39581 5.66120 0 {?} 0 660 {361.HN} 6.302 0.057 0.057 ++ 0.000 {?} {360.HG1} 0.763 0.164 0.164 ++ 0.000 {?} {361.N} 110.881 0.281 0.281 ++ 0.000 {?} 472.14749 3.89010 0 {?} 0 661 {361.HN} 6.300 0.047 0.047 ++ 0.000 {?} {361.HG11} 0.439 0.165 0.165 ++ 0.000 {?} {361.N} 110.910 0.297 0.297 ++ 0.000 {?} 411.14359 3.28990 0 {?} 0 662 {361.HN} 6.300 0.041 0.051 ++ 0.000 {?} {361.HG21} 0.185 0.082 0.107 ++ 0.000 {?} {361.N} 110.911 0.462 0.568 ++ 0.000 {?} 693.07458 7.02220 0 {?} 0 663 {361.HN} 6.298 0.045 0.045 ++ 0.000 {?} {324.HA} 4.478 0.093 0.093 ++ 0.000 {?} {361.N} 110.904 0.194 0.194 ++ 0.000 {?} 170.15370 2.90530 0 {?} 0 664 {?} 8.401 0.035 0.065 ++ 0.000 {?} {?} 4.429 0.046 0.128 ? 0.000 {?} {?} 110.369 0.420 0.762 ++ 0.000 {?} 1197.26086 24.14760 0 {?} 0 665 {371.HN} 8.401 0.040 0.060 ++ 0.000 {?} {371.HA1} 4.229 0.072 0.134 ? 0.000 {?} {371.N} 110.378 0.421 0.622 ++ 0.000 {?} 830.99902 11.86820 0 {?} 0 666 {371.HN} 8.401 0.033 0.053 ++ 0.000 {?} {371.HA2} 4.076 0.046 0.113 ? 0.000 {?} {371.N} 110.369 0.413 0.633 ++ 0.000 {?} 652.74072 13.24430 0 {?} 0 667 {371.HN} 8.403 0.068 0.048 ++ 0.000 {?} {372.HD1} 3.664 0.214 0.144 ++ 0.000 {?} {371.N} 110.364 0.291 0.291 ++ 0.000 {?} 234.84360 3.58480 0 {?} 0 668 {371.HN} 8.400 0.037 0.047 ++ 0.000 {?} {370.HB1} 1.850 0.065 0.140 ? 0.000 {?} {371.N} 110.366 0.416 0.511 ++ 0.000 {?} 472.33331 7.32770 0 {?} 0 669 {371.HN} 8.402 0.037 0.037 ++ 0.000 {?} {370.HG1} 1.656 0.164 0.129 ? 0.000 {?} {371.N} 110.382 0.346 0.346 ++ 0.000 {?} 301.97510 3.71750 0 {?} 0 670 {391.HN} 8.484 0.063 0.063 ++ 0.000 {?} {392.HB1} 1.689 0.134 0.120 ? 0.000 {?} {391.N} 110.162 0.399 0.358 ++ 0.000 {?} 204.82339 2.56450 0 {?} 0 671 {350.HN} 6.436 0.062 0.059 ++ 0.000 {?} {350.HA} 5.047 0.147 0.139 ++ 0.000 {?} {350.N} 110.204 0.441 0.423 ++ 0.000 {?} 365.62259 4.72490 0 {?} 0 672 {350.HN} 6.435 0.057 0.057 ++ 0.000 {?} {351.HA} 4.894 0.129 0.129 ++ 0.000 {?} {350.N} 110.195 0.351 0.351 ++ 0.000 {?} 453.34851 4.15080 0 {?} 0 673 {350.HN} 6.436 0.059 0.057 ++ 0.000 {?} {349.HA} 3.789 0.150 0.145 ++ 0.000 {?} {350.N} 110.194 0.455 0.441 ++ 0.000 {?} 359.45450 4.80310 0 {?} 0 674 {350.HN} 6.435 0.077 0.058 ++ 0.000 {?} {350.HB1} 3.460 0.146 0.146 ++ 0.000 {?} {350.N} 110.203 0.273 0.273 ++ 0.000 {?} 286.84451 3.43620 0 {?} 0 675 {350.HN} 6.438 0.060 0.060 ++ 0.000 {?} {350.HB2} 2.504 0.158 0.158 ++ 0.000 {?} {350.N} 110.188 0.355 0.355 ++ 0.000 {?} 536.83771 4.22660 0 {?} 0 676 {350.HN} 6.437 0.051 0.051 ? 0.000 {?} {349.HB1} 1.143 0.112 0.112 ++ 0.000 {?} {350.N} 110.192 0.044 0.044 ? 0.000 {?} 66.78700 2.58130 0 {?} 0 677 {350.HN} 6.438 0.063 0.063 ++ 0.000 {?} {349.HB2} 0.677 0.130 0.130 ++ 0.000 {?} {350.N} 110.205 0.440 0.370 ++ 0.000 {?} 343.08691 4.09530 0 {?} 0 678 {391.HN} 8.486 0.043 0.056 ++ 0.000 {?} {390.HA} 4.587 0.088 0.125 ++ 0.000 {?} {391.N} 110.152 0.359 0.481 ++ 0.000 {?} 644.00262 7.93330 0 {?} 0 679 {391.HN} 8.486 0.041 0.049 ++ 0.000 {?} {390.HB} 4.240 0.105 0.166 ? 0.000 {?} {391.N} 110.133 0.401 0.482 ++ 0.000 {?} 757.25531 6.74220 0 {?} 0 680 {391.HN} 8.485 0.041 0.058 ++ 0.000 {?} {391.HA1} 4.136 0.127 0.200 ? 0.000 {?} {391.N} 110.151 0.357 0.517 ++ 0.000 {?} 1106.84119 9.87520 0 {?} 0 681 {391.HN} 8.485 0.042 0.060 ++ 0.000 {?} {391.HA2} 3.971 0.089 0.158 ? 0.000 {?} {391.N} 110.144 0.385 0.564 ++ 0.000 {?} 916.40723 10.30990 0 {?} 0 682 {391.HN} 8.483 0.048 0.048 ++ 0.000 {?} {390.HG21} 1.201 0.131 0.131 ++ 0.000 {?} {391.N} 110.145 0.220 0.220 ++ 0.000 {?} 237.68021 3.32110 0 {?} 0 683 {391.HN} 8.482 0.058 0.058 ++ 0.000 {?} {389.HA} 4.402 0.055 0.118 ? 0.000 {?} {391.N} 110.139 0.257 0.257 ++ 0.000 {?} 178.83369 3.47730 0 {?} 0 684 {?} 6.731 0.072 0.072 ++ 0.000 {?} {?} 0.209 0.191 0.149 ++ 0.000 {?} {?} 109.864 0.271 0.271 ++ 0.000 {?} 313.90390 3.31660 0 {?} 0 685 {?} 6.725 0.057 0.057 ++ 0.000 {?} {?} 1.661 0.146 0.146 ++ 0.000 {?} {?} 109.824 0.149 0.149 ++ 0.000 {?} 216.30800 2.84190 0 {?} 0 686 {326.HE22} 6.209 0.054 0.054 ++ 0.000 {?} {326.HG1} 2.416 0.148 0.148 ++ 0.000 {?} {326.NE2} 109.173 0.247 0.247 ++ 0.000 {?} 305.82220 3.49480 0 {?} 0 687 {326.HE21} 8.048 0.052 0.052 ++ 0.000 {?} {326.HG1} 2.420 0.100 0.100 ++ 0.000 {?} {326.NE2} 109.142 0.282 0.282 ++ 0.000 {?} 226.22620 3.13190 0 {?} 0 688 {337.HN} 8.213 0.056 0.056 ++ 0.000 {?} {336.HA} 4.487 0.098 0.117 ? 0.000 {?} {337.N} 108.821 0.312 0.312 ++ 0.000 {?} 393.02371 4.20520 0 {?} 0 689 {331.HN} 8.041 0.046 0.073 ++ 0.000 {?} {330.HA} 4.524 0.089 0.179 ++ 0.000 {?} {331.N} 108.840 0.487 0.821 ++ 0.000 {?} 1655.29871 13.72120 0 {?} 0 690 {331.HN} 8.040 0.058 0.055 ++ 0.000 {?} {331.HG21} 0.966 0.152 0.152 ++ 0.000 {?} {331.N} 108.855 0.529 0.513 ++ 0.000 {?} 469.50021 4.78770 0 {?} 0 691 {337.HN} 8.213 0.042 0.062 ++ 0.000 {?} {337.HA1} 4.378 0.103 0.175 ? 0.000 {?} {337.N} 108.803 0.394 0.620 ++ 0.000 {?} 1144.41968 11.46740 0 {?} 0 692 {337.HN} 8.212 0.042 0.060 ++ 0.000 {?} {337.HA2} 3.563 0.096 0.159 ++ 0.000 {?} {337.N} 108.807 0.369 0.577 ++ 0.000 {?} 1060.69031 11.99180 0 {?} 0 693 {374.HN} 8.305 0.011 0.068 ? 0.000 {?} {374.HA1} 4.062 0.045 0.132 ? 0.000 {?} {374.N} 108.387 0.385 1.017 ++ 0.000 {?} 225.83611 13.39320 0 {?} 0 694 {374.HN} 8.303 0.057 0.091 ++ 0.000 {?} {374.HA2} 3.987 0.075 0.131 ? 0.000 {?} {374.N} 108.391 0.406 0.716 ++ 0.000 {?} 1517.50476 15.31960 0 {?} 0 695 {316.HN} 7.411 0.052 0.052 ++ 0.000 {?} {316.HA} 5.582 0.148 0.148 ++ 0.000 {?} {316.N} 107.718 0.430 0.368 ++ 0.000 {?} 336.48230 4.25230 0 {?} 0 696 {316.HN} 7.412 0.043 0.079 ++ 0.000 {?} {315.HA} 4.506 0.077 0.174 ++ 0.000 {?} {316.N} 107.711 0.435 0.764 ++ 0.000 {?} 1825.98389 20.33700 0 {?} 0 697 {316.HN} 7.412 0.044 0.047 ++ 0.000 {?} {315.HB1} 1.566 0.133 0.144 ++ 0.000 {?} {316.N} 107.712 0.426 0.460 ++ 0.000 {?} 836.77258 5.60770 0 {?} 0 698 {316.HN} 7.412 0.044 0.061 ++ 0.000 {?} {315.HG1} 1.338 0.105 0.244 ? 0.000 {?} {316.N} 107.713 0.427 0.583 ++ 0.000 {?} 1075.46130 8.96830 0 {?} 0 699 {316.HN} 7.413 0.057 0.057 ++ 0.000 {?} {315.HG2} 1.123 0.062 0.116 ? 0.000 {?} {316.N} 107.709 0.442 0.361 ++ 0.000 {?} 232.75751 4.01800 0 {?} 0 700 {316.HN} 7.411 0.040 0.048 ++ 0.000 {?} {316.HG21} 1.019 0.091 0.118 ? 0.000 {?} {316.N} 107.706 0.453 0.538 ++ 0.000 {?} 664.82172 6.79590 0 {?} 0 701 {316.HN} 7.413 0.050 0.050 ++ 0.000 {?} {309.HD21} 0.763 0.134 0.134 ++ 0.000 {?} {316.N} 107.689 0.181 0.181 ++ 0.000 {?} 208.10539 2.84830 0 {?} 0 702 {378.HN} 8.302 0.029 0.053 ++ 0.000 {?} {377.HA} 4.553 0.047 0.154 ? 0.000 {?} {378.N} 107.583 0.379 0.706 ++ 0.000 {?} 1254.42029 28.60740 0 {?} 0 703 {378.HN} 8.302 0.036 0.056 ++ 0.000 {?} {378.HA1} 4.335 0.095 0.179 ? 0.000 {?} {378.N} 107.591 0.378 0.575 ++ 0.000 {?} 929.08728 12.32330 0 {?} 0 704 {378.HN} 8.302 0.035 0.056 ++ 0.000 {?} {378.HA2} 3.909 0.084 0.244 ? 0.000 {?} {378.N} 107.584 0.380 0.661 ++ 0.000 {?} 1126.32361 15.62010 0 {?} 0 705 {378.HN} 8.300 0.034 0.037 ++ 0.000 {?} {379.HD2} 3.668 0.140 0.150 ++ 0.000 {?} {378.N} 107.576 0.392 0.429 ++ 0.000 {?} 668.69788 5.54750 0 {?} 0 706 {378.HN} 8.301 0.035 0.041 ++ 0.000 {?} {377.HB1} 2.370 0.086 0.105 ++ 0.000 {?} {378.N} 107.587 0.370 0.436 ++ 0.000 {?} 456.30240 6.39920 0 {?} 0 707 {378.HN} 8.301 0.035 0.052 ++ 0.000 {?} {377.HB2} 2.036 0.089 0.149 ++ 0.000 {?} {378.N} 107.588 0.386 0.568 ++ 0.000 {?} 781.14618 10.92370 0 {?} 0 708 {347.HE} 8.066 0.019 0.040 ++ 0.000 {?} {347.HG2} 1.610 0.037 0.107 ? 0.000 {?} {347.NE} 107.595 0.391 1.159 ? 0.000 {?} 43.19410 1.69960 0 {?} 0 709 {347.HE} 8.063 0.072 0.070 ++ 0.000 {?} {347.HD1} 3.200 0.184 0.179 ++ 0.000 {?} {347.NE} 107.593 0.392 0.384 ++ 0.000 {?} 379.71289 4.87040 0 {?} 0 710 {329.HN} 8.467 0.043 0.055 ? 0.000 {?} {330.HN} 8.655 0.083 0.200 ? 0.000 {?} {329.N} 111.446 0.152 0.152 EE 0.000 {?} 466.64420 11.12890 0 {?} 0 711 {329.HN} 8.464 0.032 0.026 ++ 0.000 {?} {327.HN} 8.770 0.067 0.096 ? 0.000 {?} {329.N} 111.446 0.068 0.068 ? 0.000 {?} 30.82210 2.66820 0 {?} 0 712 {323.HN} 9.069 0.050 0.048 ++ 0.000 {?} {322.HB} 1.417 0.130 0.126 ++ 0.000 {?} {323.N} 126.341 0.084 0.084 EE 0.000 {?} 47.89920 2.13700 0 {?} 0 713 {295.HN} 7.566 0.048 0.048 ++ 0.000 {?} {296.HN} 8.413 0.031 0.096 ? 0.000 {?} {295.N} 120.008 0.088 0.088 EE 0.000 {?} 20.19150 2.96010 0 {?} 0 714 {295.HN} 7.565 0.060 0.057 ++ 0.000 {?} {295.HD1} 7.199 0.131 0.125 ++ 0.000 {?} {295.N} 120.008 0.084 0.084 EE 0.000 {?} 73.27740 2.82920 0 {?} 0 715 {321.HN} 8.359 0.042 0.077 ++ 0.000 {?} {320.HN} 9.150 0.055 0.146 ? 0.000 {?} {321.N} 116.787 0.156 0.156 EE 0.000 {?} 221.57381 9.25740 0 {?} 0 716 {275.HN} 8.389 0.049 0.049 ++ 0.000 {?} {275.HD1} 3.193 0.118 0.115 ++ 0.000 {?} {275.N} 122.149 0.086 0.086 EE 0.000 {?} 57.56990 2.41170 0 {?} 0 717 {273.HN} 8.226 0.042 0.042 ++ 0.000 {?} {271.HA} 4.681 0.110 0.110 ? 0.000 {?} {273.N} 122.060 0.042 0.042 ? 0.000 {?} 56.15080 1.93540 0 {?} 0 718 {383.HN} 8.331 0.037 0.037 ++ 0.000 {?} {385.HN} 9.135 0.093 0.093 ++ 0.000 {?} {383.N} 121.346 0.045 0.045 ? 0.000 {?} 34.17760 1.51340 0 {?} 0 719 {395.HN} 8.331 0.028 0.047 ++ 0.000 {?} {394.HN} 8.652 0.046 0.105 ? 0.000 {?} {395.N} 121.346 0.146 0.146 EE 0.000 {?} 109.40500 6.04120 0 {?} 0 720 {383.HN} 8.332 0.057 0.058 ++ 0.000 {?} {386.HN} 8.054 0.097 0.098 ? 0.000 {?} {383.N} 121.346 0.091 0.091 EE 0.000 {?} 58.07470 2.31510 0 {?} 0 721 {383.HN} 8.331 0.017 0.035 ? 0.000 {?} {383.HG21} 0.710 0.089 0.109 ? 0.000 {?} {383.N} 121.346 0.127 0.127 EE 0.000 {?} 39.19770 3.05310 0 {?} 0 722 {276.HN} 8.465 0.027 0.043 ++ 0.000 {?} {277.HN} 8.682 0.062 0.127 ? 0.000 {?} {276.N} 117.600 0.136 0.136 EE 0.000 {?} 91.63260 6.05960 0 {?} 0 723 {277.HN} 8.677 0.061 0.044 ++ 0.000 {?} {278.HG21} 0.925 0.100 0.100 ++ 0.000 {?} {277.N} 123.754 0.060 0.060 ? 0.000 {?} 44.74930 2.26140 0 {?} 0 724 {277.HN} 8.677 0.046 0.046 ++ 0.000 {?} {281.HB1} 3.121 0.139 0.139 ++ 0.000 {?} {277.N} 123.754 0.048 0.048 ? 0.000 {?} 66.18970 2.05800 0 {?} 0 725 {277.HN} 8.677 0.028 0.044 ++ 0.000 {?} {278.HN} 9.132 0.083 0.121 ++ 0.000 {?} {277.N} 123.754 0.131 0.131 EE 0.000 {?} 102.60380 5.62360 0 {?} 0 726 {277.HN} 8.678 0.039 0.049 ++ 0.000 {?} {276.HN} 8.470 0.093 0.122 ? 0.000 {?} {277.N} 123.754 0.115 0.115 EE 0.000 {?} 109.44710 4.24420 0 {?} 0 727 {278.HN} 9.123 0.047 0.049 ++ 0.000 {?} {277.HN} 8.689 0.101 0.106 ++ 0.000 {?} {278.N} 113.765 0.095 0.095 EE 0.000 {?} 84.34420 3.22390 0 {?} 0 728 {278.HN} 9.123 0.033 0.033 ++ 0.000 {?} {278.HA} 5.015 0.085 0.085 ++ 0.000 {?} {278.N} 113.765 0.058 0.058 ? 0.000 {?} 28.51330 1.67170 0 {?} 0 729 {278.HN} 9.123 0.034 0.032 ++ 0.000 {?} {277.HB2} 2.199 0.089 0.089 ? 0.000 {?} {278.N} 113.776 0.083 0.083 EE 0.000 {?} 44.47440 2.39810 0 {?} 0 730 {279.HN} 8.734 0.047 0.050 ++ 0.000 {?} {279.HA} 3.589 0.100 0.107 ++ 0.000 {?} {279.N} 119.562 0.096 0.096 EE 0.000 {?} 59.51230 2.46170 0 {?} 0 731 {279.HN} 8.732 0.046 0.048 ++ 0.000 {?} {280.HN} 6.843 0.113 0.117 ++ 0.000 {?} {279.N} 119.562 0.095 0.095 EE 0.000 {?} 66.12600 2.41260 0 {?} 0 732 {279.HN} 8.734 0.013 0.045 ? 0.000 {?} {278.HB} 4.658 0.070 0.159 ++ 0.000 {?} {279.N} 119.562 0.162 0.162 EE 0.000 {?} 76.13580 4.93750 0 {?} 0 733 {280.HN} 6.843 0.037 0.055 ++ 0.000 {?} {281.HN} 7.758 0.080 0.113 ++ 0.000 {?} {280.N} 120.276 0.134 0.134 EE 0.000 {?} 104.50950 4.51020 0 {?} 0 734 {280.HN} 6.843 0.035 0.046 ++ 0.000 {?} {279.HN} 8.734 0.087 0.116 ++ 0.000 {?} {280.N} 120.276 0.124 0.124 EE 0.000 {?} 79.03310 3.71180 0 {?} 0 735 {280.HN} 6.843 0.026 0.026 ++ 0.000 {?} {278.HN} 9.136 0.082 0.082 ++ 0.000 {?} {280.N} 120.276 0.046 0.046 ? 0.000 {?} 23.06180 1.52810 0 {?} 0 736 {?} 6.843 0.041 0.035 ++ 0.000 {?} {?} 5.601 0.105 0.089 ++ 0.000 {?} {?} 120.276 0.070 0.070 ? 0.000 {?} 22.21700 1.87140 0 {?} 0 737 {280.HN} 6.843 0.043 0.043 ++ 0.000 {?} {278.HA} 5.020 0.118 0.089 ++ 0.000 {?} {280.N} 120.276 0.061 0.061 ? 0.000 {?} 30.56020 1.72660 0 {?} 0 738 {280.HN} 6.843 0.041 0.038 ++ 0.000 {?} {280.HG} 1.545 0.048 0.102 ? 0.000 {?} {280.N} 120.276 0.078 0.078 EE 0.000 {?} 24.77280 2.00930 0 {?} 0 739 {280.HN} 6.842 0.051 0.051 ++ 0.000 {?} {283.HB2} 2.415 0.105 0.105 ++ 0.000 {?} {280.N} 120.276 0.057 0.057 ? 0.000 {?} 68.10100 2.01940 0 {?} 0 740 {280.HN} 6.843 0.031 0.031 ++ 0.000 {?} {279.HA} 3.576 0.097 0.070 ++ 0.000 {?} {280.N} 120.276 0.063 0.063 ? 0.000 {?} 22.42200 1.75960 0 {?} 0 741 {281.HN} 7.752 0.032 0.048 ++ 0.000 {?} {280.HN} 6.846 0.080 0.125 ++ 0.000 {?} {281.N} 119.473 0.132 0.132 EE 0.000 {?} 110.82670 4.97920 0 {?} 0 742 {281.HN} 7.752 0.039 0.054 ++ 0.000 {?} {282.HN} 8.166 0.086 0.126 ++ 0.000 {?} {281.N} 119.473 0.125 0.125 EE 0.000 {?} 102.11170 4.33590 0 {?} 0 743 {281.HN} 7.752 0.032 0.032 ++ 0.000 {?} {279.HN} 8.735 0.073 0.073 ++ 0.000 {?} {281.N} 119.473 0.062 0.062 ? 0.000 {?} 35.32580 1.86710 0 {?} 0 744 {281.HN} 7.752 0.035 0.034 ++ 0.000 {?} {278.HN} 9.133 0.110 0.103 ++ 0.000 {?} {281.N} 119.473 0.083 0.083 EE 0.000 {?} 39.30070 2.44820 0 {?} 0 745 {281.HN} 7.748 0.051 0.051 ++ 0.000 {?} {278.HB} 4.648 0.108 0.108 ++ 0.000 {?} {281.N} 119.473 0.060 0.060 ? 0.000 {?} 55.07500 1.96670 0 {?} 0 746 {281.HN} 7.752 0.050 0.050 ++ 0.000 {?} {385.HA} 3.994 0.125 0.125 ++ 0.000 {?} {281.N} 119.473 0.036 0.036 ? 0.000 {?} 57.40060 1.63020 0 {?} 0 747 {281.HN} 7.752 0.047 0.047 ++ 0.000 {?} {280.HG} 1.531 0.114 0.114 ++ 0.000 {?} {281.N} 119.473 0.048 0.048 ? 0.000 {?} 51.52310 1.69620 0 {?} 0 748 {282.HN} 8.169 0.043 0.058 ++ 0.000 {?} {283.HN} 8.711 0.070 0.152 ? 0.000 {?} {282.N} 120.633 0.126 0.126 EE 0.000 {?} 94.49710 4.43260 0 {?} 0 749 {282.HN} 8.169 0.037 0.051 ++ 0.000 {?} {281.HN} 7.754 0.086 0.119 ++ 0.000 {?} {282.N} 120.633 0.125 0.125 EE 0.000 {?} 94.34050 4.39670 0 {?} 0 750 {282.HN} 8.169 0.049 0.056 ++ 0.000 {?} {282.HD1} 7.181 0.082 0.098 ++ 0.000 {?} {282.N} 120.633 0.105 0.105 EE 0.000 {?} 89.82860 3.18040 0 {?} 0 751 {282.HN} 8.169 0.028 0.028 ++ 0.000 {?} {279.HG11} 0.789 0.114 0.114 ? 0.000 {?} {282.N} 120.633 0.070 0.070 ? 0.000 {?} 48.15690 2.07790 0 {?} 0 752 {281.HN} 7.752 0.033 0.033 ++ 0.000 {?} {283.HB2} 2.456 0.076 0.076 ++ 0.000 {?} {281.N} 119.473 0.026 0.026 ? 0.000 {?} 28.62510 1.52930 0 {?} 0 753 {283.HN} 8.707 0.044 0.044 ++ 0.000 {?} {389.HD21} 0.636 0.094 0.094 ++ 0.000 {?} {283.N} 118.671 0.073 0.073 ? 0.000 {?} 53.51280 1.92460 0 {?} 0 754 {283.HN} 8.707 0.038 0.040 ++ 0.000 {?} {280.HD11} 0.949 0.104 0.110 ++ 0.000 {?} {283.N} 118.671 0.096 0.096 EE 0.000 {?} 61.35020 2.44310 0 {?} 0 755 {283.HN} 8.705 0.050 0.040 ++ 0.000 {?} {279.HA} 3.569 0.115 0.116 ? 0.000 {?} {283.N} 118.671 0.065 0.065 ? 0.000 {?} 44.77030 1.78740 0 {?} 0 756 {283.HN} 8.701 0.072 0.063 ++ 0.000 {?} {280.HA} 4.141 0.148 0.126 ++ 0.000 {?} {283.N} 118.671 0.072 0.072 ? 0.000 {?} 47.04490 1.89380 0 {?} 0 757 {283.HN} 8.707 0.044 0.044 ++ 0.000 {?} {282.HA} 4.310 0.135 0.094 ++ 0.000 {?} {283.N} 118.671 0.062 0.062 ? 0.000 {?} 32.24530 1.73690 0 {?} 0 758 {283.HN} 8.707 0.032 0.037 ++ 0.000 {?} {282.HD1} 7.179 0.070 0.082 ++ 0.000 {?} {283.N} 118.671 0.105 0.105 EE 0.000 {?} 47.51470 2.66390 0 {?} 0 759 {283.HN} 8.707 0.039 0.050 ++ 0.000 {?} {282.HN} 8.171 0.073 0.096 ++ 0.000 {?} {283.N} 118.671 0.116 0.116 EE 0.000 {?} 69.16560 3.25380 0 {?} 0 760 {283.HN} 8.707 0.017 0.043 ? 0.000 {?} {284.HN} 8.605 0.040 0.102 ? 0.000 {?} {283.N} 118.671 0.163 0.163 EE 0.000 {?} 52.83270 3.84910 0 {?} 0 761 {297.HN} 8.308 0.032 0.030 ++ 0.000 {?} {296.HA} 3.012 0.110 0.101 ++ 0.000 {?} {297.N} 120.008 0.081 0.081 EE 0.000 {?} 24.06270 1.80470 0 {?} 0 762 {388.HN} 9.709 0.055 0.055 ++ 0.000 {?} {388.HA} 4.761 0.086 0.086 ++ 0.000 {?} {388.N} 121.435 0.050 0.050 ? 0.000 {?} 42.28870 1.30590 0 {?} 0 763 {388.HN} 9.711 0.042 0.044 ++ 0.000 {?} {388.HD1} 7.133 0.076 0.080 ++ 0.000 {?} {388.N} 121.435 0.095 0.095 EE 0.000 {?} 38.42700 2.00680 0 {?} 0 764 {388.HN} 9.703 0.042 0.041 ++ 0.000 {?} {388.HB2} 2.824 0.101 0.099 ++ 0.000 {?} {388.N} 121.435 0.088 0.088 EE 0.000 {?} 34.43860 1.84890 0 {?} 0 765 {388.HN} 9.704 0.043 0.040 ++ 0.000 {?} {388.HB1} 3.079 0.082 0.082 ++ 0.000 {?} {388.N} 121.435 0.080 0.080 EE 0.000 {?} 29.25810 1.71050 0 {?} 0 766 {341.HN} 8.452 0.049 0.054 ++ 0.000 {?} {340.HG11} 0.443 0.097 0.108 ++ 0.000 {?} {341.N} 118.314 0.102 0.102 EE 0.000 {?} 50.56810 1.99100 0 {?} 0 767 {341.HN} 8.445 0.043 0.058 ++ 0.000 {?} {341.HA} 5.158 0.085 0.103 ++ 0.000 {?} {341.N} 118.314 0.113 0.113 EE 0.000 {?} 55.50960 2.32810 0 {?} 0 768 {327.HN} 8.779 0.055 0.070 ++ 0.000 {?} {361.HG21} 0.181 0.071 0.088 ++ 0.000 {?} {327.N} 116.084 0.114 0.114 EE 0.000 {?} 65.76780 2.39240 0 {?} 0 769 {327.HN} 8.784 0.038 0.045 ++ 0.000 {?} {327.HA} 5.449 0.092 0.109 ++ 0.000 {?} {327.N} 116.084 0.107 0.107 EE 0.000 {?} 46.06630 2.14570 0 {?} 0 770 {268.HN} 8.615 0.030 0.037 ++ 0.000 {?} {267.HB} 4.236 0.080 0.108 ? 0.000 {?} {268.N} 123.665 0.120 0.120 EE 0.000 {?} 27.11330 1.58310 0 {?} 0 771 {268.HN} 8.612 0.041 0.046 ? 0.000 {?} {268.HB1} 2.729 0.087 0.098 ++ 0.000 {?} {268.N} 123.665 0.109 0.109 EE 0.000 {?} 64.58730 2.38210 0 {?} 0 772 {?} 8.611 0.040 0.043 ++ 0.000 {?} {?} 5.381 0.101 0.110 ++ 0.000 {?} {?} 123.665 0.103 0.103 EE 0.000 {?} 32.04580 1.21640 0 {?} 0 773 {268.HN} 8.614 0.031 0.036 ++ 0.000 {?} {269.HN} 8.270 0.089 0.102 ++ 0.000 {?} {268.N} 123.665 0.110 0.110 EE 0.000 {?} 23.74200 1.35580 0 {?} 0 774 {269.HN} 8.268 0.031 0.034 ++ 0.000 {?} {270.HA} 4.377 0.085 0.092 ? 0.000 {?} {269.N} 120.276 0.100 0.100 EE 0.000 {?} 22.15030 1.17420 0 {?} 0 775 {270.HN} 8.429 0.038 0.065 ++ 0.000 {?} {269.HB} 2.166 0.055 0.113 ? 0.000 {?} {270.N} 118.760 0.150 0.150 EE 0.000 {?} 81.70970 3.12140 0 {?} 0 776 {276.HN} 8.470 0.033 0.041 ++ 0.000 {?} {275.HD1} 3.180 0.106 0.124 ++ 0.000 {?} {276.N} 117.600 0.117 0.117 EE 0.000 {?} 34.72480 1.49830 0 {?} 0 777 {277.HN} 8.683 0.020 0.056 ? 0.000 {?} {277.HA} 4.741 0.078 0.128 ? 0.000 {?} {277.N} 123.754 0.170 0.170 EE 0.000 {?} 336.19180 10.70720 0 {?} 0 778 {?} 8.680 0.036 0.045 ++ 0.000 {?} {?} 0.660 0.085 0.127 ++ 0.000 {?} {?} 123.754 0.115 0.115 EE 0.000 {?} 32.21760 1.46270 0 {?} 0 779 {?} 8.679 0.032 0.038 ++ 0.000 {?} {?} 7.118 0.099 0.125 ++ 0.000 {?} {?} 123.754 0.114 0.114 EE 0.000 {?} 28.61980 1.42830 0 {?} 0 780 {278.HN} 9.122 0.042 0.048 ++ 0.000 {?} {281.HN} 7.750 0.083 0.095 ++ 0.000 {?} {278.N} 113.765 0.104 0.104 EE 0.000 {?} 28.36620 1.23850 0 {?} 0 781 {322.HN} 8.775 0.038 0.055 ? 0.000 {?} {321.HN} 8.356 0.103 0.154 ++ 0.000 {?} {322.N} 119.652 0.137 0.137 EE 0.000 {?} 67.78280 2.24340 0 {?} 0 782 {283.HN} 8.706 0.037 0.044 ++ 0.000 {?} {283.HE1} 1.922 0.035 0.088 ? 0.000 {?} {283.N} 118.671 0.110 0.110 EE 0.000 {?} 15.98710 1.34800 0 {?} 0 783 {289.HN} 7.766 0.036 0.065 ++ 0.000 {?} {290.HN} 7.402 0.059 0.137 ? 0.000 {?} {289.N} 117.422 0.148 0.148 EE 0.000 {?} 66.30630 2.98540 0 {?} 0 784 {290.HN} 7.399 0.034 0.056 ++ 0.000 {?} {289.HN} 7.755 0.043 0.113 ? 0.000 {?} {290.N} 113.052 0.149 0.149 EE 0.000 {?} 59.14400 3.13950 0 {?} 0 785 {290.HN} 7.394 0.042 0.058 ++ 0.000 {?} {290.HB} 3.960 0.082 0.139 ++ 0.000 {?} {290.N} 113.052 0.141 0.141 EE 0.000 {?} 68.77770 2.48950 0 {?} 0 786 {290.HN} 7.402 0.045 0.052 ++ 0.000 {?} {289.HG1} 2.257 0.087 0.102 ++ 0.000 {?} {290.N} 113.052 0.108 0.108 EE 0.000 {?} 34.68670 1.30530 0 {?} 0 787 {290.HN} 7.397 0.036 0.047 ++ 0.000 {?} {289.HB1} 2.095 0.080 0.108 ++ 0.000 {?} {290.N} 113.052 0.122 0.122 EE 0.000 {?} 33.22870 1.64350 0 {?} 0 788 {290.HN} 7.400 0.040 0.050 ++ 0.000 {?} {289.HB2} 1.917 0.078 0.106 ++ 0.000 {?} {290.N} 113.052 0.121 0.121 EE 0.000 {?} 35.29600 1.60580 0 {?} 0 789 {290.HN} 7.389 0.046 0.056 ++ 0.000 {?} {291.HN} 8.315 0.083 0.107 ++ 0.000 {?} {290.N} 113.052 0.116 0.116 EE 0.000 {?} 37.62300 1.46640 0 {?} 0 790 {291.HN} 8.309 0.027 0.037 ++ 0.000 {?} {294.HB1} 1.915 0.068 0.114 ? 0.000 {?} {291.N} 122.238 0.138 0.138 EE 0.000 {?} 47.16840 2.29230 0 {?} 0 791 {291.HN} 8.312 0.053 0.053 ? 0.000 {?} {291.HA} 4.380 0.041 0.086 ? 0.000 {?} {291.N} 122.238 0.131 0.131 EE 0.000 {?} 173.72710 8.24600 0 {?} 0 792 {291.HN} 8.308 0.036 0.051 ++ 0.000 {?} {290.HN} 7.407 0.070 0.154 ? 0.000 {?} {291.N} 122.238 0.132 0.132 EE 0.000 {?} 44.67870 1.96990 0 {?} 0 793 {291.HN} 8.318 0.036 0.054 ++ 0.000 {?} {292.HN} 8.795 0.066 0.157 ? 0.000 {?} {291.N} 122.238 0.144 0.144 EE 0.000 {?} 66.66380 2.70530 0 {?} 0 794 {315.HN} 7.468 0.039 0.056 ++ 0.000 {?} {314.HB1} 3.080 0.078 0.141 ? 0.000 {?} {315.N} 118.671 0.136 0.136 EE 0.000 {?} 58.06440 2.17150 0 {?} 0 795 {315.HN} 7.465 0.032 0.047 ++ 0.000 {?} {315.HE1} 2.970 0.054 0.093 ? 0.000 {?} {315.N} 118.671 0.137 0.137 EE 0.000 {?} 42.24350 2.14010 0 {?} 0 796 {315.HN} 7.464 0.035 0.053 ++ 0.000 {?} {314.HB2} 2.638 0.066 0.103 ++ 0.000 {?} {315.N} 118.671 0.137 0.137 EE 0.000 {?} 46.72990 2.22510 0 {?} 0 797 {315.HN} 7.466 0.044 0.053 ++ 0.000 {?} {309.HA} 5.283 0.067 0.087 ++ 0.000 {?} {315.N} 118.671 0.117 0.117 EE 0.000 {?} 30.22860 1.49200 0 {?} 0 798 {315.HN} 7.465 0.033 0.050 ++ 0.000 {?} {313.HN} 6.736 0.082 0.133 ? 0.000 {?} {315.N} 118.671 0.139 0.139 EE 0.000 {?} 64.34990 2.32840 0 {?} 0 799 {315.HN} 7.465 0.029 0.053 ++ 0.000 {?} {312.HN} 6.919 0.088 0.157 ? 0.000 {?} {315.N} 118.671 0.154 0.154 EE 0.000 {?} 135.57179 3.78600 0 {?} 0 800 {315.HN} 7.466 0.035 0.064 ++ 0.000 {?} {314.HN} 7.794 0.065 0.159 ? 0.000 {?} {315.N} 118.671 0.157 0.157 EE 0.000 {?} 147.58960 4.29460 0 {?} 0 801 {315.HN} 7.464 0.028 0.063 ? 0.000 {?} {310.HN} 9.365 0.047 0.154 ? 0.000 {?} {315.N} 118.671 0.151 0.151 EE 0.000 {?} 63.45580 3.35790 0 {?} 0 802 {295.HN} 7.565 0.039 0.048 ++ 0.000 {?} {290.HB} 3.936 0.047 0.096 ? 0.000 {?} {295.N} 120.008 0.120 0.120 EE 0.000 {?} 27.48540 1.58240 0 {?} 0 803 {296.HN} 8.421 0.034 0.043 ++ 0.000 {?} {295.HB1} 3.319 0.087 0.104 ++ 0.000 {?} {296.N} 117.244 0.119 0.119 EE 0.000 {?} 32.40270 1.55180 0 {?} 0 804 {296.HN} 8.423 0.036 0.051 ++ 0.000 {?} {295.HD1} 7.215 0.046 0.127 ? 0.000 {?} {296.N} 117.244 0.130 0.130 EE 0.000 {?} 27.39380 1.91510 0 {?} 0 805 {296.HN} 8.417 0.034 0.045 ? 0.000 {?} {295.HN} 7.553 0.033 0.097 ? 0.000 {?} {296.N} 117.244 0.130 0.130 EE 0.000 {?} 15.04670 1.91640 0 {?} 0 806 {297.HN} 8.312 0.030 0.036 ++ 0.000 {?} {294.HA} 4.446 0.090 0.113 ++ 0.000 {?} {297.N} 120.008 0.121 0.121 EE 0.000 {?} 30.45970 1.59300 0 {?} 0 807 {297.HN} 8.308 0.021 0.073 ? 0.000 {?} {297.HB1} 2.101 0.046 0.090 ? 0.000 {?} {297.N} 120.008 0.169 0.169 EE 0.000 {?} 146.15610 9.66910 0 {?} 0 808 {297.HN} 8.308 0.031 0.040 ? 0.000 {?} {296.HG1} 1.647 0.078 0.122 ? 0.000 {?} {297.N} 119.919 0.126 0.126 EE 0.000 {?} 35.95760 1.65940 0 {?} 0 809 {298.HN} 8.226 0.023 0.075 ? 0.000 {?} {298.HB2} 2.227 0.049 0.095 ? 0.000 {?} {298.N} 118.046 0.170 0.170 EE 0.000 {?} 159.24541 10.32650 0 {?} 0 810 {298.HN} 8.227 0.015 0.062 ? 0.000 {?} {299.HN} 8.908 0.059 0.145 ? 0.000 {?} {298.N} 118.046 0.160 0.160 EE 0.000 {?} 64.53780 5.05830 0 {?} 0 811 {299.HN} 8.906 0.041 0.042 ++ 0.000 {?} {298.HG2} 2.492 0.109 0.112 ++ 0.000 {?} {299.N} 119.830 0.094 0.094 EE 0.000 {?} 27.37990 1.08790 0 {?} 0 812 {299.HN} 8.907 0.042 0.058 ++ 0.000 {?} {299.HA} 3.175 0.060 0.083 ++ 0.000 {?} {299.N} 119.830 0.131 0.131 EE 0.000 {?} 34.65390 1.94170 0 {?} 0 813 {299.HN} 8.898 0.050 0.057 ++ 0.000 {?} {298.HA} 4.075 0.056 0.112 ? 0.000 {?} {299.N} 119.830 0.113 0.113 EE 0.000 {?} 28.30210 1.41160 0 {?} 0 814 {299.HN} 8.905 0.049 0.071 ++ 0.000 {?} {300.HN} 7.821 0.108 0.178 ? 0.000 {?} {299.N} 119.830 0.140 0.140 EE 0.000 {?} 123.42520 2.39410 0 {?} 0 815 {299.HN} 8.904 0.039 0.055 ++ 0.000 {?} {298.HN} 8.229 0.080 0.146 ? 0.000 {?} {299.N} 119.830 0.140 0.140 EE 0.000 {?} 71.97660 2.41020 0 {?} 0 816 {300.HN} 7.821 0.052 0.064 ++ 0.000 {?} {299.HA} 3.176 0.083 0.116 ++ 0.000 {?} {300.N} 117.065 0.117 0.117 EE 0.000 {?} 45.81000 1.50520 0 {?} 0 817 {300.HN} 7.824 0.017 0.055 ? 0.000 {?} {301.HN} 7.265 0.065 0.150 ? 0.000 {?} {300.N} 117.065 0.158 0.158 EE 0.000 {?} 78.17320 4.45590 0 {?} 0 818 {300.HN} 7.823 0.040 0.049 ++ 0.000 {?} {298.HN} 8.237 0.108 0.144 ++ 0.000 {?} {300.N} 117.065 0.124 0.124 EE 0.000 {?} 44.03530 1.70510 0 {?} 0 819 {300.HN} 7.823 0.042 0.079 ++ 0.000 {?} {299.HN} 8.910 0.111 0.174 ? 0.000 {?} {300.N} 117.065 0.152 0.152 EE 0.000 {?} 183.44160 3.48200 0 {?} 0 820 {301.HN} 7.263 0.029 0.061 ++ 0.000 {?} {300.HN} 7.820 0.065 0.174 ? 0.000 {?} {301.N} 118.403 0.162 0.162 EE 0.000 {?} 162.82260 5.66680 0 {?} 0 821 {301.HN} 7.262 0.034 0.039 ++ 0.000 {?} {299.HN} 8.921 0.051 0.109 ? 0.000 {?} {301.N} 118.403 0.106 0.106 EE 0.000 {?} 15.92560 1.27330 0 {?} 0 822 {301.HN} 7.266 0.042 0.044 ++ 0.000 {?} {298.HB1} 2.311 0.088 0.091 ++ 0.000 {?} {301.N} 118.403 0.093 0.093 EE 0.000 {?} 51.25610 2.02230 0 {?} 0 823 {301.HN} 7.264 0.043 0.042 ++ 0.000 {?} {301.HE1} 3.043 0.089 0.083 ++ 0.000 {?} {301.N} 118.403 0.083 0.083 EE 0.000 {?} 13.28430 0.96780 0 {?} 0 824 {301.HN} 7.265 0.035 0.047 ++ 0.000 {?} {298.HB2} 2.208 0.070 0.098 ? 0.000 {?} {301.N} 118.403 0.137 0.137 EE 0.000 {?} 61.26430 2.24710 0 {?} 0 825 {301.HN} 7.267 0.041 0.051 ++ 0.000 {?} {304.HD11} 0.932 0.092 0.117 ? 0.000 {?} {301.N} 118.403 0.116 0.116 EE 0.000 {?} 38.13310 1.46800 0 {?} 0 826 {301.HN} 7.263 0.029 0.043 ++ 0.000 {?} {322.HD11} 0.700 0.087 0.087 ? 0.000 {?} {301.N} 118.403 0.129 0.129 EE 0.000 {?} 41.33800 1.85190 0 {?} 0 827 {301.HN} 7.264 0.034 0.049 ++ 0.000 {?} {303.HD11} 0.787 0.048 0.087 ? 0.000 {?} {301.N} 118.403 0.128 0.128 EE 0.000 {?} 25.47910 1.84240 0 {?} 0 828 {301.HN} 7.264 0.074 0.068 ++ 0.000 {?} {301.HG2} 1.546 0.092 0.080 ++ 0.000 {?} {301.N} 118.403 0.075 0.075 EE 0.000 {?} 71.71900 3.47840 0 {?} 0 829 {302.HN} 7.288 0.044 0.057 ? 0.000 {?} {303.HD11} 0.748 0.121 0.185 ? 0.000 {?} {302.N} 115.460 0.139 0.139 EE 0.000 {?} 125.34190 2.31720 0 {?} 0 830 {302.HN} 7.286 0.028 0.074 ? 0.000 {?} {303.HN} 7.723 0.072 0.199 ? 0.000 {?} {302.N} 115.460 0.167 0.167 EE 0.000 {?} 254.38811 8.02070 0 {?} 0 831 {303.HN} 7.730 0.030 0.080 ? 0.000 {?} {302.HN} 7.283 0.076 0.182 ? 0.000 {?} {303.N} 116.798 0.165 0.165 EE 0.000 {?} 266.08600 7.14310 0 {?} 0 832 {303.HN} 7.735 0.030 0.045 ++ 0.000 {?} {302.HG1} 2.292 0.072 0.106 ? 0.000 {?} {303.N} 116.887 0.134 0.134 EE 0.000 {?} 47.61790 2.09640 0 {?} 0 833 {303.HN} 7.734 0.035 0.051 ++ 0.000 {?} {301.HB1} 1.977 0.062 0.137 ? 0.000 {?} {303.N} 116.887 0.138 0.138 EE 0.000 {?} 49.70760 2.27710 0 {?} 0 834 {304.HN} 7.694 0.038 0.053 ++ 0.000 {?} {302.HN} 7.290 0.109 0.147 ? 0.000 {?} {304.N} 117.690 0.129 0.129 EE 0.000 {?} 52.03830 1.88230 0 {?} 0 835 {304.HN} 7.701 0.048 0.058 ++ 0.000 {?} {305.HN} 9.539 0.064 0.080 ++ 0.000 {?} {304.N} 117.690 0.114 0.114 EE 0.000 {?} 25.87870 1.42520 0 {?} 0 836 {305.HN} 9.544 0.020 0.063 ? 0.000 {?} {306.HN} 8.061 0.082 0.174 ++ 0.000 {?} {305.N} 117.600 0.155 0.155 EE 0.000 {?} 96.32180 3.92510 0 {?} 0 837 {305.HN} 9.543 0.032 0.036 ++ 0.000 {?} {304.HN} 7.706 0.087 0.115 ++ 0.000 {?} {305.N} 117.600 0.113 0.113 EE 0.000 {?} 28.29730 1.41160 0 {?} 0 838 {?} 9.554 0.037 0.042 ++ 0.000 {?} {?} 9.757 0.079 0.109 ? 0.000 {?} {?} 117.600 0.110 0.110 EE 0.000 {?} 28.89150 1.34890 0 {?} 0 839 {306.HN} 8.062 0.030 0.045 ++ 0.000 {?} {319.HN} 8.966 0.051 0.130 ? 0.000 {?} {306.N} 120.811 0.142 0.142 EE 0.000 {?} 45.66310 2.51610 0 {?} 0 840 {306.HN} 8.062 0.030 0.061 ++ 0.000 {?} {305.HN} 9.548 0.071 0.181 ? 0.000 {?} {306.N} 120.811 0.165 0.165 EE 0.000 {?} 248.48399 6.93600 0 {?} 0 841 {307.HN} 7.931 0.045 0.065 ++ 0.000 {?} {306.HD11} 0.637 0.042 0.125 ? 0.000 {?} {307.N} 119.919 0.139 0.139 EE 0.000 {?} 53.70520 2.31250 0 {?} 0 842 {307.HN} 7.933 0.033 0.060 ? 0.000 {?} {392.HN} 8.249 0.071 0.119 ? 0.000 {?} {307.N} 119.919 0.115 0.115 EE 0.000 {?} 33.07710 1.44770 0 {?} 0 843 {307.HN} 7.935 0.033 0.040 ++ 0.000 {?} {308.HN} 9.340 0.102 0.122 ++ 0.000 {?} {307.N} 119.919 0.116 0.116 EE 0.000 {?} 33.92060 1.46800 0 {?} 0 844 {307.HN} 7.936 0.034 0.045 ++ 0.000 {?} {393.HG21} 1.210 0.051 0.091 ? 0.000 {?} {307.N} 119.919 0.122 0.122 EE 0.000 {?} 22.83670 1.64180 0 {?} 0 845 {308.HN} 9.342 0.043 0.062 ? 0.000 {?} {308.HA} 5.269 0.094 0.151 ++ 0.000 {?} {308.N} 121.168 0.139 0.139 EE 0.000 {?} 78.82350 2.33510 0 {?} 0 846 {308.HN} 9.345 0.038 0.042 ++ 0.000 {?} {316.HA} 5.600 0.107 0.120 ++ 0.000 {?} {308.N} 121.168 0.110 0.110 EE 0.000 {?} 35.79970 1.34420 0 {?} 0 847 {308.HN} 9.345 0.040 0.064 ++ 0.000 {?} {317.HN} 8.893 0.060 0.166 ? 0.000 {?} {308.N} 121.168 0.151 0.151 EE 0.000 {?} 90.76530 3.39910 0 {?} 0 848 {308.HN} 9.337 0.045 0.049 ++ 0.000 {?} {307.HN} 7.933 0.112 0.123 ++ 0.000 {?} {308.N} 121.168 0.102 0.102 EE 0.000 {?} 38.97680 1.19800 0 {?} 0 849 {308.HN} 9.344 0.046 0.055 ++ 0.000 {?} {308.HB} 1.971 0.092 0.124 ++ 0.000 {?} {308.N} 121.168 0.114 0.114 EE 0.000 {?} 42.38100 1.43870 0 {?} 0 850 {308.HN} 9.341 0.036 0.049 ++ 0.000 {?} {307.HB} 1.790 0.067 0.119 ? 0.000 {?} {308.N} 121.168 0.128 0.128 EE 0.000 {?} 35.05020 1.81940 0 {?} 0 851 {309.HN} 9.101 0.029 0.049 ? 0.000 {?} {388.HN} 9.704 0.086 0.117 ++ 0.000 {?} {309.N} 122.684 0.128 0.128 EE 0.000 {?} 38.62240 1.80980 0 {?} 0 852 {309.HN} 9.103 0.045 0.055 ? 0.000 {?} {310.HN} 9.373 0.092 0.104 ++ 0.000 {?} {309.N} 122.684 0.104 0.104 EE 0.000 {?} 34.41700 1.24110 0 {?} 0 853 {310.HN} 9.364 0.041 0.063 ++ 0.000 {?} {316.HG21} 1.011 0.097 0.145 ? 0.000 {?} {310.N} 115.995 0.141 0.141 EE 0.000 {?} 79.53180 2.48690 0 {?} 0 854 {310.HN} 9.366 0.034 0.045 ++ 0.000 {?} {310.HB} 3.372 0.081 0.103 ++ 0.000 {?} {310.N} 115.995 0.115 0.115 EE 0.000 {?} 28.24660 1.46050 0 {?} 0 855 {310.HN} 9.364 0.041 0.051 ++ 0.000 {?} {317.HE1} 6.906 0.046 0.081 ? 0.000 {?} {310.N} 115.995 0.126 0.126 EE 0.000 {?} 31.65500 1.75480 0 {?} 0 856 {310.HN} 9.364 0.032 0.049 ++ 0.000 {?} {315.HN} 7.474 0.047 0.131 ? 0.000 {?} {310.N} 115.995 0.145 0.145 EE 0.000 {?} 50.47820 2.72640 0 {?} 0 857 {310.HN} 9.363 0.046 0.058 ++ 0.000 {?} {317.HD1} 6.829 0.077 0.077 ? 0.000 {?} {310.N} 115.995 0.121 0.121 EE 0.000 {?} 42.39140 1.59550 0 {?} 0 858 {317.HN} 8.886 0.044 0.062 ++ 0.000 {?} {310.HN} 9.351 0.103 0.151 ++ 0.000 {?} {317.N} 118.135 0.133 0.133 EE 0.000 {?} 122.74080 3.57480 0 {?} 0 859 {327.HD21} 7.838 0.044 0.051 ++ 0.000 {?} {327.HB2} 2.767 0.105 0.122 ++ 0.000 {?} {327.ND2} 114.379 0.109 0.109 EE 0.000 {?} 66.19230 2.37190 0 {?} 0 860 {327.HD21} 7.829 0.046 0.046 ++ 0.000 {?} {327.HB1} 3.119 0.082 0.082 ++ 0.000 {?} {327.ND2} 114.379 0.077 0.077 EE 0.000 {?} 44.48160 1.77370 0 {?} 0 861 {398.HD22} 6.900 0.048 0.048 ++ 0.000 {?} {398.HB2} 2.704 0.134 0.117 ++ 0.000 {?} {398.ND2} 112.963 0.076 0.076 EE 0.000 {?} 26.44580 1.57780 0 {?} 0 862 {317.HN} 8.890 0.034 0.048 ++ 0.000 {?} {309.HA} 5.281 0.032 0.097 ? 0.000 {?} {317.N} 118.135 0.138 0.138 EE 0.000 {?} 24.65730 2.30360 0 {?} 0 863 {317.HN} 8.891 0.041 0.052 ++ 0.000 {?} {310.HG21} 1.225 0.113 0.145 ? 0.000 {?} {317.N} 118.135 0.119 0.119 EE 0.000 {?} 52.39050 1.55920 0 {?} 0 864 {333.HN} 8.261 0.043 0.056 ++ 0.000 {?} {332.HD1} 6.306 0.067 0.097 ++ 0.000 {?} {333.N} 118.492 0.130 0.130 EE 0.000 {?} 68.12850 3.33230 0 {?} 0 865 {398.HN} 8.595 0.033 0.044 ++ 0.000 {?} {399.HN} 8.033 0.066 0.097 ++ 0.000 {?} {398.N} 120.633 0.128 0.128 EE 0.000 {?} 48.16280 3.17670 0 {?} 0 866 {398.HN} 8.598 0.036 0.047 ++ 0.000 {?} {397.HN} 8.253 0.057 0.101 ++ 0.000 {?} {398.N} 120.633 0.124 0.124 EE 0.000 {?} 26.40100 1.69010 0 {?} 0 867 {398.HN} 8.598 0.029 0.046 ++ 0.000 {?} {398.HB1} 2.859 0.057 0.113 ? 0.000 {?} {398.N} 120.633 0.141 0.141 EE 0.000 {?} 44.29220 2.49560 0 {?} 0 868 {312.HN} 6.927 0.019 0.063 ? 0.000 {?} {313.HN} 6.730 0.128 0.164 ? 0.000 {?} {312.N} 111.803 0.169 0.169 EE 0.000 {?} 390.88589 10.05010 0 {?} 0 869 {312.HN} 6.928 0.023 0.058 ? 0.000 {?} {312.HD1} 6.580 0.079 0.148 ? 0.000 {?} {312.N} 111.803 0.166 0.166 EE 0.000 {?} 242.97000 7.72070 0 {?} 0 870 {?} 6.926 0.015 0.070 ? 0.000 {?} {?} 7.732 0.096 0.256 ? 0.000 {?} {?} 111.803 0.176 0.176 EE 0.000 {?} 749.63989 39.26210 0 {?} 0 871 {312.HN} 6.929 0.025 0.064 ? 0.000 {?} {311.HN} 9.002 0.103 0.210 ? 0.000 {?} {312.N} 111.803 0.158 0.158 EE 0.000 {?} 149.15260 4.54210 0 {?} 0 872 {?} 6.928 0.038 0.050 ++ 0.000 {?} {?} 3.828 0.059 0.149 ? 0.000 {?} {?} 111.803 0.124 0.124 EE 0.000 {?} 27.67230 1.68290 0 {?} 0 873 {311.HN} 8.996 0.028 0.041 ++ 0.000 {?} {312.HN} 6.924 0.076 0.128 ++ 0.000 {?} {311.N} 122.238 0.130 0.130 EE 0.000 {?} 33.98380 1.92040 0 {?} 0 874 {311.HN} 9.004 0.037 0.039 ++ 0.000 {?} {311.HD1} 1.475 0.099 0.107 ++ 0.000 {?} {311.N} 122.238 0.096 0.096 EE 0.000 {?} 23.99410 1.11750 0 {?} 0 875 {?} 9.002 0.037 0.059 ++ 0.000 {?} {?} 1.687 0.106 0.190 ? 0.000 {?} {?} 122.238 0.135 0.135 EE 0.000 {?} 69.63600 2.07430 0 {?} 0 876 {311.HN} 9.003 0.041 0.048 ++ 0.000 {?} {311.HB1} 1.804 0.107 0.128 ? 0.000 {?} {311.N} 122.238 0.109 0.109 EE 0.000 {?} 39.76920 1.32170 0 {?} 0 877 {313.HN} 6.732 0.042 0.054 ? 0.000 {?} {312.HA} 4.607 0.070 0.131 ? 0.000 {?} {313.N} 117.333 0.129 0.129 EE 0.000 {?} 42.03740 1.87020 0 {?} 0 878 {313.HN} 6.733 0.033 0.051 ? 0.000 {?} {314.HA} 4.447 0.066 0.113 ? 0.000 {?} {313.N} 117.333 0.141 0.141 EE 0.000 {?} 53.66190 2.44170 0 {?} 0 879 {313.HN} 6.728 0.043 0.050 ? 0.000 {?} {311.HA} 4.070 0.083 0.107 ++ 0.000 {?} {313.N} 117.333 0.112 0.112 EE 0.000 {?} 35.12510 1.38080 0 {?} 0 880 {313.HN} 6.735 0.049 0.067 ? 0.000 {?} {312.HN} 6.924 0.111 0.175 ? 0.000 {?} {313.N} 117.333 0.157 0.157 EE 0.000 {?} 251.92500 4.24450 0 {?} 0 881 {313.HN} 6.738 0.036 0.054 ? 0.000 {?} {312.HD1} 6.590 0.105 0.105 ? 0.000 {?} {313.N} 117.333 0.140 0.140 EE 0.000 {?} 92.12190 2.36900 0 {?} 0 882 {313.HN} 6.740 0.038 0.047 ? 0.000 {?} {315.HN} 7.457 0.066 0.103 ++ 0.000 {?} {313.N} 117.333 0.126 0.126 EE 0.000 {?} 30.42100 1.76950 0 {?} 0 883 {313.HN} 6.736 0.044 0.067 ? 0.000 {?} {314.HN} 7.799 0.094 0.155 ? 0.000 {?} {313.N} 117.333 0.160 0.160 EE 0.000 {?} 232.88251 4.94460 0 {?} 0 884 {314.HN} 7.795 0.043 0.064 ? 0.000 {?} {311.HA} 4.071 0.095 0.130 ? 0.000 {?} {314.N} 116.530 0.137 0.137 EE 0.000 {?} 66.83990 2.20110 0 {?} 0 885 {314.HN} 7.799 0.045 0.067 ? 0.000 {?} {314.HB1} 3.081 0.075 0.114 ++ 0.000 {?} {314.N} 116.530 0.131 0.131 EE 0.000 {?} 49.43110 1.94820 0 {?} 0 886 {314.HN} 7.799 0.034 0.038 ++ 0.000 {?} {313.HB2} 2.851 0.073 0.081 ++ 0.000 {?} {314.N} 116.530 0.103 0.103 EE 0.000 {?} 19.99640 1.21710 0 {?} 0 887 {314.HN} 7.794 0.046 0.067 ? 0.000 {?} {314.HB2} 2.635 0.090 0.132 ++ 0.000 {?} {314.N} 116.530 0.138 0.138 EE 0.000 {?} 72.63240 2.25620 0 {?} 0 888 {314.HN} 7.798 0.047 0.067 ? 0.000 {?} {313.HN} 6.736 0.121 0.244 ? 0.000 {?} {314.N} 116.530 0.159 0.159 EE 0.000 {?} 324.36679 4.80050 0 {?} 0 889 {314.HN} 7.794 0.045 0.050 ? 0.000 {?} {312.HN} 6.928 0.076 0.155 ? 0.000 {?} {314.N} 116.530 0.106 0.106 EE 0.000 {?} 31.44170 1.27060 0 {?} 0 890 {314.HN} 7.796 0.046 0.067 ? 0.000 {?} {315.HN} 7.466 0.098 0.141 ? 0.000 {?} {314.N} 116.530 0.143 0.143 EE 0.000 {?} 115.46270 2.58040 0 {?} 0 891 {313.HN} 6.739 0.033 0.046 ++ 0.000 {?} {313.HB2} 2.851 0.044 0.101 ? 0.000 {?} {313.N} 117.333 0.111 0.111 EE 0.000 {?} 19.07180 1.20100 0 {?} 0 892 {314.HN} 7.797 0.044 0.067 ? 0.000 {?} {309.HD21} 0.726 0.075 0.099 ++ 0.000 {?} {314.N} 116.530 0.126 0.126 EE 0.000 {?} 38.66280 1.75170 0 {?} 0 893 {351.HN} 7.632 0.025 0.086 ? 0.000 {?} {350.HN} 6.438 0.079 0.247 ? 0.000 {?} {351.N} 118.849 0.169 0.169 EE 0.000 {?} 291.26169 9.85040 0 {?} 0 894 {351.HN} 7.637 0.037 0.053 ++ 0.000 {?} {350.HD1} 6.913 0.115 0.154 ++ 0.000 {?} {351.N} 118.849 0.132 0.132 EE 0.000 {?} 58.21670 1.97760 0 {?} 0 895 {351.HN} 7.631 0.024 0.071 ? 0.000 {?} {352.HN} 7.892 0.072 0.185 ? 0.000 {?} {351.N} 118.849 0.164 0.164 EE 0.000 {?} 190.67250 6.42220 0 {?} 0 896 {351.HN} 7.631 0.035 0.048 ++ 0.000 {?} {349.HN} 8.800 0.067 0.133 ? 0.000 {?} {351.N} 118.849 0.129 0.129 EE 0.000 {?} 34.89810 1.87420 0 {?} 0 897 {316.HN} 7.410 0.033 0.047 ++ 0.000 {?} {317.HE1} 6.914 0.050 0.119 ? 0.000 {?} {316.N} 107.701 0.134 0.134 EE 0.000 {?} 31.54880 2.08170 0 {?} 0 898 {316.HN} 7.413 0.041 0.067 ? 0.000 {?} {316.HB} 3.876 0.091 0.138 ++ 0.000 {?} {316.N} 107.701 0.141 0.141 EE 0.000 {?} 77.74220 2.48530 0 {?} 0 899 {316.HN} 7.414 0.027 0.035 ++ 0.000 {?} {317.HN} 8.879 0.088 0.117 ++ 0.000 {?} {316.N} 107.701 0.118 0.118 EE 0.000 {?} 26.13600 1.52120 0 {?} 0 900 {317.HN} 8.887 0.038 0.086 ? 0.000 {?} {317.HD1} 6.824 0.098 0.166 ? 0.000 {?} {317.N} 118.135 0.158 0.158 EE 0.000 {?} 195.43510 4.54150 0 {?} 0 901 {317.HN} 8.884 0.035 0.043 ++ 0.000 {?} {317.HB1} 2.888 0.150 0.244 ? 0.000 {?} {317.N} 118.135 0.123 0.123 EE 0.000 {?} 56.57510 1.65530 0 {?} 0 902 {317.HN} 8.892 0.042 0.050 ++ 0.000 {?} {309.HN} 9.132 0.043 0.091 ? 0.000 {?} {317.N} 118.135 0.110 0.110 EE 0.000 {?} 23.21990 1.34610 0 {?} 0 903 {318.HN} 8.898 0.033 0.047 ? 0.000 {?} {317.HD1} 6.821 0.099 0.144 ++ 0.000 {?} {318.N} 123.130 0.141 0.141 EE 0.000 {?} 73.38300 2.43420 0 {?} 0 904 {318.HN} 8.888 0.044 0.074 ++ 0.000 {?} {318.HG1} 1.349 0.173 0.244 ? 0.000 {?} {318.N} 123.130 0.150 0.150 EE 0.000 {?} 283.21509 3.21880 0 {?} 0 905 {319.HN} 8.965 0.032 0.044 ++ 0.000 {?} {318.HB2} 1.620 0.072 0.153 ? 0.000 {?} {319.N} 127.054 0.121 0.121 EE 0.000 {?} 29.54470 1.57720 0 {?} 0 906 {319.HN} 8.973 0.039 0.045 ++ 0.000 {?} {321.HN} 8.362 0.086 0.107 ++ 0.000 {?} {319.N} 127.054 0.111 0.111 EE 0.000 {?} 29.60480 1.35740 0 {?} 0 907 {319.HN} 8.966 0.028 0.033 ++ 0.000 {?} {306.HN} 8.071 0.082 0.107 ++ 0.000 {?} {319.N} 127.054 0.112 0.112 EE 0.000 {?} 20.25480 1.38410 0 {?} 0 908 {319.HN} 8.968 0.031 0.040 ++ 0.000 {?} {308.HN} 9.347 0.042 0.100 ? 0.000 {?} {319.N} 127.054 0.123 0.123 EE 0.000 {?} 21.71510 1.65030 0 {?} 0 909 {320.HN} 9.139 0.044 0.062 ++ 0.000 {?} {320.HA} 5.016 0.052 0.119 ? 0.000 {?} {320.N} 129.373 0.137 0.137 EE 0.000 {?} 50.63920 2.20310 0 {?} 0 910 {320.HN} 9.140 0.054 0.075 ++ 0.000 {?} {364.HA} 5.177 0.052 0.122 ? 0.000 {?} {320.N} 129.373 0.139 0.139 EE 0.000 {?} 71.03560 2.31650 0 {?} 0 911 {320.HN} 9.145 0.032 0.077 ? 0.000 {?} {321.HN} 8.359 0.058 0.159 ? 0.000 {?} {320.N} 129.373 0.157 0.157 EE 0.000 {?} 112.25320 4.39610 0 {?} 0 912 {321.HN} 8.367 0.040 0.063 ++ 0.000 {?} {322.HN} 8.773 0.068 0.088 ++ 0.000 {?} {321.N} 116.798 0.126 0.126 EE 0.000 {?} 33.55650 1.75960 0 {?} 0 913 {321.HN} 8.353 0.034 0.050 ? 0.000 {?} {362.HA} 4.468 0.093 0.120 ? 0.000 {?} {321.N} 116.798 0.122 0.122 EE 0.000 {?} 38.08450 1.63330 0 {?} 0 914 {322.HN} 8.767 0.035 0.052 ++ 0.000 {?} {323.HN} 9.063 0.059 0.138 ? 0.000 {?} {322.N} 119.652 0.137 0.137 EE 0.000 {?} 47.45700 2.21420 0 {?} 0 915 {322.HN} 8.770 0.027 0.056 ? 0.000 {?} {321.HB2} 2.224 0.082 0.141 ++ 0.000 {?} {322.N} 119.652 0.154 0.154 EE 0.000 {?} 115.60400 3.48760 0 {?} 0 916 {?} 8.770 0.034 0.041 ++ 0.000 {?} {?} 1.559 0.135 0.135 ? 0.000 {?} {?} 119.652 0.112 0.112 EE 0.000 {?} 43.40500 1.38280 0 {?} 0 917 {323.HN} 9.059 0.040 0.045 ++ 0.000 {?} {324.HN} 8.207 0.073 0.083 ? 0.000 {?} {323.N} 126.341 0.105 0.105 EE 0.000 {?} 30.45130 1.26000 0 {?} 0 918 {323.HN} 9.061 0.036 0.049 ++ 0.000 {?} {322.HN} 8.774 0.112 0.139 ? 0.000 {?} {323.N} 126.341 0.118 0.118 EE 0.000 {?} 39.89080 1.52630 0 {?} 0 919 {323.HN} 9.065 0.043 0.059 ++ 0.000 {?} {362.HD21} 0.534 0.020 0.074 ? 0.000 {?} {323.N} 126.341 0.138 0.138 EE 0.000 {?} 27.79320 2.25350 0 {?} 0 920 {324.HN} 8.213 0.029 0.066 ? 0.000 {?} {324.HD1} 7.278 0.069 0.139 ? 0.000 {?} {324.N} 123.397 0.159 0.159 EE 0.000 {?} 147.18030 4.82780 0 {?} 0 921 {324.HN} 8.213 0.032 0.050 ++ 0.000 {?} {325.HN} 8.775 0.071 0.141 ++ 0.000 {?} {324.N} 123.397 0.152 0.152 EE 0.000 {?} 94.78340 3.49160 0 {?} 0 922 {324.HN} 8.221 0.029 0.031 ++ 0.000 {?} {323.HN} 9.067 0.051 0.054 ++ 0.000 {?} {324.N} 123.397 0.096 0.096 EE 0.000 {?} 13.97560 1.12170 0 {?} 0 923 {324.HN} 8.211 0.037 0.050 ++ 0.000 {?} {323.HB1} 2.869 0.067 0.067 ? 0.000 {?} {324.N} 123.397 0.133 0.133 EE 0.000 {?} 44.81250 2.03760 0 {?} 0 924 {324.HN} 8.213 0.023 0.044 ? 0.000 {?} {323.HB2} 2.102 0.058 0.130 ? 0.000 {?} {324.N} 123.397 0.137 0.137 EE 0.000 {?} 30.85310 2.20450 0 {?} 0 925 {365.HN} 10.258 0.037 0.041 ++ 0.000 {?} {320.HA} 4.993 0.057 0.102 ? 0.000 {?} {365.N} 128.481 0.102 0.102 EE 0.000 {?} 18.98040 1.21130 0 {?} 0 926 {365.HN} 10.263 0.033 0.039 ++ 0.000 {?} {320.HN} 9.148 0.074 0.089 ++ 0.000 {?} {365.N} 128.481 0.111 0.111 EE 0.000 {?} 23.55460 1.37210 0 {?} 0 927 {365.HN} 10.250 0.051 0.063 ++ 0.000 {?} {319.HA} 3.611 0.114 0.146 ++ 0.000 {?} {365.N} 128.481 0.118 0.118 EE 0.000 {?} 63.24560 1.53220 0 {?} 0 928 {365.HN} 10.252 0.036 0.046 ++ 0.000 {?} {364.HB2} 3.435 0.088 0.107 ++ 0.000 {?} {365.N} 128.481 0.107 0.107 EE 0.000 {?} 25.58270 1.29370 0 {?} 0 929 {365.HN} 10.249 0.036 0.040 ++ 0.000 {?} {366.HD2} 3.809 0.124 0.154 ++ 0.000 {?} {365.N} 128.481 0.104 0.104 EE 0.000 {?} 35.17710 1.23310 0 {?} 0 930 {365.HN} 10.251 0.033 0.049 ++ 0.000 {?} {320.HB1} 2.762 0.081 0.148 ? 0.000 {?} {365.N} 128.481 0.133 0.133 EE 0.000 {?} 51.73490 2.03620 0 {?} 0 931 {325.HN} 8.770 0.020 0.071 ? 0.000 {?} {326.HN} 7.270 0.080 0.215 ? 0.000 {?} {325.N} 118.225 0.170 0.170 EE 0.000 {?} 308.03741 10.58610 0 {?} 0 932 {325.HN} 8.769 0.023 0.063 ? 0.000 {?} {324.HN} 8.218 0.065 0.169 ? 0.000 {?} {325.N} 118.225 0.162 0.162 EE 0.000 {?} 125.18230 5.76480 0 {?} 0 933 {325.HN} 8.767 0.041 0.057 ++ 0.000 {?} {324.HA} 4.481 0.080 0.125 ? 0.000 {?} {325.N} 118.225 0.140 0.140 EE 0.000 {?} 67.27140 2.42650 0 {?} 0 934 {325.HN} 8.764 0.037 0.051 ++ 0.000 {?} {324.HB1} 3.612 0.089 0.152 ++ 0.000 {?} {325.N} 118.225 0.130 0.130 EE 0.000 {?} 38.30530 1.89720 0 {?} 0 935 {325.HN} 8.769 0.039 0.044 ++ 0.000 {?} {326.HG2} 2.114 0.083 0.105 ++ 0.000 {?} {325.N} 118.225 0.115 0.115 EE 0.000 {?} 31.20800 1.44930 0 {?} 0 936 {325.HN} 8.769 0.039 0.041 ++ 0.000 {?} {326.HG1} 2.411 0.090 0.096 ++ 0.000 {?} {325.N} 118.225 0.099 0.099 EE 0.000 {?} 24.15250 1.15320 0 {?} 0 937 {?} 7.261 0.035 0.042 ++ 0.000 {?} {?} 5.120 0.111 0.134 ++ 0.000 {?} {?} 117.868 0.115 0.115 EE 0.000 {?} 36.36190 1.44380 0 {?} 0 938 {326.HN} 7.271 0.047 0.058 ++ 0.000 {?} {361.HN} 6.310 0.088 0.155 ? 0.000 {?} {326.N} 117.868 0.120 0.120 EE 0.000 {?} 41.93660 1.58660 0 {?} 0 939 {326.HN} 7.268 0.036 0.049 ++ 0.000 {?} {324.HN} 8.217 0.073 0.108 ++ 0.000 {?} {326.N} 117.868 0.135 0.135 EE 0.000 {?} 50.73740 2.13510 0 {?} 0 940 {326.HN} 7.269 0.042 0.050 ++ 0.000 {?} {326.HE21} 8.039 0.081 0.120 ++ 0.000 {?} {326.N} 117.868 0.118 0.118 EE 0.000 {?} 34.02270 1.53070 0 {?} 0 941 {326.HN} 7.268 0.020 0.071 ? 0.000 {?} {325.HN} 8.776 0.092 0.230 ? 0.000 {?} {326.N} 117.868 0.173 0.173 EE 0.000 {?} 493.67340 16.74680 0 {?} 0 942 {?} 8.777 0.048 0.052 ++ 0.000 {?} {?} 5.969 0.126 0.131 ++ 0.000 {?} {?} 116.084 0.097 0.097 EE 0.000 {?} 39.44040 1.13550 0 {?} 0 943 {349.HN} 8.796 0.035 0.048 ++ 0.000 {?} {345.HA} 4.300 0.070 0.099 ++ 0.000 {?} {349.N} 116.084 0.128 0.128 EE 0.000 {?} 31.15340 1.84170 0 {?} 0 944 {349.HN} 8.798 0.035 0.072 ++ 0.000 {?} {350.HN} 6.441 0.070 0.192 ? 0.000 {?} {349.N} 116.084 0.162 0.162 EE 0.000 {?} 197.85741 5.48930 0 {?} 0 945 {349.HN} 8.798 0.038 0.053 ++ 0.000 {?} {351.HN} 7.614 0.092 0.147 ++ 0.000 {?} {349.N} 116.084 0.141 0.141 EE 0.000 {?} 79.24570 2.47460 0 {?} 0 946 {349.HN} 8.796 0.036 0.064 ++ 0.000 {?} {348.HN} 8.401 0.094 0.196 ? 0.000 {?} {349.N} 116.084 0.163 0.163 EE 0.000 {?} 253.44991 5.93990 0 {?} 0 947 {327.HN} 8.776 0.039 0.058 ++ 0.000 {?} {327.HB2} 2.789 0.115 0.155 ? 0.000 {?} {327.N} 116.084 0.130 0.130 EE 0.000 {?} 56.29560 1.88930 0 {?} 0 948 {327.HN} 8.770 0.034 0.040 ++ 0.000 {?} {327.HB1} 3.141 0.119 0.147 ++ 0.000 {?} {327.N} 116.084 0.111 0.111 EE 0.000 {?} 39.69050 1.36720 0 {?} 0 949 {329.HN} 8.465 0.028 0.041 ++ 0.000 {?} {328.HD1} 3.543 0.050 0.119 ? 0.000 {?} {329.N} 111.446 0.131 0.131 EE 0.000 {?} 30.19620 1.92510 0 {?} 0 950 {329.HN} 8.466 0.033 0.043 ++ 0.000 {?} {327.HB2} 2.814 0.117 0.157 ++ 0.000 {?} {329.N} 111.446 0.127 0.127 EE 0.000 {?} 51.21320 1.80010 0 {?} 0 951 {329.HN} 8.465 0.027 0.038 ++ 0.000 {?} {357.HD21} 0.787 0.098 0.181 ? 0.000 {?} {329.N} 111.446 0.131 0.131 EE 0.000 {?} 38.72810 1.92860 0 {?} 0 952 {?} 8.653 0.029 0.036 ++ 0.000 {?} {?} 5.972 0.055 0.068 ++ 0.000 {?} {?} 119.473 0.117 0.117 EE 0.000 {?} 17.51570 1.48760 0 {?} 0 953 {330.HN} 8.656 0.036 0.044 ++ 0.000 {?} {342.HE1} 7.065 0.094 0.119 ++ 0.000 {?} {330.N} 119.473 0.121 0.121 EE 0.000 {?} 32.90000 1.59920 0 {?} 0 954 {330.HN} 8.653 0.031 0.043 ++ 0.000 {?} {342.HD1} 7.412 0.052 0.152 ? 0.000 {?} {330.N} 119.473 0.135 0.135 EE 0.000 {?} 32.02730 2.14280 0 {?} 0 955 {330.HN} 8.653 0.045 0.049 ++ 0.000 {?} {342.HN} 8.189 0.111 0.131 ? 0.000 {?} {330.N} 119.473 0.100 0.100 EE 0.000 {?} 35.56090 1.16780 0 {?} 0 956 {330.HN} 8.650 0.038 0.050 ++ 0.000 {?} {331.HN} 8.033 0.168 0.203 ? 0.000 {?} {330.N} 119.473 0.126 0.126 EE 0.000 {?} 71.05270 1.75420 0 {?} 0 957 {330.HN} 8.653 0.017 0.058 ? 0.000 {?} {329.HN} 8.464 0.065 0.160 ? 0.000 {?} {330.N} 119.473 0.169 0.169 EE 0.000 {?} 175.16190 10.10400 0 {?} 0 958 {336.HN} 7.680 0.031 0.056 ++ 0.000 {?} {337.HN} 8.214 0.067 0.129 ? 0.000 {?} {336.N} 113.854 0.141 0.141 EE 0.000 {?} 54.62810 2.47180 0 {?} 0 959 {336.HN} 7.683 0.037 0.050 ++ 0.000 {?} {335.HB1} 1.498 0.084 0.123 ++ 0.000 {?} {336.N} 113.854 0.122 0.122 EE 0.000 {?} 34.66690 1.62050 0 {?} 0 960 {336.HN} 7.682 0.039 0.037 ++ 0.000 {?} {335.HA} 4.144 0.088 0.088 ++ 0.000 {?} {336.N} 113.854 0.083 0.083 EE 0.000 {?} 15.17390 0.96080 0 {?} 0 961 {336.HN} 7.680 0.047 0.055 ++ 0.000 {?} {336.HB2} 2.632 0.076 0.088 ++ 0.000 {?} {336.N} 113.854 0.109 0.109 EE 0.000 {?} 32.69450 1.31890 0 {?} 0 962 {336.HN} 7.689 0.050 0.057 ++ 0.000 {?} {336.HB1} 3.109 0.059 0.067 ++ 0.000 {?} {336.N} 113.854 0.103 0.103 EE 0.000 {?} 23.29890 1.21610 0 {?} 0 963 {336.HN} 7.672 0.038 0.058 ++ 0.000 {?} {336.HA} 4.496 0.089 0.121 ++ 0.000 {?} {336.N} 113.854 0.136 0.136 EE 0.000 {?} 55.74390 2.16870 0 {?} 0 964 {337.HN} 8.216 0.039 0.056 ++ 0.000 {?} {335.HA} 4.144 0.083 0.138 ? 0.000 {?} {337.N} 108.771 0.139 0.139 EE 0.000 {?} 62.61180 2.34640 0 {?} 0 965 {337.HN} 8.213 0.046 0.077 ++ 0.000 {?} {336.HN} 7.680 0.092 0.244 ? 0.000 {?} {337.N} 108.771 0.160 0.160 EE 0.000 {?} 257.71811 5.01300 0 {?} 0 966 {337.HN} 8.220 0.031 0.033 ++ 0.000 {?} {336.HB1} 3.109 0.103 0.110 ++ 0.000 {?} {337.N} 108.771 0.095 0.095 EE 0.000 {?} 22.72310 1.10790 0 {?} 0 967 {337.HN} 8.215 0.026 0.040 ++ 0.000 {?} {336.HB2} 2.625 0.058 0.132 ? 0.000 {?} {337.N} 108.771 0.118 0.118 EE 0.000 {?} 18.67240 1.52430 0 {?} 0 968 {337.HN} 8.217 0.027 0.035 ++ 0.000 {?} {334.HB2} 1.871 0.069 0.092 ? 0.000 {?} {337.N} 108.771 0.113 0.113 EE 0.000 {?} 22.88770 1.40030 0 {?} 0 969 {337.HN} 8.216 0.020 0.043 ? 0.000 {?} {334.HD1} 1.656 0.074 0.110 ? 0.000 {?} {337.N} 108.771 0.136 0.136 EE 0.000 {?} 40.97330 2.17650 0 {?} 0 970 {337.HN} 8.213 0.037 0.050 ++ 0.000 {?} {335.HB1} 1.508 0.089 0.130 ? 0.000 {?} {337.N} 108.771 0.135 0.135 EE 0.000 {?} 65.22070 2.14180 0 {?} 0 971 {337.HN} 8.209 0.023 0.047 ? 0.000 {?} {334.HG1} 1.326 0.098 0.132 ? 0.000 {?} {337.N} 108.771 0.129 0.129 EE 0.000 {?} 32.70720 1.86680 0 {?} 0 972 {338.HN} 8.233 0.035 0.052 ++ 0.000 {?} {336.HN} 7.669 0.126 0.201 ? 0.000 {?} {338.N} 117.868 0.142 0.142 EE 0.000 {?} 109.16930 2.53890 0 {?} 0 973 {338.HN} 8.240 0.042 0.053 ++ 0.000 {?} {334.HN} 8.702 0.106 0.155 ? 0.000 {?} {338.N} 117.868 0.120 0.120 EE 0.000 {?} 44.02040 1.58600 0 {?} 0 974 {339.HN} 8.424 0.030 0.058 ? 0.000 {?} {339.HG2} 1.908 0.085 0.153 ? 0.000 {?} {339.N} 120.276 0.153 0.153 EE 0.000 {?} 143.59700 3.68120 0 {?} 0 975 {339.HN} 8.429 0.036 0.062 ++ 0.000 {?} {339.HG1} 2.084 0.059 0.147 ? 0.000 {?} {339.N} 120.276 0.167 0.167 EE 0.000 {?} 178.40100 4.82670 0 {?} 0 976 {339.HN} 8.430 0.052 0.068 ? 0.000 {?} {334.HN} 8.720 0.072 0.129 ? 0.000 {?} {339.N} 120.276 0.120 0.120 EE 0.000 {?} 47.80900 1.58680 0 {?} 0 977 {348.HN} 8.403 0.032 0.055 ++ 0.000 {?} {347.HA} 4.155 0.075 0.153 ? 0.000 {?} {348.N} 118.492 0.159 0.159 EE 0.000 {?} 189.46429 4.71180 0 {?} 0 978 {341.HN} 8.450 0.031 0.051 ? 0.000 {?} {344.HB1} 2.162 0.072 0.158 ? 0.000 {?} {341.N} 118.314 0.138 0.138 EE 0.000 {?} 58.46320 2.28710 0 {?} 0 979 {341.HN} 8.448 0.029 0.046 ? 0.000 {?} {344.HB2} 2.064 0.057 0.108 ? 0.000 {?} {341.N} 118.314 0.136 0.136 EE 0.000 {?} 33.79390 2.15770 0 {?} 0 980 {341.HN} 8.453 0.029 0.048 ? 0.000 {?} {342.HN} 8.204 0.065 0.119 ? 0.000 {?} {341.N} 118.314 0.138 0.138 EE 0.000 {?} 44.01630 2.30570 0 {?} 0 981 {340.HN} 8.281 0.041 0.048 ? 0.000 {?} {331.HG21} 0.977 0.042 0.100 ? 0.000 {?} {340.N} 121.525 0.132 0.132 EE 0.000 {?} 35.34960 1.96470 0 {?} 0 982 {342.HN} 8.215 0.034 0.039 ++ 0.000 {?} {383.HD11} 0.156 0.063 0.071 ++ 0.000 {?} {342.N} 119.206 0.106 0.106 EE 0.000 {?} 19.95090 1.26230 0 {?} 0 983 {342.HN} 8.214 0.023 0.057 ? 0.000 {?} {342.HD1} 7.406 0.052 0.158 ? 0.000 {?} {342.N} 119.206 0.160 0.160 EE 0.000 {?} 88.18770 5.10290 0 {?} 0 984 {342.HN} 8.209 0.018 0.057 ? 0.000 {?} {343.HN} 8.557 0.066 0.148 ? 0.000 {?} {342.N} 119.206 0.161 0.161 EE 0.000 {?} 100.80980 5.26750 0 {?} 0 985 {342.HN} 8.209 0.051 0.056 ++ 0.000 {?} {332.HE1} 6.498 0.075 0.082 ? 0.000 {?} {342.N} 119.206 0.102 0.102 EE 0.000 {?} 32.35830 1.21270 0 {?} 0 986 {344.HN} 8.214 0.034 0.041 ++ 0.000 {?} {345.HE1} 6.608 0.111 0.156 ? 0.000 {?} {344.N} 119.206 0.111 0.111 EE 0.000 {?} 35.47290 1.35770 0 {?} 0 987 {343.HN} 8.560 0.036 0.052 ++ 0.000 {?} {341.HB2} 3.937 0.054 0.149 ? 0.000 {?} {343.N} 117.511 0.138 0.138 EE 0.000 {?} 48.29400 2.27080 0 {?} 0 988 {343.HN} 8.554 0.048 0.066 ++ 0.000 {?} {341.HA} 5.140 0.081 0.110 ++ 0.000 {?} {343.N} 117.511 0.128 0.128 EE 0.000 {?} 45.79470 1.83080 0 {?} 0 989 {343.HN} 8.559 0.043 0.056 ++ 0.000 {?} {342.HD1} 7.408 0.077 0.113 ? 0.000 {?} {343.N} 117.511 0.127 0.127 EE 0.000 {?} 39.78760 1.78180 0 {?} 0 990 {343.HN} 8.557 0.039 0.084 ++ 0.000 {?} {342.HN} 8.202 0.113 0.244 ? 0.000 {?} {343.N} 117.511 0.164 0.164 EE 0.000 {?} 334.14990 6.32940 0 {?} 0 991 {343.HN} 8.562 0.025 0.050 ? 0.000 {?} {344.HG1} 2.369 0.071 0.147 ? 0.000 {?} {343.N} 117.511 0.124 0.124 EE 0.000 {?} 28.63450 1.70690 0 {?} 0 992 {343.HN} 8.556 0.033 0.038 ++ 0.000 {?} {344.HB1} 2.181 0.053 0.096 ? 0.000 {?} {343.N} 117.511 0.107 0.107 EE 0.000 {?} 17.23160 1.29620 0 {?} 0 993 {343.HN} 8.556 0.030 0.049 ++ 0.000 {?} {344.HB2} 2.078 0.079 0.115 ? 0.000 {?} {343.N} 117.511 0.131 0.131 EE 0.000 {?} 39.23900 1.93070 0 {?} 0 994 {344.HN} 8.185 0.023 0.070 ? 0.000 {?} {345.HN} 8.927 0.059 0.162 ? 0.000 {?} {344.N} 119.295 0.175 0.175 EE 0.000 {?} 104.18190 5.02600 0 {?} 0 995 {344.HN} 8.184 0.041 0.068 ? 0.000 {?} {341.HN} 8.441 0.082 0.148 ? 0.000 {?} {344.N} 119.295 0.142 0.142 EE 0.000 {?} 100.22660 2.55800 0 {?} 0 996 {344.HN} 8.183 0.035 0.052 ? 0.000 {?} {343.HN} 8.555 0.049 0.126 ? 0.000 {?} {344.N} 119.295 0.161 0.161 EE 0.000 {?} 108.19590 4.53020 0 {?} 0 997 {344.HN} 8.182 0.023 0.081 ? 0.000 {?} {344.HB1} 2.158 0.072 0.114 ? 0.000 {?} {344.N} 119.384 0.167 0.167 EE 0.000 {?} 268.74301 8.38280 0 {?} 0 998 {344.HN} 8.184 0.056 0.101 ++ 0.000 {?} {343.HB2} 1.553 0.058 0.136 ? 0.000 {?} {344.N} 119.295 0.158 0.158 EE 0.000 {?} 161.63150 4.44680 0 {?} 0 999 {345.HN} 8.929 0.032 0.042 ++ 0.000 {?} {344.HG1} 2.314 0.086 0.114 ? 0.000 {?} {345.N} 121.168 0.123 0.123 EE 0.000 {?} 36.33500 1.66060 0 {?} 0 1000 {345.HN} 8.927 0.030 0.041 ++ 0.000 {?} {340.HB} 1.797 0.094 0.126 ? 0.000 {?} {345.N} 121.168 0.128 0.128 EE 0.000 {?} 41.04070 1.82330 0 {?} 0 1001 {?} 8.930 0.042 0.050 ++ 0.000 {?} {?} 1.612 0.151 0.155 ? 0.000 {?} {?} 121.168 0.116 0.116 EE 0.000 {?} 58.27730 1.47040 0 {?} 0 1002 {345.HN} 8.926 0.040 0.053 ++ 0.000 {?} {332.HE1} 6.476 0.079 0.132 ? 0.000 {?} {345.N} 121.168 0.129 0.129 EE 0.000 {?} 43.08900 1.87940 0 {?} 0 1003 {345.HN} 8.927 0.030 0.050 ++ 0.000 {?} {345.HD1} 6.692 0.063 0.147 ? 0.000 {?} {345.N} 121.168 0.149 0.149 EE 0.000 {?} 56.78720 3.15140 0 {?} 0 1004 {345.HN} 8.926 0.040 0.071 ++ 0.000 {?} {344.HN} 8.181 0.063 0.160 ? 0.000 {?} {345.N} 121.168 0.161 0.161 EE 0.000 {?} 180.14391 5.45250 0 {?} 0 1005 {345.HN} 8.927 0.042 0.048 ++ 0.000 {?} {345.HE1} 6.580 0.060 0.100 ? 0.000 {?} {345.N} 121.168 0.108 0.108 EE 0.000 {?} 19.93520 1.31140 0 {?} 0 1006 {346.HN} 8.973 0.035 0.057 ++ 0.000 {?} {343.HA} 4.177 0.129 0.155 ? 0.000 {?} {346.N} 115.281 0.141 0.141 EE 0.000 {?} 105.14240 2.43630 0 {?} 0 1007 {346.HN} 8.977 0.031 0.051 ++ 0.000 {?} {345.HA} 4.294 0.085 0.129 ? 0.000 {?} {346.N} 115.281 0.138 0.138 EE 0.000 {?} 59.77810 2.26370 0 {?} 0 1008 {346.HN} 8.972 0.042 0.051 ++ 0.000 {?} {342.HA} 4.563 0.077 0.103 ++ 0.000 {?} {346.N} 115.281 0.112 0.112 EE 0.000 {?} 35.37120 1.38180 0 {?} 0 1009 {346.HN} 8.970 0.032 0.072 ? 0.000 {?} {345.HD1} 6.688 0.045 0.146 ? 0.000 {?} {346.N} 115.281 0.150 0.150 EE 0.000 {?} 61.37430 3.26200 0 {?} 0 1010 {346.HN} 8.973 0.043 0.054 ++ 0.000 {?} {312.HD1} 6.594 0.051 0.071 ++ 0.000 {?} {346.N} 115.281 0.121 0.121 EE 0.000 {?} 35.99110 2.13020 0 {?} 0 1011 {346.HN} 8.971 0.039 0.086 ? 0.000 {?} {346.HD1} 7.187 0.073 0.160 ? 0.000 {?} {346.N} 115.281 0.161 0.161 EE 0.000 {?} 192.79660 5.14960 0 {?} 0 1012 {346.HN} 8.972 0.032 0.069 ? 0.000 {?} {347.HN} 7.573 0.148 0.148 ? 0.000 {?} {346.N} 115.281 0.156 0.156 EE 0.000 {?} 189.91850 4.20160 0 {?} 0 1013 {346.HN} 8.972 0.032 0.040 ++ 0.000 {?} {343.HN} 8.599 0.124 0.148 ++ 0.000 {?} {346.N} 115.281 0.116 0.116 EE 0.000 {?} 38.95850 1.48490 0 {?} 0 1014 {346.HN} 8.972 0.030 0.035 ++ 0.000 {?} {340.HG11} 0.439 0.091 0.103 ++ 0.000 {?} {346.N} 115.281 0.107 0.107 EE 0.000 {?} 24.14670 1.28630 0 {?} 0 1015 {346.HN} 8.967 0.044 0.070 ? 0.000 {?} {340.HG21} 0.860 0.150 0.244 ? 0.000 {?} {346.N} 115.281 0.138 0.138 EE 0.000 {?} 130.78760 2.26260 0 {?} 0 1016 {346.HN} 8.977 0.033 0.044 ++ 0.000 {?} {343.HG} 1.654 0.094 0.121 ? 0.000 {?} {346.N} 115.281 0.127 0.127 EE 0.000 {?} 37.24400 1.80490 0 {?} 0 1017 {?} 8.975 0.042 0.054 ++ 0.000 {?} {?} 2.024 0.174 0.200 ? 0.000 {?} {?} 115.281 0.119 0.119 EE 0.000 {?} 71.49880 1.56220 0 {?} 0 1018 {347.HN} 7.572 0.049 0.063 ++ 0.000 {?} {352.HN} 7.874 0.063 0.108 ? 0.000 {?} {347.N} 120.811 0.124 0.124 EE 0.000 {?} 41.49090 2.03050 0 {?} 0 1019 {347.HN} 7.576 0.037 0.073 ++ 0.000 {?} {348.HN} 8.399 0.080 0.202 ? 0.000 {?} {347.N} 120.811 0.166 0.166 EE 0.000 {?} 328.07901 8.69610 0 {?} 0 1020 {347.HN} 7.576 0.038 0.077 ++ 0.000 {?} {346.HN} 8.964 0.072 0.186 ? 0.000 {?} {347.N} 120.811 0.161 0.161 EE 0.000 {?} 232.40230 6.18970 0 {?} 0 1021 {347.HN} 7.584 0.043 0.054 ++ 0.000 {?} {349.HN} 8.816 0.111 0.111 ? 0.000 {?} {347.N} 120.811 0.122 0.122 EE 0.000 {?} 59.98060 1.94940 0 {?} 0 1022 {347.HN} 7.576 0.044 0.060 ++ 0.000 {?} {346.HA} 3.801 0.074 0.113 ++ 0.000 {?} {347.N} 120.811 0.123 0.123 EE 0.000 {?} 44.17940 2.00260 0 {?} 0 1023 {347.HN} 7.576 0.045 0.055 ++ 0.000 {?} {346.HB2} 2.910 0.079 0.174 ? 0.000 {?} {347.N} 120.811 0.121 0.121 EE 0.000 {?} 53.07730 1.92890 0 {?} 0 1024 {348.HN} 8.399 0.034 0.040 ++ 0.000 {?} {347.HD1} 3.210 0.077 0.136 ? 0.000 {?} {348.N} 118.581 0.110 0.110 EE 0.000 {?} 34.42360 1.61730 0 {?} 0 1025 {348.HN} 8.398 0.031 0.033 ++ 0.000 {?} {346.HB2} 2.956 0.106 0.116 ++ 0.000 {?} {348.N} 118.581 0.099 0.099 EE 0.000 {?} 32.66100 1.39960 0 {?} 0 1026 {348.HN} 8.399 0.033 0.068 ++ 0.000 {?} {347.HN} 7.578 0.075 0.174 ? 0.000 {?} {348.N} 118.581 0.162 0.162 EE 0.000 {?} 243.14670 6.90490 0 {?} 0 1027 {348.HN} 8.399 0.035 0.069 ++ 0.000 {?} {349.HN} 8.800 0.066 0.165 ? 0.000 {?} {348.N} 118.581 0.161 0.161 EE 0.000 {?} 208.47720 6.25440 0 {?} 0 1028 {?} 8.401 0.036 0.043 ++ 0.000 {?} {?} 8.944 0.111 0.155 ? 0.000 {?} {?} 118.581 0.115 0.115 EE 0.000 {?} 50.79210 1.73890 0 {?} 0 1029 {349.HN} 8.793 0.042 0.051 ++ 0.000 {?} {348.HG2} 1.444 0.083 0.111 ? 0.000 {?} {349.N} 116.084 0.124 0.124 EE 0.000 {?} 49.82120 2.04280 0 {?} 0 1030 {349.HN} 8.797 0.041 0.058 ++ 0.000 {?} {349.HG2} 1.000 0.103 0.155 ? 0.000 {?} {349.N} 116.084 0.133 0.133 EE 0.000 {?} 76.01510 2.43190 0 {?} 0 1031 {350.HN} 6.434 0.030 0.035 ++ 0.000 {?} {350.HE1} 6.774 0.128 0.155 ? 0.000 {?} {350.N} 110.198 0.113 0.113 EE 0.000 {?} 43.54970 1.69830 0 {?} 0 1032 {350.HN} 6.437 0.041 0.066 ++ 0.000 {?} {350.HD1} 6.911 0.089 0.155 ? 0.000 {?} {350.N} 110.198 0.148 0.148 EE 0.000 {?} 146.08881 3.58480 0 {?} 0 1033 {350.HN} 6.436 0.026 0.076 ? 0.000 {?} {351.HN} 7.629 0.080 0.216 ? 0.000 {?} {350.N} 110.198 0.168 0.168 EE 0.000 {?} 331.88959 11.09370 0 {?} 0 1034 {350.HN} 6.433 0.043 0.064 ++ 0.000 {?} {352.HN} 7.893 0.078 0.117 ++ 0.000 {?} {350.N} 110.198 0.133 0.133 EE 0.000 {?} 65.92590 2.41550 0 {?} 0 1035 {350.HN} 6.435 0.040 0.074 ++ 0.000 {?} {349.HN} 8.801 0.090 0.209 ? 0.000 {?} {350.N} 110.198 0.162 0.162 EE 0.000 {?} 313.97849 6.89200 0 {?} 0 1036 {350.HN} 6.434 0.034 0.041 ++ 0.000 {?} {347.HA} 4.146 0.049 0.090 ? 0.000 {?} {350.N} 110.198 0.103 0.103 EE 0.000 {?} 18.68090 1.46840 0 {?} 0 1037 {350.HN} 6.432 0.051 0.072 ++ 0.000 {?} {349.HG1} 1.647 0.129 0.200 ? 0.000 {?} {350.N} 110.198 0.131 0.131 EE 0.000 {?} 94.80400 2.33090 0 {?} 0 1038 {351.HN} 7.631 0.033 0.041 ++ 0.000 {?} {347.HG1} 1.777 0.083 0.155 ? 0.000 {?} {351.N} 118.849 0.118 0.118 EE 0.000 {?} 40.14780 1.83120 0 {?} 0 1039 {351.HN} 7.632 0.047 0.079 ? 0.000 {?} {347.HG2} 1.668 0.111 0.111 ? 0.000 {?} {351.N} 118.849 0.119 0.119 EE 0.000 {?} 66.83150 1.86740 0 {?} 0 1040 {351.HN} 7.632 0.036 0.040 ++ 0.000 {?} {347.HB1} 2.124 0.123 0.132 ++ 0.000 {?} {351.N} 118.849 0.099 0.099 EE 0.000 {?} 40.39320 1.39900 0 {?} 0 1041 {351.HN} 7.629 0.030 0.040 ++ 0.000 {?} {350.HB2} 2.497 0.066 0.144 ? 0.000 {?} {351.N} 118.849 0.122 0.122 EE 0.000 {?} 27.46090 1.94720 0 {?} 0 1042 {352.HN} 7.889 0.041 0.051 ++ 0.000 {?} {350.HN} 6.446 0.099 0.122 ++ 0.000 {?} {352.N} 115.727 0.118 0.118 EE 0.000 {?} 45.84980 1.83350 0 {?} 0 1043 {352.HN} 7.893 0.032 0.065 ++ 0.000 {?} {351.HN} 7.625 0.087 0.184 ? 0.000 {?} {352.N} 115.727 0.163 0.163 EE 0.000 {?} 281.21780 7.12590 0 {?} 0 1044 {352.HN} 7.893 0.049 0.064 ++ 0.000 {?} {353.HN} 8.647 0.087 0.112 ++ 0.000 {?} {352.N} 115.727 0.123 0.123 EE 0.000 {?} 53.80810 2.00460 0 {?} 0 1045 {352.HN} 7.893 0.036 0.042 ++ 0.000 {?} {351.HB1} 3.229 0.087 0.107 ++ 0.000 {?} {352.N} 115.727 0.110 0.110 EE 0.000 {?} 32.82440 1.61140 0 {?} 0 1046 {352.HN} 7.885 0.036 0.043 ++ 0.000 {?} {351.HB2} 2.786 0.133 0.172 ? 0.000 {?} {352.N} 115.727 0.112 0.112 EE 0.000 {?} 47.25430 1.65620 0 {?} 0 1047 {353.HN} 8.643 0.040 0.048 ++ 0.000 {?} {352.HG1} 2.371 0.099 0.132 ++ 0.000 {?} {353.N} 124.468 0.110 0.110 EE 0.000 {?} 41.70670 1.61330 0 {?} 0 1048 {354.HN} 7.915 0.045 0.053 ++ 0.000 {?} {343.HA} 4.187 0.121 0.156 ? 0.000 {?} {354.N} 126.697 0.109 0.109 EE 0.000 {?} 53.20100 1.59580 0 {?} 0 1049 {354.HN} 7.909 0.035 0.043 ++ 0.000 {?} {355.HG21} 1.187 0.062 0.113 ? 0.000 {?} {354.N} 126.697 0.111 0.111 EE 0.000 {?} 25.39250 1.63840 0 {?} 0 1050 {355.HN} 9.613 0.034 0.036 ++ 0.000 {?} {355.HB} 4.172 0.067 0.072 ++ 0.000 {?} {355.N} 119.295 0.097 0.097 EE 0.000 {?} 20.45820 1.35790 0 {?} 0 1051 {355.HN} 9.609 0.049 0.056 ? 0.000 {?} {354.HB} 1.669 0.069 0.084 ++ 0.000 {?} {355.N} 119.295 0.112 0.112 EE 0.000 {?} 38.71150 1.65680 0 {?} 0 1052 {355.HN} 9.615 0.046 0.081 ? 0.000 {?} {356.HN} 8.337 0.074 0.124 ++ 0.000 {?} {355.N} 119.295 0.145 0.145 EE 0.000 {?} 116.85910 3.35710 0 {?} 0 1053 {355.HN} 9.609 0.055 0.087 ? 0.000 {?} {355.HA} 4.461 0.058 0.074 ++ 0.000 {?} {355.N} 119.295 0.113 0.113 EE 0.000 {?} 41.46180 1.69050 0 {?} 0 1054 {356.HN} 8.328 0.047 0.066 ++ 0.000 {?} {355.HB} 4.158 0.068 0.088 ++ 0.000 {?} {356.N} 125.003 0.126 0.126 EE 0.000 {?} 45.16470 2.09230 0 {?} 0 1055 {356.HN} 8.337 0.039 0.054 ++ 0.000 {?} {355.HG21} 1.183 0.136 0.201 ++ 0.000 {?} {356.N} 125.003 0.133 0.133 EE 0.000 {?} 90.11150 2.42710 0 {?} 0 1056 {356.HN} 8.335 0.042 0.084 ++ 0.000 {?} {355.HN} 9.619 0.096 0.244 ? 0.000 {?} {356.N} 125.003 0.162 0.162 EE 0.000 {?} 301.43790 6.58100 0 {?} 0 1057 {356.HN} 8.337 0.036 0.049 ++ 0.000 {?} {385.HN} 9.134 0.110 0.159 ++ 0.000 {?} {356.N} 125.003 0.127 0.127 EE 0.000 {?} 54.41740 2.13020 0 {?} 0 1058 {356.HN} 8.335 0.026 0.064 ? 0.000 {?} {356.HA} 4.853 0.078 0.200 ? 0.000 {?} {356.N} 125.003 0.168 0.168 EE 0.000 {?} 308.86511 10.58190 0 {?} 0 1059 {357.HN} 8.887 0.038 0.038 ? 0.000 {?} {358.HA} 4.603 0.068 0.095 ? 0.000 {?} {357.N} 124.735 0.122 0.122 EE 0.000 {?} 31.21280 1.43440 0 {?} 0 1060 {357.HN} 8.886 0.036 0.044 ++ 0.000 {?} {356.HB1} 3.038 0.099 0.119 ? 0.000 {?} {357.N} 124.735 0.112 0.112 EE 0.000 {?} 40.91850 1.66030 0 {?} 0 1061 {356.HN} 8.341 0.039 0.040 ++ 0.000 {?} {357.HN} 8.894 0.058 0.106 ? 0.000 {?} {356.N} 125.003 0.092 0.092 EE 0.000 {?} 18.20240 1.28440 0 {?} 0 1062 {357.HN} 8.889 0.037 0.044 ++ 0.000 {?} {358.HG2} 1.467 0.141 0.155 ? 0.000 {?} {357.N} 124.735 0.112 0.112 EE 0.000 {?} 59.34460 1.65610 0 {?} 0 1063 {357.HN} 8.891 0.036 0.064 ? 0.000 {?} {358.HN} 8.598 0.102 0.200 ? 0.000 {?} {357.N} 124.735 0.157 0.157 EE 0.000 {?} 213.15559 5.11140 0 {?} 0 1064 {358.HN} 8.592 0.041 0.057 ++ 0.000 {?} {354.HD11} 0.938 0.086 0.144 ? 0.000 {?} {358.N} 118.135 0.123 0.123 EE 0.000 {?} 58.19480 1.99180 0 {?} 0 1065 {358.HN} 8.593 0.036 0.044 ++ 0.000 {?} {354.HG21} 0.793 0.072 0.116 ? 0.000 {?} {358.N} 118.135 0.109 0.109 EE 0.000 {?} 34.33920 1.59400 0 {?} 0 1066 {358.HN} 8.592 0.037 0.086 ++ 0.000 {?} {358.HB1} 2.023 0.035 0.127 ? 0.000 {?} {358.N} 118.135 0.163 0.163 EE 0.000 {?} 145.05730 7.20800 0 {?} 0 1067 {358.HN} 8.594 0.043 0.064 ++ 0.000 {?} {357.HA} 4.275 0.051 0.129 ? 0.000 {?} {358.N} 118.135 0.133 0.133 EE 0.000 {?} 54.52570 2.41300 0 {?} 0 1068 {358.HN} 8.593 0.029 0.079 ++ 0.000 {?} {359.HN} 7.235 0.080 0.230 ? 0.000 {?} {358.N} 118.135 0.166 0.166 EE 0.000 {?} 321.67319 9.24130 0 {?} 0 1069 {358.HN} 8.594 0.033 0.064 ++ 0.000 {?} {357.HN} 8.890 0.080 0.187 ? 0.000 {?} {358.N} 118.135 0.159 0.159 EE 0.000 {?} 212.33760 5.71790 0 {?} 0 1070 {359.HN} 7.234 0.029 0.070 ++ 0.000 {?} {358.HN} 8.595 0.076 0.218 ? 0.000 {?} {359.N} 121.792 0.166 0.166 EE 0.000 {?} 309.51141 9.17880 0 {?} 0 1071 {359.HN} 7.233 0.043 0.070 ++ 0.000 {?} {358.HB2} 1.936 0.064 0.149 ? 0.000 {?} {359.N} 121.792 0.151 0.151 EE 0.000 {?} 124.80060 4.00650 0 {?} 0 1072 {359.HN} 7.234 0.056 0.070 ++ 0.000 {?} {359.HG1} 2.081 0.066 0.104 ? 0.000 {?} {359.N} 121.792 0.115 0.115 EE 0.000 {?} 143.71300 4.97140 0 {?} 0 1073 {361.HN} 6.296 0.042 0.050 ++ 0.000 {?} {324.HD1} 7.269 0.091 0.111 ++ 0.000 {?} {361.N} 110.911 0.113 0.113 EE 0.000 {?} 39.84080 1.69970 0 {?} 0 1074 {361.HN} 6.298 0.031 0.040 ++ 0.000 {?} {323.HN} 9.079 0.092 0.134 ++ 0.000 {?} {361.N} 110.911 0.124 0.124 EE 0.000 {?} 39.18060 2.03340 0 {?} 0 1075 {361.HN} 6.302 0.038 0.047 ++ 0.000 {?} {323.HB1} 2.851 0.099 0.129 ++ 0.000 {?} {361.N} 110.911 0.118 0.118 EE 0.000 {?} 44.47540 1.81640 0 {?} 0 1076 {361.HN} 6.295 0.039 0.046 ++ 0.000 {?} {323.HB2} 2.102 0.149 0.149 ? 0.000 {?} {361.N} 110.911 0.116 0.116 EE 0.000 {?} 63.40400 1.76780 0 {?} 0 1077 {362.HN} 8.865 0.040 0.058 ++ 0.000 {?} {362.HA} 4.447 0.067 0.087 ? 0.000 {?} {362.N} 122.862 0.129 0.129 EE 0.000 {?} 49.03960 2.22820 0 {?} 0 1078 {362.HN} 8.862 0.047 0.047 ++ 0.000 {?} {361.HN} 6.301 0.058 0.051 ++ 0.000 {?} {362.N} 122.862 0.076 0.076 EE 0.000 {?} 15.12630 1.07780 0 {?} 0 1079 {362.HN} 8.862 0.045 0.047 ++ 0.000 {?} {321.HN} 8.390 0.148 0.155 ++ 0.000 {?} {362.N} 122.862 0.096 0.096 EE 0.000 {?} 47.46460 1.34160 0 {?} 0 1080 {362.HN} 8.865 0.042 0.066 ? 0.000 {?} {382.HN} 9.082 0.101 0.200 ? 0.000 {?} {362.N} 122.862 0.144 0.144 EE 0.000 {?} 149.69850 3.20350 0 {?} 0 1081 {362.HN} 8.874 0.025 0.055 ? 0.000 {?} {362.HB1} 1.659 0.079 0.154 ? 0.000 {?} {362.N} 122.862 0.144 0.144 EE 0.000 {?} 86.36060 3.23300 0 {?} 0 1082 {387.HN} 7.369 0.025 0.070 ? 0.000 {?} {386.HN} 8.044 0.090 0.223 ? 0.000 {?} {387.N} 115.371 0.167 0.167 EE 0.000 {?} 297.75601 9.98670 0 {?} 0 1083 {386.HN} 8.045 0.032 0.065 ++ 0.000 {?} {387.HN} 7.370 0.049 0.158 ? 0.000 {?} {386.N} 112.427 0.165 0.165 EE 0.000 {?} 180.49930 8.28860 0 {?} 0 1084 {386.HN} 8.047 0.037 0.053 ++ 0.000 {?} {385.HN} 9.134 0.109 0.179 ? 0.000 {?} {386.N} 112.427 0.141 0.141 EE 0.000 {?} 120.06590 2.98660 0 {?} 0 1085 {386.HN} 8.045 0.035 0.038 ++ 0.000 {?} {385.HA} 3.981 0.128 0.136 ? 0.000 {?} {386.N} 112.427 0.097 0.097 EE 0.000 {?} 36.88400 1.35650 0 {?} 0 1086 {385.HN} 9.137 0.052 0.073 ++ 0.000 {?} {384.HB2} 1.934 0.082 0.116 ? 0.000 {?} {385.N} 116.442 0.126 0.126 EE 0.000 {?} 65.13770 2.12940 0 {?} 0 1087 {387.HN} 7.366 0.032 0.040 ++ 0.000 {?} {385.HN} 9.131 0.047 0.098 ? 0.000 {?} {387.N} 115.371 0.117 0.117 EE 0.000 {?} 22.75150 1.78520 0 {?} 0 1088 {387.HN} 7.367 0.018 0.050 ? 0.000 {?} {384.HA} 3.788 0.084 0.121 ++ 0.000 {?} {387.N} 115.371 0.130 0.130 EE 0.000 {?} 29.00870 2.28990 0 {?} 0 1089 {389.HN} 8.622 0.036 0.045 ++ 0.000 {?} {278.HG21} 0.916 0.107 0.168 ? 0.000 {?} {389.N} 121.703 0.122 0.122 EE 0.000 {?} 53.41370 1.95140 0 {?} 0 1090 {389.HN} 8.616 0.034 0.047 ++ 0.000 {?} {388.HB2} 2.833 0.094 0.130 ++ 0.000 {?} {389.N} 121.703 0.124 0.124 EE 0.000 {?} 41.60120 2.04260 0 {?} 0 1091 {389.HN} 8.617 0.032 0.039 ++ 0.000 {?} {388.HD1} 7.134 0.093 0.112 ++ 0.000 {?} {389.N} 121.703 0.111 0.111 EE 0.000 {?} 30.60880 1.64320 0 {?} 0 1092 {390.HN} 8.392 0.041 0.050 ? 0.000 {?} {389.HN} 8.600 0.033 0.100 ? 0.000 {?} {390.N} 111.268 0.121 0.121 EE 0.000 {?} 16.36800 1.93750 0 {?} 0 1093 {390.HN} 8.396 0.042 0.052 ++ 0.000 {?} {392.HN} 8.242 0.067 0.067 ? 0.000 {?} {390.N} 111.268 0.119 0.119 EE 0.000 {?} 39.24210 1.87570 0 {?} 0 1094 {391.HN} 8.483 0.056 0.056 ? 0.000 {?} {392.HN} 8.228 0.072 0.193 ? 0.000 {?} {391.N} 110.109 0.162 0.162 EE 0.000 {?} 329.05261 6.75050 0 {?} 0 1095 {393.HN} 8.197 0.048 0.051 ? 0.000 {?} {394.HB2} 2.544 0.113 0.120 ++ 0.000 {?} {393.N} 113.230 0.099 0.099 EE 0.000 {?} 46.35100 1.39240 0 {?} 0 1096 {393.HN} 8.198 0.035 0.055 ? 0.000 {?} {394.HN} 8.657 0.084 0.200 ? 0.000 {?} {393.N} 113.230 0.144 0.144 EE 0.000 {?} 91.41070 3.20330 0 {?} 0 1097 {394.HN} 8.651 0.036 0.055 ++ 0.000 {?} {395.HN} 8.328 0.106 0.155 ? 0.000 {?} {394.N} 122.773 0.146 0.146 EE 0.000 {?} 128.23599 3.39000 0 {?} 0 1098 {394.HN} 8.652 0.035 0.053 ++ 0.000 {?} {393.HN} 8.204 0.102 0.155 ? 0.000 {?} {394.N} 122.773 0.137 0.137 EE 0.000 {?} 81.47830 2.67990 0 {?} 0 1099 {?} 8.652 0.033 0.039 ++ 0.000 {?} {?} 1.329 0.074 0.110 ? 0.000 {?} {?} 122.773 0.117 0.117 EE 0.000 {?} 36.09430 1.79110 0 {?} 0 1100 {396.HN} 8.393 0.043 0.043 +E 0.000 {?} {395.HB2} 1.758 0.075 0.166 ? 0.000 {?} {396.N} 120.543 0.167 0.167 EE 0.000 {?} 344.86780 6.24120 0 {?} 0 1101 {380.HN} 8.947 0.039 0.045 ? 0.000 {?} {364.HB1} 3.668 0.115 0.115 ? 0.000 {?} {380.N} 124.468 0.114 0.114 EE 0.000 {?} 48.33690 1.71120 0 {?} 0 1102 {380.HN} 8.948 0.034 0.037 ++ 0.000 {?} {381.HN} 7.974 0.113 0.121 ++ 0.000 {?} {380.N} 124.557 0.098 0.098 EE 0.000 {?} 35.22940 1.36880 0 {?} 0 1103 {380.HN} 8.947 0.058 0.097 ? 0.000 {?} {380.HA} 4.456 0.059 0.113 ? 0.000 {?} {380.N} 124.557 0.138 0.138 EE 0.000 {?} 201.12891 6.73500 0 {?} 0 1104 {378.HN} 8.296 0.041 0.045 ++ 0.000 {?} {376.HB1} 1.626 0.118 0.129 ++ 0.000 {?} {378.N} 107.611 0.103 0.103 EE 0.000 {?} 43.12810 1.46560 0 {?} 0 1105 {397.HN} 8.257 0.043 0.056 ++ 0.000 {?} {397.HD1} 3.229 0.078 0.110 ++ 0.000 {?} {397.N} 121.525 0.130 0.130 EE 0.000 {?} 48.65820 2.26500 0 {?} 0 1106 {397.HN} 8.263 0.031 0.048 ++ 0.000 {?} {396.HB2} 2.598 0.112 0.200 ? 0.000 {?} {397.N} 121.525 0.134 0.134 EE 0.000 {?} 67.93920 2.46700 0 {?} 0 1107 {397.HN} 8.261 0.022 0.075 ? 0.000 {?} {397.HB2} 1.797 0.110 0.134 ? 0.000 {?} {397.N} 121.525 0.171 0.171 EE 0.000 {?} 613.02582 15.96610 0 {?} 0 1108 {340.HN} 8.267 0.030 0.057 ? 0.000 {?} {332.HN} 8.568 0.068 0.132 ? 0.000 {?} {340.N} 121.525 0.158 0.158 EE 0.000 {?} 187.14540 5.52600 0 {?} 0 1109 {398.HN} 8.598 0.028 0.035 ? 0.000 {?} {397.HG1} 1.618 0.070 0.084 ++ 0.000 {?} {398.N} 120.633 0.114 0.114 EE 0.000 {?} 26.04750 1.70620 0 {?} 0 1110 {398.HN} 8.596 0.021 0.083 ? 0.000 {?} {398.HA} 4.850 0.063 0.180 ? 0.000 {?} {398.N} 120.633 0.178 0.178 EE 0.000 {?} 3444.19727 136.94330 0 {?} 0 1111 {399.HN} 8.036 0.029 0.048 ++ 0.000 {?} {398.HN} 8.597 0.093 0.174 ++ 0.000 {?} {399.N} 126.073 0.153 0.153 EE 0.000 {?} 140.31480 4.37430 0 {?} 0 1112 {399.HN} 8.035 0.028 0.037 ++ 0.000 {?} {397.HG1} 1.654 0.155 0.155 ? 0.000 {?} {399.N} 126.073 0.131 0.131 EE 0.000 {?} 66.33500 2.32220 0 {?} 0 1113 {272.HN} 8.243 0.034 0.040 ++ 0.000 {?} {274.HD21} 0.931 0.084 0.115 ++ 0.000 {?} {272.N} 122.595 0.115 0.115 EE 0.000 {?} 34.21260 1.75510 0 {?} 0 1114 {272.HN} 8.242 0.038 0.072 ++ 0.000 {?} {272.HA} 4.313 0.089 0.165 ? 0.000 {?} {272.N} 122.506 0.158 0.158 EE 0.000 {?} 211.79410 5.32250 0 {?} 0 1115 {370.HN} 8.493 0.034 0.044 ++ 0.000 {?} {370.HD1} 3.216 0.087 0.129 ++ 0.000 {?} {370.N} 121.614 0.124 0.124 EE 0.000 {?} 50.06770 2.47460 0 {?} 0 1116 {376.HN} 8.604 0.026 0.035 ++ 0.000 {?} {377.HD1} 3.949 0.103 0.141 ? 0.000 {?} {376.N} 126.073 0.126 0.126 EE 0.000 {?} 39.66340 2.12110 0 {?} 0 1117 {376.HN} 8.605 0.030 0.037 ++ 0.000 {?} {377.HD2} 3.643 0.059 0.074 ++ 0.000 {?} {376.N} 126.073 0.112 0.112 EE 0.000 {?} 18.86830 1.63220 0 {?} 0 1118 {376.HN} 8.601 0.032 0.035 ++ 0.000 {?} {376.HG} 2.031 0.078 0.085 ++ 0.000 {?} {376.N} 126.073 0.100 0.100 EE 0.000 {?} 26.27600 1.41630 0 {?} 0 1119 {375.HN} 7.891 0.039 0.052 ++ 0.000 {?} {397.HG1} 1.651 0.089 0.113 ++ 0.000 {?} {375.N} 113.765 0.117 0.117 EE 0.000 {?} 43.40390 1.80350 0 {?} 0 1120 {375.HN} 7.891 0.030 0.034 ++ 0.000 {?} {397.HB1} 1.860 0.147 0.169 ++ 0.000 {?} {375.N} 113.765 0.107 0.107 EE 0.000 {?} 43.73660 1.55730 0 {?} 0 1121 {376.HN} 8.601 0.038 0.048 ++ 0.000 {?} {375.HN} 7.887 0.090 0.116 ++ 0.000 {?} {376.N} 126.073 0.124 0.124 EE 0.000 {?} 44.29210 2.03340 0 {?} 0 1122 {375.HN} 7.889 0.031 0.044 ++ 0.000 {?} {374.HN} 8.303 0.058 0.148 ? 0.000 {?} {375.N} 113.765 0.144 0.144 EE 0.000 {?} 56.47140 3.20030 0 {?} 0 1123 {375.HN} 7.892 0.031 0.045 ++ 0.000 {?} {376.HN} 8.600 0.080 0.112 ++ 0.000 {?} {375.N} 113.765 0.133 0.133 EE 0.000 {?} 48.03210 2.45140 0 {?} 0 1124 {374.HN} 8.303 0.028 0.044 ++ 0.000 {?} {375.HN} 7.890 0.070 0.147 ++ 0.000 {?} {374.N} 108.325 0.148 0.148 EE 0.000 {?} 87.50550 3.67750 0 {?} 0 1125 {?} 8.393 0.042 0.048 ++ 0.000 {?} {?} 8.697 0.073 0.090 ? 0.000 {?} {?} 110.376 0.108 0.108 EE 0.000 {?} 34.69560 1.56500 0 {?} 0 1126 {334.HN} 8.710 0.033 0.051 ++ 0.000 {?} {340.HN} 8.271 0.044 0.092 ? 0.000 {?} {334.N} 123.933 0.136 0.136 EE 0.000 {?} 50.31900 2.63580 0 {?} 0 1127 {283.HN} 8.707 0.042 0.037 ++ 0.000 {?} {284.HD1} 7.292 0.046 0.068 ? 0.000 {?} {283.N} 118.671 0.077 0.077 EE 0.000 {?} 12.65760 1.09380 0 {?} 0 1128 {333.HN} 8.264 0.040 0.051 ++ 0.000 {?} {332.HN} 8.545 0.056 0.130 ? 0.000 {?} {333.N} 118.492 0.117 0.117 EE 0.000 {?} 30.69010 1.80470 0 {?} 0 1129 {333.HN} 8.267 0.036 0.039 ++ 0.000 {?} {334.HN} 8.705 0.053 0.098 ? 0.000 {?} {333.N} 118.492 0.100 0.100 EE 0.000 {?} 22.95940 1.41150 0 {?} 0 1130 {367.HN} 8.528 0.026 0.052 ? 0.000 {?} {367.HA} 4.309 0.065 0.147 ? 0.000 {?} {367.N} 121.525 0.172 0.172 EE 0.000 {?} 229.29289 7.76860 0 {?} 0 1131 {326.HE21} 8.045 0.041 0.068 ++ 0.000 {?} {326.HE22} 6.208 0.096 0.170 ++ 0.000 {?} {326.NE2} 109.170 0.144 0.144 EE 0.000 {?} 611.41119 18.91450 0 {?} 0 1132 {326.HE22} 6.209 0.041 0.072 ++ 0.000 {?} {326.HE21} 8.046 0.101 0.188 ++ 0.000 {?} {326.NE2} 109.170 0.149 0.149 EE 0.000 {?} 781.13599 21.91270 0 {?} 0 1133 {?} 6.727 0.046 0.042 ++ 0.000 {?} {?} 3.008 0.084 0.077 ++ 0.000 {?} {?} 109.841 0.078 0.078 EE 0.000 {?} 32.91590 2.31780 0 {?} 0 1134 {?} 8.654 0.037 0.052 ++ 0.000 {?} {?} 2.249 0.087 0.150 ? 0.000 {?} {?} 119.473 0.116 0.116 EE 0.000 {?} 41.07320 1.75990 0 {?} 0 1135 {?} 8.654 0.034 0.041 ++ 0.000 {?} {?} 1.828 0.059 0.115 ? 0.000 {?} {?} 119.473 0.111 0.111 EE 0.000 {?} 24.16210 1.62930 0 {?} 0 1136 {330.HN} 8.650 0.032 0.035 ++ 0.000 {?} {329.HG1} 1.675 0.071 0.099 ? 0.000 {?} {330.N} 119.473 0.100 0.100 EE 0.000 {?} 27.51660 1.41740 0 {?} 0 1137 {330.HN} 8.653 0.031 0.036 ++ 0.000 {?} {329.HG2} 1.557 0.103 0.129 ? 0.000 {?} {330.N} 119.473 0.114 0.114 EE 0.000 {?} 39.92780 1.48770 0 {?} 0 1138 {314.HD21} 7.555 0.032 0.080 ? 0.000 {?} {314.HD22} 6.757 0.087 0.244 ? 0.000 {?} {314.ND2} 111.803 0.175 0.175 EE 0.000 {?} 2372.80957 67.24650 0 {?} 0 1139 {314.HD22} 6.758 0.035 0.097 ++ 0.000 {?} {314.HD21} 7.554 0.087 0.244 ? 0.000 {?} {314.ND2} 111.803 0.175 0.175 EE 0.000 {?} 2824.32788 70.54980 0 {?} 0 1140 {285.HN} 8.165 0.032 0.059 ++ 0.000 {?} {284.HN} 8.591 0.080 0.181 ? 0.000 {?} {285.N} 117.600 0.156 0.156 EE 0.000 {?} 176.64760 4.86940 0 {?} 0 1141 {332.HN} 8.555 0.029 0.049 ? 0.000 {?} {332.HD1} 6.310 0.034 0.123 ? 0.000 {?} {332.N} 118.760 0.136 0.136 EE 0.000 {?} 24.69090 2.58010 0 {?} 0 1142 {284.HN} 8.584 0.025 0.051 ? 0.000 {?} {285.HN} 8.172 0.105 0.129 ? 0.000 {?} {284.N} 118.760 0.162 0.162 EE 0.000 {?} 151.60100 4.02840 0 {?} 0 1143 {284.HN} 8.579 0.037 0.048 ++ 0.000 {?} {284.HD1} 7.290 0.065 0.134 ? 0.000 {?} {284.N} 118.671 0.125 0.125 EE 0.000 {?} 40.87820 2.06310 0 {?} 0 1144 {371.HN} 8.403 0.029 0.031 ++ 0.000 {?} {370.HD1} 3.201 0.087 0.096 ++ 0.000 {?} {371.N} 110.376 0.097 0.097 EE 0.000 {?} 25.45570 1.36140 0 {?} 0 1145 {?} 8.682 0.058 0.067 ? 0.000 {?} {?} 8.437 0.109 0.125 ? 0.000 {?} {?} 118.671 0.113 0.113 EE 0.000 {?} 68.36060 1.68210 0 {?} 0 1146 {?} 6.734 0.035 0.031 ++ 0.000 {?} {?} 7.282 0.077 0.077 ++ 0.000 {?} {?} 109.841 0.070 0.070 ? 0.000 {?} 25.92690 1.78000 0 {?} 0 1147 {?} 6.729 0.026 0.026 ++ 0.000 {?} {?} 7.931 0.052 0.052 ++ 0.000 {?} {?} 109.841 0.041 0.041 ? 0.000 {?} 17.16590 1.41230 0 {?} 0 1148 {382.HN} 9.074 0.057 0.056 ++ 0.000 {?} {382.HD21} 0.084 0.117 0.115 ++ 0.000 {?} {382.N} 124.022 0.087 0.087 EE 0.000 {?} 54.97000 2.12200 0 {?} 0 1149 {324.HE1} 9.552 0.041 0.076 ++ 0.000 {?} {324.HD1} 7.279 0.073 0.200 ? 0.000 {?} {324.NE1} 127.946 0.154 0.154 EE 0.000 {?} 318.50201 7.93900 0 {?} 0 1150 {324.HE1} 9.556 0.047 0.061 ++ 0.000 {?} {324.HZ2} 7.117 0.084 0.118 ? 0.000 {?} {324.NE1} 127.946 0.123 0.123 EE 0.000 {?} 90.96470 3.52670 0 {?} 0 1151 {324.HE1} 9.553 0.021 0.021 ++ 0.000 {?} {324.HB2} 3.006 0.064 0.049 ++ 0.000 {?} {324.NE1} 127.946 0.036 0.036 ? 0.000 {?} 8.33860 1.35660 0 {?} 0 1152 {324.HE1} 9.551 0.037 0.037 ++ 0.000 {?} {322.HA} 4.099 0.092 0.092 ++ 0.000 {?} {324.NE1} 127.946 0.046 0.046 ? 0.000 {?} 34.64300 1.33570 0 {?} 0 1153 {324.HE1} 9.557 0.030 0.035 ++ 0.000 {?} {322.HG21} -0.538 0.086 0.107 ? 0.000 {?} {324.NE1} 127.946 0.112 0.112 EE 0.000 {?} 31.56870 1.66030 0 {?} 0 1154 {382.HN} 9.071 0.039 0.045 ++ 0.000 {?} {362.HN} 8.855 0.085 0.155 ? 0.000 {?} {382.N} 124.022 0.106 0.106 EE 0.000 {?} 34.60780 1.51640 0 {?} 0 1155 {382.HN} 9.083 0.029 0.033 ++ 0.000 {?} {361.HA} 3.993 0.054 0.064 ++ 0.000 {?} {382.N} 124.022 0.106 0.106 EE 0.000 {?} 11.32800 0.92170 0 {?} 0 1156 {382.HN} 9.080 0.050 0.054 ++ 0.000 {?} {381.HB1} 1.921 0.104 0.110 ++ 0.000 {?} {382.N} 124.022 0.098 0.098 EE 0.000 {?} 43.17320 1.37680 0 {?} 0 1157 {382.HN} 9.077 0.038 0.042 ++ 0.000 {?} {362.HB1} 1.664 0.082 0.094 ++ 0.000 {?} {382.N} 124.022 0.101 0.101 EE 0.000 {?} 29.89580 1.42800 0 {?} 0 1158 {365.HN} 10.251 0.038 0.049 ++ 0.000 {?} {363.HG21} 0.853 0.085 0.139 ? 0.000 {?} {365.N} 128.481 0.125 0.125 EE 0.000 {?} 33.53670 1.38340 0 {?} 0 1159 {364.HN} 8.788 0.027 0.039 ++ 0.000 {?} {364.HA} 5.177 0.061 0.144 ? 0.000 {?} {364.N} 121.614 0.133 0.133 EE 0.000 {?} 36.72110 2.40820 0 {?} 0 1160 {364.HN} 8.792 0.021 0.054 ? 0.000 {?} {380.HN} 8.931 0.048 0.132 ? 0.000 {?} {364.N} 121.614 0.172 0.172 EE 0.000 {?} 46.55230 3.04400 0 {?} 0 1161 {364.HN} 8.792 0.034 0.043 ++ 0.000 {?} {364.HB2} 3.432 0.080 0.138 ++ 0.000 {?} {364.N} 121.614 0.131 0.131 EE 0.000 {?} 53.24250 2.25440 0 {?} 0 1162 {364.HN} 8.793 0.029 0.040 ++ 0.000 {?} {380.HB1} 1.235 0.095 0.123 ++ 0.000 {?} {364.N} 121.614 0.130 0.130 EE 0.000 {?} 45.60030 2.30570 0 {?} 0 1163 {364.HN} 8.790 0.033 0.056 ++ 0.000 {?} {363.HG21} 0.866 0.078 0.144 ? 0.000 {?} {364.N} 121.614 0.156 0.156 EE 0.000 {?} 199.93800 4.98050 0 {?} 0 1164 {?} 8.632 0.033 0.030 ++ 0.000 {?} {?} 1.638 0.121 0.105 ++ 0.000 {?} {?} 126.787 0.079 0.079 EE 0.000 {?} 30.85450 1.94230 0 {?} 0 1165 {335.HN} 8.865 0.044 0.056 ++ 0.000 {?} {334.HB1} 1.992 0.044 0.102 ? 0.000 {?} {335.N} 124.289 0.112 0.112 EE 0.000 {?} 27.51310 1.67470 0 {?} 0 1166 {335.HN} 8.870 0.058 0.066 ++ 0.000 {?} {334.HG1} 1.258 0.112 0.120 ++ 0.000 {?} {335.N} 124.289 0.100 0.100 EE 0.000 {?} 63.91990 1.40850 0 {?} 0 1167 {337.HN} 8.218 0.039 0.039 ++ 0.000 {?} {334.HN} 8.714 0.076 0.075 ++ 0.000 {?} {337.N} 108.860 0.088 0.088 EE 0.000 {?} 18.66510 1.21610 0 {?} 0 1168 {368.HN} 8.248 0.033 0.058 ++ 0.000 {?} {367.HN} 8.528 0.066 0.151 ? 0.000 {?} {368.N} 120.989 0.156 0.156 EE 0.000 {?} 134.99969 4.87700 0 {?} 0 1169 {392.HN} 8.228 0.021 0.059 ? 0.000 {?} {391.HN} 8.473 0.048 0.176 ? 0.000 {?} {392.N} 121.435 0.164 0.164 EE 0.000 {?} 119.82980 7.81160 0 {?} 0 1170 {272.HN} 8.241 0.029 0.032 ++ 0.000 {?} {271.HB1} 3.251 0.070 0.103 ? 0.000 {?} {272.N} 122.595 0.105 0.105 EE 0.000 {?} 22.24270 1.50930 0 {?} 0 1171 {272.HN} 8.241 0.030 0.033 ++ 0.000 {?} {271.HB2} 3.119 0.084 0.094 ? 0.000 {?} {272.N} 122.595 0.102 0.102 EE 0.000 {?} 28.40400 1.45470 0 {?} 0 1172 {369.HN} 8.430 0.037 0.037 ++ 0.000 {?} {369.HD1} 3.229 0.084 0.084 ++ 0.000 {?} {369.N} 122.952 0.082 0.082 EE 0.000 {?} 38.62450 2.00460 0 {?} 0 1173 {369.HN} 8.431 0.040 0.048 ++ 0.000 {?} {368.HN} 8.252 0.077 0.108 ? 0.000 {?} {369.N} 122.952 0.119 0.119 EE 0.000 {?} 42.82410 1.86410 0 {?} 0 1174 {363.HN} 8.334 0.042 0.051 ? 0.000 {?} {363.HG21} 0.855 0.089 0.135 ? 0.000 {?} {363.N} 122.149 0.108 0.108 EE 0.000 {?} 102.37210 3.27490 0 {?} 0 1175 {363.HN} 8.336 0.038 0.046 ? 0.000 {?} {362.HG} 1.399 0.075 0.115 ? 0.000 {?} {363.N} 122.149 0.108 0.108 EE 0.000 {?} 35.59370 1.56930 0 {?} 0 1176 {363.HN} 8.337 0.037 0.045 ? 0.000 {?} {322.HA} 4.108 0.044 0.114 ? 0.000 {?} {363.N} 122.149 0.129 0.129 EE 0.000 {?} 31.74460 2.21480 0 {?} 0 1177 {363.HN} 8.333 0.035 0.038 ++ 0.000 {?} {323.HN} 9.090 0.113 0.129 ++ 0.000 {?} {363.N} 122.149 0.101 0.101 EE 0.000 {?} 38.04300 1.43390 0 {?} 0 1178 {331.HN} 8.039 0.045 0.049 ++ 0.000 {?} {341.HA} 5.153 0.090 0.107 ++ 0.000 {?} {331.N} 108.860 0.103 0.103 EE 0.000 {?} 35.73170 1.47330 0 {?} 0 1179 {331.HN} 8.042 0.033 0.038 ++ 0.000 {?} {331.HB} 3.812 0.095 0.110 ++ 0.000 {?} {331.N} 108.860 0.109 0.109 EE 0.000 {?} 31.49470 1.59770 0 {?} 0 1180 {331.HN} 8.039 0.026 0.049 ? 0.000 {?} {331.HA} 4.938 0.039 0.098 ? 0.000 {?} {331.N} 108.860 0.146 0.146 EE 0.000 {?} 23.27670 1.52180 0 {?} 0 1181 {331.HN} 8.047 0.027 0.051 ? 0.000 {?} {342.HN} 8.209 0.035 0.130 ? 0.000 {?} {331.N} 108.860 0.137 0.137 EE 0.000 {?} 37.75770 2.69730 0 {?} 0 1182 {331.HN} 8.039 0.033 0.034 ++ 0.000 {?} {330.HN} 8.638 0.155 0.155 ? 0.000 {?} {331.N} 108.860 0.093 0.093 EE 0.000 {?} 43.15190 1.29740 0 {?} 0 1183 {331.HN} 8.042 0.033 0.034 ++ 0.000 {?} {341.HN} 8.487 0.163 0.167 ? 0.000 {?} {331.N} 108.860 0.092 0.092 EE 0.000 {?} 45.72060 1.28420 0 {?} 0 1184 {?} 8.560 0.036 0.044 ++ 0.000 {?} {?} 4.130 0.058 0.139 ? 0.000 {?} {?} 118.760 0.115 0.115 EE 0.000 {?} 27.26570 1.72990 0 {?} 0 1185 {332.HN} 8.558 0.031 0.055 ++ 0.000 {?} {340.HN} 8.277 0.110 0.134 ? 0.000 {?} {332.N} 118.760 0.162 0.162 EE 0.000 {?} 317.33011 6.54960 0 {?} 0 1186 {295.HN} 7.567 0.031 0.039 ++ 0.000 {?} {294.HB1} 1.904 0.079 0.115 ++ 0.000 {?} {295.N} 120.008 0.122 0.122 EE 0.000 {?} 33.49890 1.96540 0 {?} 0 1187 {295.HN} 7.569 0.041 0.049 ++ 0.000 {?} {294.HG1} 1.123 0.086 0.101 ? 0.000 {?} {295.N} 120.008 0.115 0.115 EE 0.000 {?} 43.42540 1.30150 0 {?} 0 1188 {296.HN} 8.418 0.038 0.049 ++ 0.000 {?} {296.HG2} 0.207 0.062 0.076 ++ 0.000 {?} {296.N} 117.244 0.117 0.117 EE 0.000 {?} 33.18710 1.78920 0 {?} 0 1189 {294.HN} 7.483 0.034 0.067 ++ 0.000 {?} {294.HB2} 1.656 0.062 0.138 ? 0.000 {?} {294.N} 118.849 0.162 0.162 EE 0.000 {?} 211.82210 5.69610 0 {?} 0 1190 {295.HN} 7.568 0.038 0.047 ++ 0.000 {?} {290.HG21} 1.214 0.136 0.160 ? 0.000 {?} {295.N} 120.008 0.115 0.115 EE 0.000 {?} 61.55030 1.75590 0 {?} 0 1191 {294.HN} 7.481 0.035 0.072 ++ 0.000 {?} {294.HG1} 1.122 0.075 0.169 ? 0.000 {?} {294.N} 118.849 0.163 0.163 EE 0.000 {?} 269.58160 6.88770 0 {?} 0 1192 {294.HN} 7.478 0.044 0.049 ++ 0.000 {?} {293.HB2} 3.206 0.083 0.117 ? 0.000 {?} {294.N} 118.849 0.111 0.111 EE 0.000 {?} 46.11760 1.54530 0 {?} 0 1193 {294.HN} 7.477 0.035 0.044 ++ 0.000 {?} {292.HA} 3.939 0.096 0.114 ++ 0.000 {?} {294.N} 118.849 0.113 0.113 EE 0.000 {?} 35.17170 1.68640 0 {?} 0 1194 {294.HN} 7.476 0.044 0.046 ++ 0.000 {?} {295.HA} 4.283 0.033 0.099 ? 0.000 {?} {294.N} 118.849 0.095 0.095 EE 0.000 {?} 11.40130 1.32270 0 {?} 0 1195 {359.HN} 7.236 0.037 0.055 ++ 0.000 {?} {354.HG21} 0.791 0.081 0.113 ? 0.000 {?} {359.N} 121.792 0.117 0.117 EE 0.000 {?} 37.71170 1.79200 0 {?} 0 1196 {?} 7.234 0.035 0.036 ++ 0.000 {?} {?} 7.595 0.099 0.100 ++ 0.000 {?} {?} 121.792 0.091 0.091 EE 0.000 {?} 26.65610 1.25940 0 {?} 0 1197 {359.HN} 7.239 0.031 0.033 ++ 0.000 {?} {383.HD11} 0.148 0.107 0.116 ++ 0.000 {?} {359.N} 121.881 0.095 0.095 EE 0.000 {?} 27.69780 1.32120 0 {?} 0 1198 {347.HE} 8.064 0.027 0.034 ++ 0.000 {?} {347.HG1} 1.788 0.065 0.126 ? 0.000 {?} {347.NE} 107.611 0.126 0.126 EE 0.000 {?} 30.99810 2.09200 0 {?} 0 1199 {347.HE} 8.063 0.032 0.040 ++ 0.000 {?} {347.HB1} 2.104 0.055 0.104 ? 0.000 {?} {347.NE} 107.611 0.116 0.116 EE 0.000 {?} 22.85990 1.76990 0 {?} 0 1200 {289.HN} 7.764 0.034 0.036 ++ 0.000 {?} {288.HB1} 3.267 0.100 0.106 ++ 0.000 {?} {289.N} 117.511 0.098 0.098 EE 0.000 {?} 29.99060 1.37790 0 {?} 0 1201 {288.HN} 7.586 0.054 0.060 ++ 0.000 {?} {288.HB1} 3.287 0.091 0.102 ++ 0.000 {?} {288.N} 115.549 0.102 0.102 EE 0.000 {?} 43.73830 1.44660 0 {?} 0 1202 {288.HN} 7.582 0.064 0.068 ++ 0.000 {?} {288.HB2} 3.059 0.108 0.116 ++ 0.000 {?} {288.N} 115.549 0.100 0.100 EE 0.000 {?} 58.15860 1.41170 0 {?} 0 1203 {288.HN} 7.583 0.040 0.044 ++ 0.000 {?} {287.HA} 3.910 0.077 0.084 ++ 0.000 {?} {288.N} 115.549 0.098 0.098 EE 0.000 {?} 30.91930 1.37820 0 {?} 0 1204 {288.HN} 7.591 0.041 0.047 ++ 0.000 {?} {288.HA} 4.469 0.090 0.106 ++ 0.000 {?} {288.N} 115.549 0.105 0.105 EE 0.000 {?} 38.46170 1.51000 0 {?} 0 1205 {288.HN} 7.580 0.042 0.042 ++ 0.000 {?} {289.HN} 7.741 0.085 0.099 ? 0.000 {?} {288.N} 115.549 0.088 0.088 EE 0.000 {?} 32.56310 1.21830 0 {?} 0 1206 {289.HN} 7.765 0.020 0.043 ? 0.000 {?} {288.HN} 7.579 0.089 0.125 ? 0.000 {?} {289.N} 117.511 0.105 0.105 EE 0.000 {?} 26.45830 1.50770 0 {?} 0 1207 {294.HN} 7.476 0.030 0.040 ++ 0.000 {?} {294.HE1} 2.963 0.094 0.129 ? 0.000 {?} {294.N} 118.849 0.130 0.130 EE 0.000 {?} 53.02450 2.26250 0 {?} 0 1208 {312.HN} 6.926 0.025 0.039 ++ 0.000 {?} {311.HB1} 1.809 0.081 0.114 ? 0.000 {?} {312.N} 111.803 0.131 0.131 EE 0.000 {?} 45.68690 2.32770 0 {?} 0 1209 {?} 6.929 0.033 0.042 ++ 0.000 {?} {?} 0.874 0.091 0.140 ? 0.000 {?} {?} 111.803 0.124 0.124 EE 0.000 {?} 46.05420 2.04270 0 {?} 0 1210 {?} 6.924 0.036 0.043 ++ 0.000 {?} {?} 0.731 0.081 0.103 ? 0.000 {?} {?} 111.803 0.111 0.111 EE 0.000 {?} 31.79350 1.62730 0 {?} 0 1211 {311.HN} 9.000 0.036 0.036 ++ 0.000 {?} {311.HA} 4.076 0.083 0.076 ++ 0.000 {?} {311.N} 122.238 0.071 0.071 ? 0.000 {?} 16.34580 1.02550 0 {?} 0 1212 {385.HN} 9.136 0.037 0.047 ++ 0.000 {?} {280.HB1} 1.861 0.023 0.085 ? 0.000 {?} {385.N} 116.441 0.121 0.121 EE 0.000 {?} 11.20950 1.92770 0 {?} 0 1213 {287.HN} 8.230 0.046 0.061 ? 0.000 {?} {287.HA} 3.936 0.072 0.103 ++ 0.000 {?} {287.N} 120.543 0.128 0.128 EE 0.000 {?} 50.68400 2.18990 0 {?} 0 1214 {287.HN} 8.219 0.042 0.054 ++ 0.000 {?} {288.HN} 7.562 0.117 0.154 ++ 0.000 {?} {287.N} 120.543 0.116 0.116 EE 0.000 {?} 52.84970 1.78320 0 {?} 0 1215 {368.HN} 8.247 0.035 0.040 ++ 0.000 {?} {368.HD1} 3.220 0.054 0.131 ? 0.000 {?} {368.N} 120.989 0.111 0.111 EE 0.000 {?} 24.30980 1.63400 0 {?} 0 1216 {368.HN} 8.243 0.035 0.043 ++ 0.000 {?} {376.HD21} 0.928 0.114 0.149 ++ 0.000 {?} {368.N} 120.989 0.120 0.120 EE 0.000 {?} 54.81740 1.89260 0 {?} 0 1217 {332.HN} 8.559 0.032 0.045 ++ 0.000 {?} {332.HB1} 2.906 0.057 0.101 ? 0.000 {?} {332.N} 118.760 0.128 0.128 EE 0.000 {?} 30.20310 2.18200 0 {?} 0 1218 {332.HN} 8.553 0.024 0.026 ++ 0.000 {?} {339.HG1} 2.078 0.071 0.111 ? 0.000 {?} {332.N} 118.760 0.100 0.100 EE 0.000 {?} 23.49050 1.40310 0 {?} 0 1219 {332.HN} 8.559 0.026 0.028 ++ 0.000 {?} {339.HG2} 1.933 0.122 0.122 ? 0.000 {?} {332.N} 118.760 0.095 0.095 EE 0.000 {?} 29.55170 1.32040 0 {?} 0 1220 {332.HN} 8.559 0.033 0.039 ++ 0.000 {?} {339.HB1} 1.760 0.084 0.108 ? 0.000 {?} {332.N} 118.760 0.113 0.113 EE 0.000 {?} 37.56090 1.68450 0 {?} 0 1221 {?} 8.562 0.036 0.035 ++ 0.000 {?} {?} 1.626 0.094 0.094 ? 0.000 {?} {?} 118.760 0.084 0.084 EE 0.000 {?} 19.93540 1.16990 0 {?} 0 1222 {287.HN} 8.228 0.028 0.037 ? 0.000 {?} {286.HA} 4.134 0.079 0.071 ++ 0.000 {?} {287.N} 120.543 0.079 0.079 EE 0.000 {?} 15.56950 1.07170 0 {?} 0 1223 {391.HN} 8.484 0.042 0.053 ++ 0.000 {?} {392.HD21} 0.890 0.067 0.107 ? 0.000 {?} {391.N} 110.109 0.115 0.115 EE 0.000 {?} 51.72900 2.11450 0 {?} 0 1224 {391.HN} 8.481 0.045 0.056 ++ 0.000 {?} {307.HG11} 0.777 0.058 0.088 ? 0.000 {?} {391.N} 110.109 0.123 0.123 EE 0.000 {?} 45.04910 2.44840 0 {?} 0 1225 {391.HN} 8.485 0.038 0.047 ++ 0.000 {?} {306.HD11} 0.629 0.113 0.136 ? 0.000 {?} {391.N} 110.109 0.119 0.119 EE 0.000 {?} 64.57330 2.26720 0 {?} 0 1226 {383.HN} 8.332 0.063 0.057 ++ 0.000 {?} {383.HD11} 0.147 0.077 0.077 ++ 0.000 {?} {383.N} 121.346 0.077 0.077 EE 0.000 {?} 67.61040 2.41770 0 {?} 0 1227 {359.HN} 7.227 0.038 0.043 ++ 0.000 {?} {360.HD2} 3.229 0.067 0.105 ? 0.000 {?} {359.N} 121.881 0.107 0.107 EE 0.000 {?} 36.78290 1.88580 0 {?} 0 1228 {?} 7.231 0.042 0.044 ++ 0.000 {?} {?} 2.855 0.049 0.111 ? 0.000 {?} {?} 121.881 0.097 0.097 EE 0.000 {?} 26.69850 1.65820 0 {?} 0 1229 {277.HN} 8.686 0.034 0.039 ++ 0.000 {?} {281.HB2} 2.870 0.039 0.109 ? 0.000 {?} {277.N} 123.754 0.106 0.106 EE 0.000 {?} 25.68330 1.86820 0 {?} 0 1230 {286.HN} 8.197 0.042 0.043 ++ 0.000 {?} {283.HA} 3.964 0.116 0.117 ? 0.000 {?} {286.N} 119.830 0.090 0.090 EE 0.000 {?} 45.84420 1.52020 0 {?} 0 1231 {286.HN} 8.199 0.041 0.047 ++ 0.000 {?} {285.HA} 4.513 0.089 0.116 ++ 0.000 {?} {286.N} 119.830 0.110 0.110 EE 0.000 {?} 49.86650 1.96040 0 {?} 0 1232 {286.HN} 8.196 0.049 0.066 ++ 0.000 {?} {286.HD1} 7.168 0.120 0.178 ++ 0.000 {?} {286.N} 119.830 0.136 0.136 EE 0.000 {?} 144.91310 3.13980 0 {?} 0 1233 {?} 8.153 0.021 0.034 ++ 0.000 {?} {?} 3.216 0.066 0.092 ? 0.000 {?} {?} 108.771 0.131 0.131 EE 0.000 {?} 29.97570 1.96390 0 {?} 0 1234 {352.HN} 7.887 0.047 0.055 ++ 0.000 {?} {350.HB1} 3.455 0.040 0.105 ? 0.000 {?} {352.N} 115.727 0.103 0.103 EE 0.000 {?} 19.44460 1.23180 0 {?} 0 1235 {268.HN} 8.621 0.031 0.029 ++ 0.000 {?} {267.HG21} 1.234 0.086 0.080 ++ 0.000 {?} {268.N} 123.665 0.081 0.081 EE 0.000 {?} 10.14370 1.13460 0 {?} 0 1236 {269.HN} 8.272 0.034 0.034 ++ 0.000 {?} {270.HB1} 3.880 0.107 0.104 ++ 0.000 {?} {269.N} 120.276 0.087 0.087 EE 0.000 {?} 22.27330 1.20740 0 {?} 0 1237 {269.HN} 8.266 0.029 0.039 ++ 0.000 {?} {268.HN} 8.611 0.050 0.109 ? 0.000 {?} {269.N} 120.276 0.133 0.133 EE 0.000 {?} 35.15020 2.45870 0 {?} 0 1238 {274.HN} 8.413 0.017 0.042 ? 0.000 {?} {273.HN} 8.246 0.020 0.104 ? 0.000 {?} {274.N} 126.787 0.178 0.178 EE 0.000 {?} 74.88240 9.52060 0 {?} 0 1239 {273.HN} 8.227 0.010 0.038 ? 0.000 {?} {274.HN} 8.410 0.034 0.113 ? 0.000 {?} {273.N} 122.060 0.178 0.178 EE 0.000 {?} 67.04820 10.21120 0 {?} 0 1240 {275.HN} 8.383 0.032 0.040 ? 0.000 {?} {273.HA} 4.088 0.048 0.119 ? 0.000 {?} {275.N} 122.149 0.117 0.117 EE 0.000 {?} 23.73920 1.80860 0 {?} 0 1241 {?} 8.387 0.028 0.035 ++ 0.000 {?} {?} 8.137 0.047 0.119 ? 0.000 {?} {?} 122.249 0.119 0.119 EE 0.000 {?} 23.35780 1.88040 0 {?} 0 1242 {275.HN} 8.390 0.019 0.051 ? 0.000 {?} {275.HB2} 1.784 0.073 0.093 ? 0.000 {?} {275.N} 122.149 0.171 0.171 EE 0.000 {?} 381.81039 14.73260 0 {?} 0 1243 {?} 7.742 0.025 0.049 ++ 0.000 {?} {?} 3.265 0.056 0.120 ? 0.000 {?} {?} 119.384 0.158 0.158 EE 0.000 {?} 34.84180 1.84540 0 {?} 0 1244 {281.HN} 7.756 0.032 0.034 ++ 0.000 {?} {280.HA} 4.094 0.031 0.073 ? 0.000 {?} {281.N} 119.473 0.096 0.096 EE 0.000 {?} 6.39200 1.34650 0 {?} 0 1245 {282.HN} 8.167 0.049 0.063 ? 0.000 {?} {281.HA} 4.429 0.077 0.101 ++ 0.000 {?} {282.N} 120.633 0.112 0.112 EE 0.000 {?} 76.63530 2.72570 0 {?} 0 1246 {283.HN} 8.706 0.045 0.044 ++ 0.000 {?} {279.HG11} 0.782 0.121 0.121 ? 0.000 {?} {283.N} 118.671 0.088 0.088 EE 0.000 {?} 32.86590 1.21820 0 {?} 0 1247 {284.HN} 8.583 0.025 0.048 ++ 0.000 {?} {283.HA} 3.952 0.046 0.086 ? 0.000 {?} {284.N} 118.671 0.159 0.159 EE 0.000 {?} 24.58130 1.61410 0 {?} 0 1248 {?} 8.159 0.030 0.033 ++ 0.000 {?} {?} 7.154 0.062 0.087 ? 0.000 {?} {?} 117.600 0.098 0.098 EE 0.000 {?} 17.75940 1.38230 0 {?} 0 1249 {285.HN} 8.160 0.029 0.033 ++ 0.000 {?} {285.HD22} 7.051 0.097 0.106 ? 0.000 {?} {285.N} 117.600 0.105 0.105 EE 0.000 {?} 30.76360 1.51480 0 {?} 0 1250 {285.HN} 8.170 0.033 0.038 ++ 0.000 {?} {284.HD1} 7.290 0.046 0.095 ? 0.000 {?} {285.N} 117.600 0.107 0.107 EE 0.000 {?} 20.31980 1.54110 0 {?} 0 1251 {286.HN} 8.196 0.042 0.046 ++ 0.000 {?} {288.HN} 7.573 0.074 0.086 ++ 0.000 {?} {286.N} 119.830 0.109 0.109 EE 0.000 {?} 33.12280 1.60080 0 {?} 0 1252 {286.HN} 8.200 0.019 0.030 ? 0.000 {?} {299.HG11} 0.648 0.074 0.082 ++ 0.000 {?} {286.N} 119.830 0.103 0.103 EE 0.000 {?} 16.22320 1.46040 0 {?} 0 1253 {287.HN} 8.214 0.005 0.043 ? 0.000 {?} {286.HD1} 7.179 0.042 0.113 ? 0.000 {?} {287.N} 120.543 0.140 0.140 EE 0.000 {?} 6.24610 1.32770 0 {?} 0 1254 {288.HN} 7.585 0.034 0.034 ++ 0.000 {?} {287.HN} 8.228 0.113 0.104 ++ 0.000 {?} {288.N} 115.549 0.078 0.078 EE 0.000 {?} 21.07040 1.10170 0 {?} 0 1255 {362.HN} 8.870 0.048 0.050 ++ 0.000 {?} {382.HD11} 0.115 0.073 0.077 ? 0.000 {?} {362.N} 122.862 0.094 0.094 EE 0.000 {?} 50.34990 2.07950 0 {?} 0 1256 {294.HN} 7.477 0.036 0.049 ++ 0.000 {?} {293.HB1} 3.333 0.061 0.123 ? 0.000 {?} {294.N} 118.849 0.140 0.140 EE 0.000 {?} 65.40850 2.71880 0 {?} 0 1257 {294.HN} 7.477 0.043 0.086 ++ 0.000 {?} {294.HA} 4.442 0.076 0.175 ? 0.000 {?} {294.N} 118.849 0.169 0.169 EE 0.000 {?} 565.74762 10.35070 0 {?} 0 1258 {295.HN} 7.566 0.051 0.049 ++ 0.000 {?} {297.HN} 8.313 0.059 0.129 ? 0.000 {?} {295.N} 120.008 0.084 0.084 EE 0.000 {?} 29.98920 1.75640 0 {?} 0 1259 {298.HN} 8.228 0.022 0.069 ? 0.000 {?} {297.HB2} 2.028 0.055 0.083 ? 0.000 {?} {298.N} 118.046 0.163 0.163 EE 0.000 {?} 135.00639 7.22480 0 {?} 0 1260 {?} 8.229 0.043 0.051 ++ 0.000 {?} {?} 3.016 0.111 0.151 ? 0.000 {?} {?} 118.046 0.103 0.103 EE 0.000 {?} 49.72490 1.46580 0 {?} 0 1261 {?} 8.230 0.051 0.057 ++ 0.000 {?} {?} 2.900 0.111 0.111 ? 0.000 {?} {?} 118.046 0.105 0.105 EE 0.000 {?} 53.41510 1.49960 0 {?} 0 1262 {298.HN} 8.228 0.030 0.033 ++ 0.000 {?} {301.HN} 7.285 0.072 0.103 ? 0.000 {?} {298.N} 118.046 0.105 0.105 EE 0.000 {?} 27.60330 1.49690 0 {?} 0 1263 {298.HN} 8.226 0.025 0.030 ++ 0.000 {?} {286.HE1} 7.089 0.095 0.112 ? 0.000 {?} {298.N} 118.046 0.107 0.107 EE 0.000 {?} 28.42160 1.54800 0 {?} 0 1264 {300.HN} 7.830 0.031 0.039 ++ 0.000 {?} {298.HB2} 2.235 0.069 0.084 ++ 0.000 {?} {300.N} 117.065 0.114 0.114 EE 0.000 {?} 33.83730 1.71240 0 {?} 0 1265 {298.HN} 8.227 0.033 0.033 ++ 0.000 {?} {300.HN} 7.822 0.064 0.089 ? 0.000 {?} {298.N} 118.046 0.091 0.091 EE 0.000 {?} 17.82480 1.25740 0 {?} 0 1266 {303.HN} 7.732 0.020 0.040 ? 0.000 {?} {300.HB1} 4.070 0.043 0.064 ? 0.000 {?} {303.N} 116.798 0.120 0.120 EE 0.000 {?} 25.20640 2.49250 0 {?} 0 1267 {303.HN} 7.741 0.021 0.042 ? 0.000 {?} {304.HD11} 0.937 0.085 0.129 ? 0.000 {?} {303.N} 116.798 0.120 0.120 EE 0.000 {?} 31.08230 1.89200 0 {?} 0 1268 {305.HN} 9.550 0.031 0.037 ++ 0.000 {?} {306.HB2} 1.339 0.108 0.131 ++ 0.000 {?} {305.N} 117.600 0.112 0.112 EE 0.000 {?} 39.41560 1.66620 0 {?} 0 1269 {?} 9.095 0.032 0.034 ++ 0.000 {?} {?} 7.111 0.082 0.088 ++ 0.000 {?} {?} 122.684 0.098 0.098 EE 0.000 {?} 25.45280 1.37780 0 {?} 0 1270 {313.HN} 6.735 0.032 0.031 ++ 0.000 {?} {314.HB2} 2.643 0.155 0.155 ? 0.000 {?} {313.N} 117.333 0.088 0.088 EE 0.000 {?} 30.07610 1.21610 0 {?} 0 1271 {313.HN} 6.741 0.033 0.035 ++ 0.000 {?} {314.HB1} 3.063 0.055 0.080 ++ 0.000 {?} {313.N} 117.333 0.102 0.102 EE 0.000 {?} 20.11460 1.45380 0 {?} 0 1272 {321.HN} 8.352 0.035 0.041 ++ 0.000 {?} {364.HA} 5.171 0.063 0.092 ? 0.000 {?} {321.N} 116.798 0.112 0.112 EE 0.000 {?} 26.37010 1.67090 0 {?} 0 1273 {321.HN} 8.359 0.029 0.058 ? 0.000 {?} {319.HG21} 0.733 0.063 0.157 ? 0.000 {?} {321.N} 116.798 0.167 0.167 EE 0.000 {?} 308.94440 9.91460 0 {?} 0 1274 {324.HN} 8.218 0.050 0.051 ++ 0.000 {?} {322.HG21} -0.539 0.074 0.076 ++ 0.000 {?} {324.N} 123.397 0.092 0.092 EE 0.000 {?} 29.34140 1.28440 0 {?} 0 1275 {349.HN} 8.789 0.042 0.053 ++ 0.000 {?} {345.HD1} 6.697 0.070 0.098 ? 0.000 {?} {349.N} 116.084 0.116 0.116 EE 0.000 {?} 37.68920 1.76320 0 {?} 0 1276 {327.HN} 8.778 0.033 0.043 ++ 0.000 {?} {326.HG1} 2.403 0.077 0.126 ? 0.000 {?} {327.N} 116.084 0.126 0.126 EE 0.000 {?} 50.03840 2.11820 0 {?} 0 1277 {349.HN} 8.794 0.027 0.049 ++ 0.000 {?} {349.HG1} 1.622 0.065 0.104 ? 0.000 {?} {349.N} 116.084 0.154 0.154 EE 0.000 {?} 112.82960 4.49360 0 {?} 0 1278 {329.HN} 8.461 0.042 0.040 ++ 0.000 {?} {342.HD1} 7.415 0.078 0.072 ++ 0.000 {?} {329.N} 111.446 0.082 0.082 EE 0.000 {?} 15.13630 1.14570 0 {?} 0 1279 {329.HN} 8.471 0.039 0.045 ++ 0.000 {?} {357.HD11} 1.018 0.054 0.115 ? 0.000 {?} {329.N} 111.446 0.115 0.115 EE 0.000 {?} 31.29850 1.69960 0 {?} 0 1280 {342.HN} 8.208 0.029 0.037 ++ 0.000 {?} {342.HE1} 7.071 0.059 0.106 ? 0.000 {?} {342.N} 119.206 0.115 0.115 EE 0.000 {?} 22.67420 1.73150 0 {?} 0 1281 {?} 8.661 0.037 0.039 ? 0.000 {?} {?} 0.935 0.054 0.108 ? 0.000 {?} {?} 119.473 0.101 0.101 EE 0.000 {?} 25.03900 1.42710 0 {?} 0 1282 {?} 8.267 0.035 0.035 ++ 0.000 {?} {?} 5.051 0.115 0.114 ++ 0.000 {?} {?} 118.492 0.088 0.088 EE 0.000 {?} 26.94170 1.22170 0 {?} 0 1283 {326.HE21} 8.045 0.026 0.041 ++ 0.000 {?} {326.HG2} 2.123 0.081 0.114 ? 0.000 {?} {326.NE2} 109.128 0.129 0.129 EE 0.000 {?} 37.36900 2.21600 0 {?} 0 1284 {326.HE21} 8.046 0.035 0.040 ++ 0.000 {?} {326.HB2} 1.569 0.047 0.105 ? 0.000 {?} {326.NE2} 109.128 0.108 0.108 EE 0.000 {?} 22.31950 1.57480 0 {?} 0 1285 {?} 8.475 0.028 0.037 ++ 0.000 {?} {?} 4.044 0.075 0.113 ++ 0.000 {?} {?} 108.935 0.123 0.123 EE 0.000 {?} 26.35020 1.50770 0 {?} 0 1286 {?} 8.801 0.029 0.051 ++ 0.000 {?} {?} 4.019 0.070 0.123 ? 0.000 {?} {?} 110.440 0.153 0.153 EE 0.000 {?} 56.14280 2.06740 0 {?} 0 1287 {?} 8.792 0.049 0.055 ++ 0.000 {?} {?} 4.470 0.078 0.088 ++ 0.000 {?} {?} 110.465 0.101 0.101 EE 0.000 {?} 35.26920 1.43290 0 {?} 0 1288 {?} 7.829 0.041 0.057 ++ 0.000 {?} {?} 4.280 0.147 0.228 ++ 0.000 {?} {?} 111.165 0.132 0.132 EE 0.000 {?} 12.58240 0.34850 0 {?} 0 1289 {?} 8.115 0.020 0.040 ++ 0.000 {?} {?} 4.356 0.045 0.095 ? 0.000 {?} {?} 114.554 0.156 0.156 EE 0.000 {?} 12.58240 0.87040 0 {?} 0 1290 {332.HN} 8.556 0.025 0.056 ++ 0.000 {?} {332.HA} 4.838 0.058 0.121 ? 0.000 {?} {332.N} 118.747 0.164 0.164 EE 0.000 {?} 128.20239 5.69420 0 {?} 0 1291 {?} 8.730 0.045 0.053 ++ 0.000 {?} {?} 4.529 0.142 0.169 ++ 0.000 {?} {?} 121.602 0.110 0.110 EE 0.000 {?} 79.84010 1.83250 0 {?} 0 1292 {?} 8.106 0.040 0.057 ++ 0.000 {?} {?} 4.574 0.159 0.243 ++ 0.000 {?} {?} 122.494 0.135 0.135 EE 0.000 {?} 21.67790 0.51580 0 {?} 0 1293 {?} 8.630 0.039 0.059 ++ 0.000 {?} {?} 4.684 0.140 0.200 ? 0.000 {?} {?} 126.775 0.135 0.135 EE 0.000 {?} 19.70510 0.95990 0 {?} 0 1294 {336.HN} 7.674 0.044 0.049 ++ 0.000 {?} {334.HB1} 1.976 0.111 0.130 ? 0.000 {?} {336.N} 113.854 0.100 0.100 EE 0.000 {?} 43.54040 1.41740 0 {?} 0 1295 {336.HN} 7.679 0.031 0.032 ++ 0.000 {?} {334.HD1} 1.632 0.101 0.104 ++ 0.000 {?} {336.N} 113.854 0.092 0.092 EE 0.000 {?} 25.00420 1.27300 0 {?} 0 1296 {334.HN} 8.709 0.038 0.057 ++ 0.000 {?} {337.HN} 8.215 0.029 0.061 ? 0.000 {?} {334.N} 123.933 0.136 0.136 EE 0.000 {?} 27.72360 2.39290 0 {?} 0 1297 {?} 8.235 0.033 0.037 ++ 0.000 {?} {?} 1.248 0.113 0.125 ? 0.000 {?} {?} 117.868 0.106 0.106 EE 0.000 {?} 33.17110 1.52130 0 {?} 0 1298 {339.HN} 8.429 0.036 0.043 ++ 0.000 {?} {333.HG1} 1.328 0.090 0.113 ++ 0.000 {?} {339.N} 120.276 0.113 0.113 EE 0.000 {?} 35.48000 1.68560 0 {?} 0 1299 {342.HN} 8.212 0.026 0.060 ? 0.000 {?} {331.HA} 4.931 0.049 0.104 ? 0.000 {?} {342.N} 119.206 0.164 0.164 EE 0.000 {?} 59.30830 3.15870 0 {?} 0 1300 {343.HN} 8.555 0.033 0.044 ++ 0.000 {?} {340.HG21} 0.819 0.051 0.113 ? 0.000 {?} {343.N} 117.511 0.127 0.127 EE 0.000 {?} 28.57170 2.13620 0 {?} 0 1301 {?} 8.981 0.049 0.057 ++ 0.000 {?} {?} 6.884 0.092 0.115 ++ 0.000 {?} {?} 115.281 0.109 0.109 EE 0.000 {?} 48.59700 1.60290 0 {?} 0 1302 {348.HN} 8.399 0.037 0.047 ? 0.000 {?} {345.HA} 4.290 0.051 0.131 ? 0.000 {?} {348.N} 118.581 0.128 0.128 EE 0.000 {?} 38.07860 2.15160 0 {?} 0 1303 {348.HN} 8.402 0.035 0.033 ++ 0.000 {?} {350.HN} 6.436 0.085 0.080 ++ 0.000 {?} {348.N} 118.581 0.084 0.084 EE 0.000 {?} 14.14340 1.16770 0 {?} 0 1304 {351.HN} 7.626 0.051 0.059 ++ 0.000 {?} {349.HA} 3.783 0.101 0.118 ++ 0.000 {?} {351.N} 118.938 0.111 0.111 EE 0.000 {?} 54.94680 1.64670 0 {?} 0 1305 {352.HN} 7.898 0.036 0.042 ++ 0.000 {?} {350.HB2} 2.519 0.110 0.130 ? 0.000 {?} {352.N} 115.727 0.109 0.109 EE 0.000 {?} 43.60140 1.58910 0 {?} 0 1306 {353.HN} 8.649 0.034 0.040 ++ 0.000 {?} {386.HD21} 0.827 0.077 0.091 ++ 0.000 {?} {353.N} 124.468 0.107 0.107 EE 0.000 {?} 29.69880 1.53750 0 {?} 0 1307 {354.HN} 7.912 0.038 0.041 ++ 0.000 {?} {386.HD11} 0.266 0.081 0.089 ++ 0.000 {?} {354.N} 126.697 0.099 0.099 EE 0.000 {?} 27.22710 1.39760 0 {?} 0 1308 {355.HN} 9.615 0.038 0.045 ++ 0.000 {?} {354.HD11} 0.914 0.045 0.076 ? 0.000 {?} {355.N} 119.295 0.108 0.108 EE 0.000 {?} 21.74170 1.57710 0 {?} 0 1309 {356.HN} 8.338 0.042 0.054 ++ 0.000 {?} {354.HB} 1.677 0.119 0.139 ? 0.000 {?} {356.N} 125.003 0.124 0.124 EE 0.000 {?} 73.07970 2.01370 0 {?} 0 1310 {?} 8.337 0.029 0.034 ++ 0.000 {?} {?} 7.582 0.118 0.135 ++ 0.000 {?} {?} 125.003 0.109 0.109 EE 0.000 {?} 38.32180 1.59370 0 {?} 0 1311 {359.HN} 7.232 0.050 0.057 ++ 0.000 {?} {357.HN} 8.898 0.059 0.064 ++ 0.000 {?} {359.N} 121.792 0.098 0.098 EE 0.000 {?} 25.72210 1.36970 0 {?} 0 1312 {359.HN} 7.233 0.038 0.048 ++ 0.000 {?} {356.HB2} 2.394 0.082 0.129 ? 0.000 {?} {359.N} 121.792 0.115 0.115 EE 0.000 {?} 41.73450 1.75610 0 {?} 0 1313 {359.HN} 7.227 0.043 0.055 ++ 0.000 {?} {385.HB2} 1.628 0.090 0.126 ? 0.000 {?} {359.N} 121.881 0.119 0.119 EE 0.000 {?} 54.42580 1.87400 0 {?} 0 1314 {359.HN} 7.226 0.047 0.060 ++ 0.000 {?} {384.HG1} 1.519 0.043 0.094 ? 0.000 {?} {359.N} 121.881 0.119 0.119 EE 0.000 {?} 34.38550 1.86730 0 {?} 0 1315 {364.HN} 8.784 0.036 0.033 ++ 0.000 {?} {363.HB} 1.662 0.084 0.084 ? 0.000 {?} {364.N} 121.614 0.076 0.076 EE 0.000 {?} 17.85140 1.07800 0 {?} 0 1316 {307.HN} 7.932 0.035 0.070 ++ 0.000 {?} {307.HA} 4.858 0.076 0.165 ++ 0.000 {?} {307.N} 119.919 0.159 0.159 EE 0.000 {?} 221.02229 5.76500 0 {?} 0 1317 {380.HN} 8.948 0.016 0.055 ? 0.000 {?} {364.HN} 8.805 0.030 0.089 ? 0.000 {?} {380.N} 124.557 0.175 0.175 EE 0.000 {?} 30.14900 3.70910 0 {?} 0 1318 {380.HN} 8.944 0.021 0.060 ? 0.000 {?} {363.HG21} 0.876 0.084 0.158 ? 0.000 {?} {380.N} 124.557 0.133 0.133 EE 0.000 {?} 45.05390 2.43450 0 {?} 0 1319 {380.HN} 8.949 0.022 0.048 ? 0.000 {?} {379.HB1} 1.945 0.076 0.123 ? 0.000 {?} {380.N} 124.557 0.156 0.156 EE 0.000 {?} 51.93820 1.85350 0 {?} 0 1320 {381.HN} 7.972 0.033 0.034 ++ 0.000 {?} {382.HD21} 0.065 0.093 0.097 ++ 0.000 {?} {381.N} 121.346 0.095 0.095 EE 0.000 {?} 27.39310 1.32530 0 {?} 0 1321 {381.HN} 7.971 0.028 0.033 ++ 0.000 {?} {361.HG11} 0.434 0.082 0.098 ++ 0.000 {?} {381.N} 121.346 0.107 0.107 EE 0.000 {?} 25.70360 1.53730 0 {?} 0 1322 {381.HN} 7.967 0.063 0.066 ++ 0.000 {?} {382.HN} 9.091 0.095 0.111 ? 0.000 {?} {381.N} 121.346 0.096 0.096 EE 0.000 {?} 47.08300 1.34000 0 {?} 0 1323 {385.HN} 9.137 0.027 0.026 ++ 0.000 {?} {386.HN} 8.056 0.070 0.067 ++ 0.000 {?} {385.N} 116.352 0.085 0.085 EE 0.000 {?} 10.61280 1.18310 0 {?} 0 1324 {387.HN} 7.361 0.044 0.046 ++ 0.000 {?} {385.HA} 3.976 0.053 0.111 ? 0.000 {?} {387.N} 115.371 0.095 0.095 EE 0.000 {?} 21.83420 1.31970 0 {?} 0 1325 {387.HN} 7.367 0.035 0.041 ++ 0.000 {?} {388.HD1} 7.138 0.096 0.096 ? 0.000 {?} {387.N} 115.281 0.109 0.109 EE 0.000 {?} 36.45000 1.60290 0 {?} 0 1326 {387.HN} 7.365 0.039 0.042 ++ 0.000 {?} {280.HN} 6.835 0.088 0.094 ++ 0.000 {?} {387.N} 115.281 0.096 0.096 EE 0.000 {?} 32.00350 1.34490 0 {?} 0 1327 {389.HN} 8.606 0.035 0.038 ++ 0.000 {?} {388.HN} 9.691 0.095 0.103 ++ 0.000 {?} {389.N} 121.703 0.097 0.097 EE 0.000 {?} 27.77810 1.35480 0 {?} 0 1328 {390.HN} 8.399 0.036 0.042 ++ 0.000 {?} {391.HA1} 4.133 0.067 0.067 ? 0.000 {?} {390.N} 111.268 0.106 0.106 EE 0.000 {?} 27.38680 1.53110 0 {?} 0 1329 {391.HN} 8.483 0.043 0.075 ++ 0.000 {?} {392.HB2} 1.572 0.055 0.105 ? 0.000 {?} {391.N} 110.198 0.154 0.154 EE 0.000 {?} 108.71320 4.44820 0 {?} 0 1330 {392.HN} 8.224 0.047 0.052 ++ 0.000 {?} {307.HG11} 0.791 0.095 0.095 ? 0.000 {?} {392.N} 121.435 0.101 0.101 EE 0.000 {?} 121.96860 4.15130 0 {?} 0 1331 {393.HN} 8.196 0.017 0.060 ? 0.000 {?} {307.HG11} 0.792 0.028 0.092 ? 0.000 {?} {393.N} 113.230 0.165 0.165 EE 0.000 {?} 30.03660 3.73310 0 {?} 0 1332 {394.HN} 8.648 0.041 0.057 ++ 0.000 {?} {306.HA} 4.371 0.058 0.105 ? 0.000 {?} {394.N} 122.773 0.132 0.132 EE 0.000 {?} 43.12290 2.39460 0 {?} 0 1333 {361.HN} 6.300 0.044 0.053 ++ 0.000 {?} {322.HG21} -0.533 0.092 0.108 ++ 0.000 {?} {361.N} 110.911 0.104 0.104 EE 0.000 {?} 55.87020 2.16530 0 {?} 0 1334 {329.HN} 8.475 0.040 0.042 ++ 0.000 {?} {342.HN} 8.215 0.111 0.111 ? 0.000 {?} {329.N} 111.446 0.093 0.093 EE 0.000 {?} 34.53320 1.29650 0 {?} 0 1335 {387.HN} 7.365 0.046 0.068 ++ 0.000 {?} {278.HB} 4.642 0.048 0.105 ? 0.000 {?} {387.N} 115.371 0.133 0.133 EE 0.000 {?} 77.71230 3.00040 0 {?} 0 1336 {?} 7.369 0.022 0.059 ? 0.000 {?} {?} 0.689 0.098 0.098 ? 0.000 {?} {?} 115.371 0.156 0.156 EE 0.000 {?} 127.16650 3.63700 0 {?} 0 1337 {368.HN} 8.245 0.034 0.040 ++ 0.000 {?} {366.HG1} 2.034 0.067 0.148 ? 0.000 {?} {368.N} 120.989 0.112 0.112 EE 0.000 {?} 29.76090 1.66940 0 {?} 0 1338 {?} 8.249 0.036 0.055 ++ 0.000 {?} {?} 1.487 0.067 0.067 ? 0.000 {?} {?} 120.989 0.134 0.134 EE 0.000 {?} 53.25450 2.49200 0 {?} 0 1339 {?} 7.238 0.029 0.033 ++ 0.000 {?} {?} 9.135 0.108 0.118 ++ 0.000 {?} {?} 121.792 0.102 0.102 EE 0.000 {?} 29.80890 1.44650 0 {?} 0 1340 {347.HE} 8.067 0.028 0.027 ++ 0.000 {?} {347.HB2} 1.967 0.084 0.080 ? 0.000 {?} {347.NE} 107.611 0.083 0.083 EE 0.000 {?} 10.48830 1.16390 0 {?} 0 1341 {326.HE22} 6.210 0.031 0.036 ++ 0.000 {?} {326.HG2} 2.113 0.052 0.126 ? 0.000 {?} {326.NE2} 109.217 0.106 0.106 EE 0.000 {?} 29.24110 2.24080 0 {?} 0 1342 {298.HE21} 7.665 0.031 0.041 ++ 0.000 {?} {294.HB2} 1.655 0.112 0.143 ++ 0.000 {?} {298.NE2} 111.714 0.124 0.124 EE 0.000 {?} 56.11990 2.45310 0 {?} 0 1343 {298.HE22} 6.988 0.026 0.034 ++ 0.000 {?} {294.HB2} 1.650 0.126 0.159 ? 0.000 {?} {298.NE2} 111.714 0.120 0.120 EE 0.000 {?} 47.97980 2.28650 0 {?} 0 1344 {298.HE21} 7.665 0.031 0.036 ++ 0.000 {?} {298.HB2} 2.240 0.067 0.067 ? 0.000 {?} {298.NE2} 111.714 0.103 0.103 EE 0.000 {?} 29.11820 1.79410 0 {?} 0 1345 {298.HE21} 7.663 0.033 0.033 ++ 0.000 {?} {294.HB1} 1.925 0.102 0.100 ? 0.000 {?} {298.NE2} 111.714 0.088 0.088 EE 0.000 {?} 26.95620 1.48630 0 {?} 0 1346 {298.HE22} 6.984 0.034 0.027 ++ 0.000 {?} {294.HB1} 1.912 0.127 0.110 ++ 0.000 {?} {298.NE2} 111.714 0.072 0.072 ? 0.000 {?} 17.47770 1.26360 0 {?} 0 1347 {298.HE22} 6.985 0.036 0.034 ++ 0.000 {?} {298.HB2} 2.271 0.067 0.174 ? 0.000 {?} {298.NE2} 111.714 0.083 0.083 EE 0.000 {?} 20.24650 1.40950 0 {?} 0 1348 {298.HE21} 7.661 0.031 0.030 ++ 0.000 {?} {298.HA} 4.071 0.074 0.072 ++ 0.000 {?} {298.NE2} 111.714 0.086 0.086 EE 0.000 {?} 13.12470 1.45820 0 {?} 0 1349 {298.HE21} 7.664 0.024 0.082 ? 0.000 {?} {298.HE22} 6.985 0.084 0.257 ? 0.000 {?} {298.NE2} 111.714 0.176 0.176 EE 0.000 {?} 1891.18030 67.15760 0 {?} 0 1350 {298.HE22} 6.986 0.029 0.076 ? 0.000 {?} {298.HE21} 7.664 0.097 0.288 ? 0.000 {?} {298.NE2} 111.714 0.176 0.176 EE 0.000 {?} 2579.91553 71.22710 0 {?} 0 1351 {314.HD22} 6.762 0.039 0.041 ++ 0.000 {?} {314.HA} 4.430 0.087 0.090 ++ 0.000 {?} {314.ND2} 111.803 0.094 0.094 EE 0.000 {?} 34.18670 1.59030 0 {?} 0 1352 {314.HD21} 7.551 0.030 0.030 ++ 0.000 {?} {314.HA} 4.442 0.073 0.051 ++ 0.000 {?} {314.ND2} 111.803 0.064 0.064 ? 0.000 {?} 11.66910 1.17860 0 {?} 0 1353 {?} 7.731 0.040 0.043 ++ 0.000 {?} {?} 2.096 0.079 0.130 ? 0.000 {?} {?} 111.892 0.095 0.095 EE 0.000 {?} 39.77090 1.61760 0 {?} 0 1354 {?} 7.729 0.039 0.044 ++ 0.000 {?} {?} 1.935 0.122 0.132 ? 0.000 {?} {?} 111.892 0.103 0.103 EE 0.000 {?} 54.53230 1.79440 0 {?} 0 1355 {?} 7.732 0.032 0.038 ++ 0.000 {?} {?} 0.878 0.148 0.195 ++ 0.000 {?} {?} 111.892 0.108 0.108 EE 0.000 {?} 61.34550 1.90950 0 {?} 0 1356 {289.HE21} 7.317 0.011 0.081 ? 0.000 {?} {289.HE22} 6.723 0.059 0.202 ? 0.000 {?} {289.NE2} 111.982 0.176 0.176 EE 0.000 {?} 665.91559 53.53850 0 {?} 0 1357 {289.HE22} 6.725 0.031 0.077 ? 0.000 {?} {289.HE21} 7.317 0.080 0.244 ? 0.000 {?} {289.NE2} 111.982 0.176 0.176 EE 0.000 {?} 2217.09741 63.80550 0 {?} 0 1358 {349.HE22} 6.814 0.039 0.044 ++ 0.000 {?} {349.HG1} 1.636 0.114 0.127 ++ 0.000 {?} {349.NE2} 112.160 0.103 0.103 EE 0.000 {?} 51.42140 1.77320 0 {?} 0 1359 {351.HD21} 7.626 0.034 0.084 ? 0.000 {?} {351.HD22} 6.874 0.077 0.244 ? 0.000 {?} {351.ND2} 112.160 0.177 0.177 EE 0.000 {?} 4058.13477 105.72020 0 {?} 0 1360 {351.HD22} 6.874 0.017 0.079 ? 0.000 {?} {351.HD21} 7.625 0.074 0.217 ? 0.000 {?} {351.ND2} 112.160 0.177 0.177 EE 0.000 {?} 1746.10144 105.59750 0 {?} 0 1361 {349.HE21} 7.061 0.041 0.040 ++ 0.000 {?} {349.HA} 3.766 0.095 0.111 ? 0.000 {?} {349.NE2} 112.160 0.086 0.086 EE 0.000 {?} 28.32030 1.46040 0 {?} 0 1362 {349.HE21} 7.055 0.029 0.075 ? 0.000 {?} {349.HE22} 6.813 0.059 0.201 ? 0.000 {?} {349.NE2} 112.160 0.175 0.175 EE 0.000 {?} 1286.98376 43.42540 0 {?} 0 1363 {349.HE22} 6.814 0.021 0.065 ? 0.000 {?} {349.HE21} 7.055 0.065 0.204 ? 0.000 {?} {349.NE2} 112.160 0.175 0.175 EE 0.000 {?} 1125.74524 42.07110 0 {?} 0 1364 {398.HD21} 7.648 0.034 0.043 ++ 0.000 {?} {398.HB1} 2.854 0.048 0.093 ? 0.000 {?} {398.ND2} 112.963 0.119 0.119 EE 0.000 {?} 22.38290 1.85960 0 {?} 0 1365 {398.HD21} 7.649 0.030 0.072 ++ 0.000 {?} {398.HD22} 6.900 0.069 0.244 ? 0.000 {?} {398.ND2} 112.963 0.177 0.177 EE 0.000 {?} 3230.49316 106.72790 0 {?} 0 1366 {398.HD22} 6.899 0.017 0.068 ? 0.000 {?} {398.HD21} 7.649 0.082 0.257 ? 0.000 {?} {398.ND2} 112.963 0.177 0.177 EE 0.000 {?} 2148.64673 92.50240 0 {?} 0 1367 {?} 7.063 0.030 0.032 ++ 0.000 {?} {?} 4.316 0.107 0.113 ++ 0.000 {?} {?} 113.944 0.097 0.097 EE 0.000 {?} 32.20270 1.64870 0 {?} 0 1368 {?} 7.554 0.052 0.055 ? 0.000 {?} {?} 4.343 0.091 0.095 ? 0.000 {?} {?} 113.944 0.095 0.095 EE 0.000 {?} 40.93420 1.33230 0 {?} 0 1369 {285.HD21} 7.555 0.021 0.059 ? 0.000 {?} {285.HD22} 7.065 0.073 0.212 ? 0.000 {?} {285.ND2} 113.944 0.175 0.175 EE 0.000 {?} 1103.72351 38.36750 0 {?} 0 1370 {285.HD22} 7.066 0.022 0.064 ++ 0.000 {?} {285.HD21} 7.556 0.079 0.210 ? 0.000 {?} {285.ND2} 113.944 0.176 0.176 EE 0.000 {?} 1345.97839 47.05210 0 {?} 0 1371 {285.HD22} 7.066 0.036 0.035 ++ 0.000 {?} {285.HN} 8.173 0.126 0.118 ++ 0.000 {?} {285.ND2} 113.944 0.084 0.084 EE 0.000 {?} 23.30190 1.43240 0 {?} 0 1372 {285.HN} 8.156 0.037 0.042 ++ 0.000 {?} {285.HD21} 7.548 0.064 0.072 ++ 0.000 {?} {285.N} 117.600 0.102 0.102 EE 0.000 {?} 21.95280 1.43940 0 {?} 0 1373 {327.HD22} 6.712 0.047 0.047 ++ 0.000 {?} {327.HB1} 3.147 0.210 0.171 ++ 0.000 {?} {327.ND2} 114.379 0.069 0.069 ? 0.000 {?} 48.04850 1.24020 0 {?} 0 1374 {327.HD21} 7.839 0.052 0.046 ++ 0.000 {?} {359.HA} 4.570 0.107 0.094 ++ 0.000 {?} {327.ND2} 114.390 0.074 0.074 ? 0.000 {?} 21.42710 1.28400 0 {?} 0 1375 {327.HD21} 7.832 0.034 0.034 ++ 0.000 {?} {327.HA} 5.454 0.076 0.062 ++ 0.000 {?} {327.ND2} 114.390 0.067 0.067 ? 0.000 {?} 16.33390 1.20570 0 {?} 0 1376 {327.HD22} 6.695 0.038 0.038 ++ 0.000 {?} {359.HA} 4.565 0.088 0.088 ++ 0.000 {?} {327.ND2} 114.390 0.033 0.033 ? 0.000 {?} 22.60640 0.92800 0 {?} 0 1377 {327.HD21} 7.837 0.040 0.083 ++ 0.000 {?} {327.HD22} 6.703 0.081 0.244 ? 0.000 {?} {327.ND2} 114.390 0.165 0.165 EE 0.000 {?} 468.64581 10.01300 0 {?} 0 1378 {327.HD22} 6.703 0.044 0.096 ++ 0.000 {?} {327.HD21} 7.840 0.089 0.244 ? 0.000 {?} {327.ND2} 114.390 0.168 0.168 EE 0.000 {?} 629.35699 12.56640 0 {?} 0 1379 {352.HE22} 7.195 0.034 0.045 ++ 0.000 {?} {352.HG1} 2.357 0.092 0.126 ++ 0.000 {?} {352.NE2} 115.281 0.121 0.121 EE 0.000 {?} 50.09650 2.34390 0 {?} 0 1380 {352.HE22} 7.191 0.037 0.044 ? 0.000 {?} {352.HG2} 1.947 0.105 0.165 ? 0.000 {?} {352.NE2} 115.281 0.116 0.116 EE 0.000 {?} 59.07580 2.15220 0 {?} 0 1381 {352.HE22} 7.196 0.031 0.032 ++ 0.000 {?} {352.HA} 4.573 0.108 0.109 ++ 0.000 {?} {352.NE2} 115.281 0.091 0.091 EE 0.000 {?} 35.14760 1.49840 0 {?} 0 1382 {352.HE21} 7.546 0.030 0.078 ? 0.000 {?} {352.HE22} 7.194 0.065 0.198 ? 0.000 {?} {352.NE2} 115.281 0.172 0.172 EE 0.000 {?} 641.70923 20.27750 0 {?} 0 1383 {352.HE22} 7.194 0.025 0.076 ++ 0.000 {?} {352.HE21} 7.546 0.065 0.200 ? 0.000 {?} {352.NE2} 115.281 0.172 0.172 EE 0.000 {?} 569.95868 20.66060 0 {?} 0 1384 {359.HN} 7.236 0.034 0.036 ++ 0.000 {?} {383.HG21} 0.684 0.110 0.111 ? 0.000 {?} {359.N} 121.881 0.096 0.096 EE 0.000 {?} 31.35330 1.34380 0 {?} 0 1385 {313.HD21} 7.986 0.041 0.043 ++ 0.000 {?} {313.HB1} 3.363 0.123 0.130 ++ 0.000 {?} {313.ND2} 109.395 0.096 0.096 EE 0.000 {?} 50.09950 1.62830 0 {?} 0 1386 {313.HD21} 7.985 0.035 0.037 ++ 0.000 {?} {313.HB2} 2.861 0.090 0.097 ++ 0.000 {?} {313.ND2} 109.395 0.097 0.097 EE 0.000 {?} 33.95990 1.64360 0 {?} 0 1387 {313.HD22} 6.907 0.034 0.027 ++ 0.000 {?} {313.HB1} 3.343 0.075 0.075 ++ 0.000 {?} {313.ND2} 109.395 0.065 0.065 ? 0.000 {?} 14.91910 1.19020 0 {?} 0 1388 {313.HD22} 6.913 0.045 0.039 ++ 0.000 {?} {313.HB2} 2.847 0.083 0.067 ++ 0.000 {?} {313.ND2} 109.395 0.070 0.070 ? 0.000 {?} 16.88890 1.24390 0 {?} 0 1389 {313.HD22} 6.919 0.045 0.078 ++ 0.000 {?} {313.HD21} 7.987 0.082 0.203 ? 0.000 {?} {313.ND2} 109.395 0.150 0.150 EE 0.000 {?} 204.21809 4.70020 0 {?} 0 1390 {313.HD21} 7.985 0.051 0.085 ? 0.000 {?} {313.HD22} 6.917 0.099 0.203 ? 0.000 {?} {313.ND2} 109.395 0.155 0.155 EE 0.000 {?} 328.02960 5.63770 0 {?} 0 1391 {?} 7.979 0.033 0.035 ++ 0.000 {?} {?} 6.708 0.085 0.097 ++ 0.000 {?} {?} 109.395 0.098 0.098 EE 0.000 {?} 30.65740 1.66330 0 {?} 0 1392 {?} 6.910 0.046 0.044 ++ 0.000 {?} {?} 6.704 0.075 0.155 ? 0.000 {?} {?} 109.395 0.082 0.082 EE 0.000 {?} 27.25890 1.40230 0 {?} 0 1393 {?} 8.412 0.045 0.045 ++ 0.000 {?} {?} 1.431 0.115 0.115 ++ 0.000 {?} {?} 126.787 0.036 0.036 ? 0.000 {?} 49.78750 1.68630 0 {?} 0 1394 {274.HN} 8.413 0.051 0.053 ? 0.000 {?} {271.HA} 4.689 0.044 0.102 ? 0.000 {?} {274.N} 126.787 0.095 0.095 EE 0.000 {?} 22.46770 1.32170 0 {?} 0 1395 {277.HN} 8.679 0.013 0.046 ? 0.000 {?} {281.HA} 4.401 0.054 0.118 ? 0.000 {?} {277.N} 123.754 0.136 0.136 EE 0.000 {?} 23.23050 2.23540 0 {?} 0 1396 {389.HN} 8.610 0.020 0.040 ? 0.000 {?} {390.HA} 4.593 0.072 0.115 ? 0.000 {?} {389.N} 121.703 0.123 0.123 EE 0.000 {?} 29.92220 2.00590 0 {?} 0 1397 {?} 6.838 0.035 0.039 ++ 0.000 {?} {?} 3.135 0.091 0.099 ++ 0.000 {?} {?} 120.276 0.103 0.103 EE 0.000 {?} 31.60950 1.45960 0 {?} 0 1398 {?} 6.848 0.037 0.038 ++ 0.000 {?} {?} 2.680 0.066 0.092 ? 0.000 {?} {?} 120.276 0.089 0.089 EE 0.000 {?} 23.62850 1.23930 0 {?} 0 1399 {?} 9.139 0.045 0.045 ? 0.000 {?} {?} 0.810 0.104 0.108 ++ 0.000 {?} {?} 116.441 0.096 0.096 EE 0.000 {?} 71.69600 2.25550 0 {?} 0 1400 {281.HN} 7.753 0.035 0.036 ++ 0.000 {?} {279.HB} 2.211 0.103 0.105 ? 0.000 {?} {281.N} 119.473 0.092 0.092 EE 0.000 {?} 31.74480 1.28590 0 {?} 0 1401 {281.HN} 7.752 0.012 0.038 ? 0.000 {?} {279.HG11} 0.789 0.045 0.095 ? 0.000 {?} {281.N} 119.473 0.162 0.162 EE 0.000 {?} 8.48380 1.28420 0 {?} 0 1402 {281.HN} 7.749 0.034 0.034 ++ 0.000 {?} {389.HD21} 0.636 0.081 0.080 ++ 0.000 {?} {281.N} 119.473 0.088 0.088 EE 0.000 {?} 18.71030 1.21640 0 {?} 0 1403 {294.HN} 7.484 0.051 0.054 ++ 0.000 {?} {291.HB1} 2.152 0.101 0.124 ? 0.000 {?} {294.N} 118.849 0.098 0.098 EE 0.000 {?} 52.83130 1.37880 0 {?} 0 1404 {299.HN} 8.906 0.043 0.045 ? 0.000 {?} {286.HE1} 7.114 0.120 0.111 ? 0.000 {?} {299.N} 119.830 0.081 0.081 EE 0.000 {?} 31.63010 1.13000 0 {?} 0 1405 {299.HN} 8.901 0.036 0.031 ++ 0.000 {?} {286.HZ} 7.263 0.059 0.081 ? 0.000 {?} {299.N} 119.830 0.070 0.070 ? 0.000 {?} 12.54830 1.02150 0 {?} 0 1406 {299.HN} 8.916 0.041 0.045 ++ 0.000 {?} {296.HA} 3.012 0.064 0.070 ++ 0.000 {?} {299.N} 119.830 0.102 0.102 EE 0.000 {?} 22.61780 1.43950 0 {?} 0 1407 {300.HN} 7.821 0.037 0.039 ++ 0.000 {?} {301.HE1} 3.015 0.082 0.088 ++ 0.000 {?} {300.N} 117.065 0.098 0.098 EE 0.000 {?} 28.82650 1.38070 0 {?} 0 1408 {303.HN} 7.727 0.039 0.039 ++ 0.000 {?} {299.HA} 3.189 0.083 0.083 ++ 0.000 {?} {303.N} 116.798 0.089 0.089 EE 0.000 {?} 27.28460 1.23090 0 {?} 0 1409 {?} 7.699 0.030 0.033 ? 0.000 {?} {?} 2.320 0.037 0.074 ? 0.000 {?} {?} 117.690 0.099 0.099 EE 0.000 {?} 15.01920 1.39630 0 {?} 0 1410 {304.HN} 7.697 0.037 0.072 ++ 0.000 {?} {303.HD11} 0.770 0.097 0.132 ? 0.000 {?} {304.N} 117.690 0.164 0.164 EE 0.000 {?} 407.53000 7.95340 0 {?} 0 1411 {?} 7.692 0.040 0.038 ++ 0.000 {?} {?} 8.157 0.082 0.100 ? 0.000 {?} {?} 117.690 0.084 0.084 EE 0.000 {?} 19.09090 1.16810 0 {?} 0 1412 {304.HN} 7.695 0.040 0.041 ++ 0.000 {?} {306.HN} 8.022 0.116 0.116 ? 0.000 {?} {304.N} 117.690 0.092 0.092 EE 0.000 {?} 41.25880 1.28260 0 {?} 0 1413 {305.HN} 9.544 0.033 0.057 ++ 0.000 {?} {304.HG12} 0.798 0.056 0.089 ? 0.000 {?} {305.N} 117.600 0.150 0.150 EE 0.000 {?} 86.66100 3.82800 0 {?} 0 1414 {309.HN} 9.105 0.045 0.048 ++ 0.000 {?} {307.HA} 4.850 0.097 0.104 ++ 0.000 {?} {309.N} 122.684 0.100 0.100 EE 0.000 {?} 33.15200 1.40150 0 {?} 0 1415 {?} 7.465 0.035 0.076 ++ 0.000 {?} {?} 1.244 0.053 0.095 ? 0.000 {?} {?} 118.671 0.167 0.167 EE 0.000 {?} 186.01241 6.29510 0 {?} 0 1416 {316.HN} 7.415 0.032 0.032 ++ 0.000 {?} {309.HA} 5.293 0.082 0.080 ++ 0.000 {?} {316.N} 107.701 0.087 0.087 EE 0.000 {?} 14.83000 1.20930 0 {?} 0 1417 {320.HN} 9.140 0.043 0.042 ++ 0.000 {?} {318.HA} 4.855 0.095 0.092 ++ 0.000 {?} {320.N} 129.373 0.086 0.086 EE 0.000 {?} 16.90270 1.20110 0 {?} 0 1418 {321.HN} 8.360 0.039 0.044 ++ 0.000 {?} {322.HG11} 1.273 0.048 0.075 ? 0.000 {?} {321.N} 116.798 0.107 0.107 EE 0.000 {?} 24.73930 1.53840 0 {?} 0 1419 {?} 8.656 0.039 0.035 ++ 0.000 {?} {?} 3.251 0.053 0.093 ? 0.000 {?} {?} 119.562 0.075 0.075 EE 0.000 {?} 13.74800 1.06940 0 {?} 0 1420 {?} 8.654 0.037 0.036 ++ 0.000 {?} {?} 3.089 0.110 0.108 ? 0.000 {?} {?} 119.562 0.086 0.086 EE 0.000 {?} 20.97170 1.19010 0 {?} 0 1421 {325.HN} 8.766 0.037 0.038 ++ 0.000 {?} {326.HA} 4.745 0.072 0.100 ? 0.000 {?} {325.N} 118.225 0.092 0.092 EE 0.000 {?} 23.51330 1.28230 0 {?} 0 1422 {?} 7.263 0.037 0.039 ++ 0.000 {?} {?} 4.106 0.111 0.128 ? 0.000 {?} {?} 117.868 0.092 0.092 EE 0.000 {?} 33.32580 1.28210 0 {?} 0 1423 {338.HN} 8.228 0.017 0.047 ? 0.000 {?} {334.HB1} 2.019 0.071 0.113 ? 0.000 {?} {338.N} 117.868 0.159 0.159 EE 0.000 {?} 107.91340 5.73070 0 {?} 0 1424 {338.HN} 8.235 0.031 0.048 ++ 0.000 {?} {334.HD1} 1.658 0.073 0.115 ? 0.000 {?} {338.N} 117.868 0.134 0.134 EE 0.000 {?} 54.18580 2.28650 0 {?} 0 1425 {341.HN} 8.454 0.025 0.040 ? 0.000 {?} {344.HA} 4.166 0.079 0.081 ++ 0.000 {?} {341.N} 118.314 0.091 0.091 EE 0.000 {?} 19.86060 1.26980 0 {?} 0 1426 {341.HN} 8.452 0.022 0.049 ? 0.000 {?} {331.HA} 4.954 0.040 0.115 ? 0.000 {?} {341.N} 118.314 0.172 0.172 EE 0.000 {?} 28.31250 1.84670 0 {?} 0 1427 {342.HN} 8.219 0.039 0.045 ++ 0.000 {?} {331.HB} 3.817 0.098 0.098 ? 0.000 {?} {342.N} 119.295 0.108 0.108 EE 0.000 {?} 38.49660 1.57140 0 {?} 0 1428 {342.HN} 8.207 0.016 0.038 ? 0.000 {?} {331.HG21} 0.967 0.070 0.119 ? 0.000 {?} {342.N} 119.206 0.143 0.143 EE 0.000 {?} 35.83710 3.15070 0 {?} 0 1429 {344.HN} 8.183 0.034 0.046 ++ 0.000 {?} {341.HB2} 3.943 0.058 0.111 ? 0.000 {?} {344.N} 119.384 0.139 0.139 EE 0.000 {?} 54.76480 2.30780 0 {?} 0 1430 {344.HN} 8.188 0.034 0.040 ++ 0.000 {?} {345.HB1} 3.257 0.065 0.110 ? 0.000 {?} {344.N} 119.384 0.108 0.108 EE 0.000 {?} 29.10400 1.57950 0 {?} 0 1431 {344.HN} 8.183 0.034 0.048 ++ 0.000 {?} {345.HB2} 3.125 0.067 0.115 ? 0.000 {?} {344.N} 119.384 0.140 0.140 EE 0.000 {?} 57.45300 2.12650 0 {?} 0 1432 {345.HN} 8.920 0.034 0.036 ++ 0.000 {?} {341.HN} 8.450 0.121 0.129 ? 0.000 {?} {345.N} 121.168 0.096 0.096 EE 0.000 {?} 35.81030 1.33630 0 {?} 0 1433 {345.HN} 8.917 0.032 0.034 ++ 0.000 {?} {343.HN} 8.553 0.105 0.114 ? 0.000 {?} {345.N} 121.168 0.095 0.095 EE 0.000 {?} 28.68190 1.32270 0 {?} 0 1434 {350.HN} 6.433 0.037 0.040 ++ 0.000 {?} {348.HB1} 1.892 0.112 0.137 ? 0.000 {?} {350.N} 110.198 0.098 0.098 EE 0.000 {?} 47.75530 1.37760 0 {?} 0 1435 {350.HN} 6.436 0.045 0.042 ++ 0.000 {?} {348.HB2} 1.770 0.048 0.080 ? 0.000 {?} {350.N} 110.198 0.080 0.080 EE 0.000 {?} 16.44680 1.12670 0 {?} 0 1436 {351.HN} 7.638 0.039 0.038 ++ 0.000 {?} {350.HB1} 3.456 0.088 0.086 ++ 0.000 {?} {351.N} 118.849 0.087 0.087 EE 0.000 {?} 14.76320 1.20240 0 {?} 0 1437 {351.HN} 7.633 0.059 0.051 ++ 0.000 {?} {348.HA} 4.067 0.078 0.078 ++ 0.000 {?} {351.N} 118.849 0.073 0.073 ? 0.000 {?} 40.94990 1.77430 0 {?} 0 1438 {352.HN} 7.891 0.037 0.043 ++ 0.000 {?} {350.HA} 5.039 0.070 0.110 ? 0.000 {?} {352.N} 115.727 0.108 0.108 EE 0.000 {?} 30.45520 1.56870 0 {?} 0 1439 {352.HN} 7.895 0.034 0.035 ++ 0.000 {?} {346.HD1} 7.187 0.073 0.075 ++ 0.000 {?} {352.N} 115.727 0.092 0.092 EE 0.000 {?} 20.87590 1.27870 0 {?} 0 1440 {353.HN} 8.642 0.042 0.041 ++ 0.000 {?} {351.HN} 7.634 0.111 0.115 ? 0.000 {?} {353.N} 124.468 0.084 0.084 EE 0.000 {?} 28.40170 1.17530 0 {?} 0 1441 {357.HN} 8.886 0.050 0.050 ? 0.000 {?} {355.HA} 4.499 0.074 0.102 ? 0.000 {?} {357.N} 124.735 0.122 0.122 EE 0.000 {?} 60.54430 1.97100 0 {?} 0 1442 {358.HN} 8.586 0.038 0.041 ++ 0.000 {?} {356.HB2} 2.376 0.076 0.083 ++ 0.000 {?} {358.N} 118.135 0.097 0.097 EE 0.000 {?} 24.95380 1.36500 0 {?} 0 1443 {359.HN} 7.228 0.040 0.040 ++ 0.000 {?} {356.HB1} 3.073 0.101 0.099 ? 0.000 {?} {359.N} 121.881 0.085 0.085 EE 0.000 {?} 26.90420 1.15430 0 {?} 0 1444 {361.HN} 6.302 0.035 0.040 ++ 0.000 {?} {322.HA} 4.144 0.058 0.086 ? 0.000 {?} {361.N} 110.911 0.104 0.104 EE 0.000 {?} 23.47480 1.37040 0 {?} 0 1445 {362.HN} 8.868 0.045 0.071 ++ 0.000 {?} {382.HB1} 1.265 0.093 0.093 ? 0.000 {?} {362.N} 122.862 0.132 0.132 EE 0.000 {?} 84.35720 2.40240 0 {?} 0 1446 {362.HN} 8.868 0.038 0.060 ++ 0.000 {?} {362.HB2} 1.171 0.042 0.093 ? 0.000 {?} {362.N} 122.862 0.127 0.127 EE 0.000 {?} 33.34900 2.15850 0 {?} 0 1447 {362.HN} 8.866 0.036 0.044 ++ 0.000 {?} {382.HG} 0.938 0.087 0.122 ? 0.000 {?} {362.N} 122.862 0.113 0.113 EE 0.000 {?} 42.64780 1.63020 0 {?} 0 1448 {364.HN} 8.791 0.035 0.036 ++ 0.000 {?} {381.HE1} 2.051 0.081 0.100 ? 0.000 {?} {364.N} 121.614 0.096 0.096 EE 0.000 {?} 32.21230 1.34160 0 {?} 0 1449 {364.HN} 8.791 0.035 0.038 ++ 0.000 {?} {381.HA} 5.072 0.076 0.082 ++ 0.000 {?} {364.N} 121.614 0.101 0.101 EE 0.000 {?} 28.47280 1.20480 0 {?} 0 1450 {364.HN} 8.789 0.039 0.038 ++ 0.000 {?} {382.HN} 9.095 0.076 0.116 ? 0.000 {?} {364.N} 121.614 0.086 0.086 EE 0.000 {?} 20.43280 1.18980 0 {?} 0 1451 {381.HN} 7.961 0.045 0.049 ++ 0.000 {?} {380.HN} 8.971 0.103 0.112 ? 0.000 {?} {381.N} 121.346 0.102 0.102 EE 0.000 {?} 40.81390 1.44510 0 {?} 0 1452 {320.HN} 9.147 0.044 0.037 ++ 0.000 {?} {365.HN} 10.237 0.077 0.054 ++ 0.000 {?} {320.N} 129.373 0.059 0.059 ? 0.000 {?} 8.76920 0.92670 0 {?} 0 1453 {365.HN} 10.256 0.043 0.083 ++ 0.000 {?} {365.HG1} 2.397 0.053 0.113 ? 0.000 {?} {365.N} 128.481 0.150 0.150 EE 0.000 {?} 100.70750 3.86300 0 {?} 0 1454 {365.HN} 10.247 0.033 0.037 ++ 0.000 {?} {363.HG11} 0.775 0.091 0.104 ? 0.000 {?} {365.N} 128.481 0.102 0.102 EE 0.000 {?} 31.54980 1.45130 0 {?} 0 1455 {367.HN} 8.529 0.018 0.075 ? 0.000 {?} {367.HB1} 1.870 0.099 0.148 ? 0.000 {?} {367.N} 121.525 0.171 0.171 EE 0.000 {?} 306.19299 9.23230 0 {?} 0 1456 {367.HN} 8.527 0.019 0.022 ++ 0.000 {?} {368.HN} 8.237 0.063 0.076 ++ 0.000 {?} {367.N} 121.525 0.110 0.110 EE 0.000 {?} 12.72120 1.62220 0 {?} 0 1457 {369.HN} 8.426 0.036 0.036 ++ 0.000 {?} {376.HD21} 0.938 0.075 0.063 ++ 0.000 {?} {369.N} 122.952 0.070 0.070 ? 0.000 {?} 14.16510 1.02010 0 {?} 0 1458 {?} 8.303 0.035 0.033 ++ 0.000 {?} {?} 8.818 0.101 0.094 ++ 0.000 {?} {?} 108.325 0.082 0.082 EE 0.000 {?} 14.91170 1.14010 0 {?} 0 1459 {?} 8.302 0.032 0.037 ++ 0.000 {?} {?} 4.474 0.108 0.126 ++ 0.000 {?} {?} 108.414 0.111 0.111 EE 0.000 {?} 37.91770 1.63020 0 {?} 0 1460 {380.HN} 8.942 0.039 0.043 ? 0.000 {?} {363.HG11} 0.772 0.111 0.111 ? 0.000 {?} {380.N} 124.557 0.100 0.100 EE 0.000 {?} 51.14950 1.40430 0 {?} 0 1461 {?} 9.131 0.039 0.040 ++ 0.000 {?} {?} 4.111 0.077 0.077 ? 0.000 {?} {?} 116.352 0.090 0.090 EE 0.000 {?} 24.94000 1.25290 0 {?} 0 1462 {386.HN} 8.043 0.033 0.040 ++ 0.000 {?} {385.HG2} 2.382 0.060 0.094 ? 0.000 {?} {386.N} 112.427 0.112 0.112 EE 0.000 {?} 26.61910 1.67180 0 {?} 0 1463 {387.HN} 7.362 0.036 0.053 ++ 0.000 {?} {310.HA} 4.894 0.051 0.113 ? 0.000 {?} {387.N} 115.371 0.133 0.133 EE 0.000 {?} 46.81450 2.42380 0 {?} 0 1464 {?} 7.363 0.035 0.035 ++ 0.000 {?} {?} 0.235 0.118 0.109 ++ 0.000 {?} {?} 115.371 0.081 0.081 EE 0.000 {?} 23.83440 1.13700 0 {?} 0 1465 {?} 7.367 0.030 0.028 ++ 0.000 {?} {?} 0.086 0.097 0.091 ++ 0.000 {?} {?} 115.371 0.083 0.083 EE 0.000 {?} 11.10800 1.16180 0 {?} 0 1466 {387.HN} 7.372 0.026 0.034 ++ 0.000 {?} {274.HG} 1.660 0.044 0.097 ? 0.000 {?} {387.N} 115.371 0.113 0.113 EE 0.000 {?} 15.65540 1.68160 0 {?} 0 1467 {280.HN} 6.852 0.048 0.043 ++ 0.000 {?} {282.HD1} 7.164 0.086 0.076 ++ 0.000 {?} {280.N} 120.276 0.077 0.077 EE 0.000 {?} 15.26450 1.08630 0 {?} 0 1468 {280.HN} 6.849 0.031 0.031 ++ 0.000 {?} {387.HN} 7.364 0.069 0.052 ++ 0.000 {?} {280.N} 120.276 0.060 0.060 ? 0.000 {?} 9.46650 0.93650 0 {?} 0 1469 {387.HN} 7.372 0.043 0.043 ++ 0.000 {?} {279.HN} 8.751 0.083 0.106 ? 0.000 {?} {387.N} 115.371 0.089 0.089 EE 0.000 {?} 34.69140 1.23750 0 {?} 0 1470 {392.HN} 8.218 0.036 0.040 ++ 0.000 {?} {306.HD11} 0.630 0.097 0.097 ? 0.000 {?} {392.N} 121.435 0.101 0.101 EE 0.000 {?} 34.66930 1.43140 0 {?} 0 1471 {?} 8.645 0.037 0.044 ++ 0.000 {?} {?} 1.555 0.086 0.120 ? 0.000 {?} {?} 122.773 0.112 0.112 EE 0.000 {?} 38.38790 1.66480 0 {?} 0 1472 {340.HN} 8.276 0.014 0.037 ? 0.000 {?} {333.HA} 4.718 0.030 0.087 ? 0.000 {?} {340.N} 121.525 0.177 0.177 EE 0.000 {?} 39.59180 4.72400 0 {?} 0 1473 {362.HN} 8.868 0.036 0.030 ++ 0.000 {?} {381.HA} 5.065 0.052 0.100 ? 0.000 {?} {362.N} 122.862 0.069 0.069 ? 0.000 {?} 9.38260 1.01370 0 {?} 0 1474 {362.HN} 8.865 0.029 0.045 ? 0.000 {?} {383.HA} 4.519 0.025 0.077 ? 0.000 {?} {362.N} 122.862 0.148 0.148 EE 0.000 {?} 21.65210 1.96960 0 {?} 0 1475 {?} 9.076 0.042 0.042 ++ 0.000 {?} {?} 4.463 0.080 0.051 ++ 0.000 {?} {?} 124.111 0.064 0.064 ? 0.000 {?} 11.44520 0.96920 0 {?} 0 1476 {380.HN} 8.948 0.034 0.032 ++ 0.000 {?} {364.HB2} 3.410 0.075 0.072 ++ 0.000 {?} {380.N} 124.468 0.084 0.084 EE 0.000 {?} 10.72940 1.12120 0 {?} 0 1477 {309.HN} 9.102 0.030 0.027 ++ 0.000 {?} {390.HN} 8.422 0.082 0.066 ++ 0.000 {?} {309.N} 122.684 0.060 0.060 ? 0.000 {?} 8.84660 0.93070 0 {?} 0 1478 {390.HN} 8.407 0.036 0.033 ++ 0.000 {?} {309.HN} 9.044 0.125 0.114 ++ 0.000 {?} {390.N} 111.268 0.078 0.078 EE 0.000 {?} 17.98560 1.09610 0 {?} 0 1479 {309.HN} 9.103 0.048 0.048 ++ 0.000 {?} {387.HA} 5.030 0.072 0.069 ++ 0.000 {?} {309.N} 122.684 0.063 0.063 ? 0.000 {?} 20.10910 0.96090 0 {?} 0 1480 {310.HN} 9.363 0.022 0.022 ++ 0.000 {?} {314.HA} 4.444 0.078 0.063 ++ 0.000 {?} {310.N} 115.995 0.070 0.070 ? 0.000 {?} 8.88880 1.01780 0 {?} 0 1481 {312.HN} 6.922 0.044 0.040 ++ 0.000 {?} {314.HA} 4.448 0.029 0.086 ? 0.000 {?} {312.N} 111.803 0.079 0.079 EE 0.000 {?} 6.33600 1.11460 0 {?} 0 1482 {279.HN} 8.736 0.040 0.041 ++ 0.000 {?} {389.HN} 8.583 0.071 0.074 ? 0.000 {?} {279.N} 119.562 0.093 0.093 EE 0.000 {?} 22.88790 1.29650 0 {?} 0 1483 {358.HN} 8.588 0.033 0.037 ++ 0.000 {?} {385.HB1} 2.713 0.080 0.102 ++ 0.000 {?} {358.N} 118.135 0.106 0.106 EE 0.000 {?} 30.07700 1.53020 0 {?} 0 1484 {?} 7.830 0.028 0.025 ++ 0.000 {?} {?} 2.084 0.111 0.111 ? 0.000 {?} {?} 117.065 0.076 0.076 EE 0.000 {?} 13.45950 1.07580 0 {?} 0 1485 {300.HN} 7.828 0.021 0.042 ? 0.000 {?} {298.HB1} 2.309 0.086 0.091 ? 0.000 {?} {300.N} 117.065 0.092 0.092 EE 0.000 {?} 23.68870 1.31780 0 {?} 0 1486 {300.HN} 7.831 0.019 0.038 ? 0.000 {?} {301.HB1} 1.969 0.125 0.132 ? 0.000 {?} {300.N} 117.065 0.092 0.092 EE 0.000 {?} 24.79840 1.27170 0 {?} 0 1487 {338.HN} 8.235 0.031 0.050 ? 0.000 {?} {336.HA} 4.488 0.057 0.112 ? 0.000 {?} {338.N} 117.859 0.111 0.111 EE 0.000 {?} 29.51150 2.02880 0 {?} 0 1488 {298.HN} 8.228 0.034 0.052 ++ 0.000 {?} {295.HA} 4.279 0.091 0.126 ? 0.000 {?} {298.N} 118.135 0.141 0.141 EE 0.000 {?} 66.35710 1.85670 0 {?} 0 1489 {297.HN} 8.307 0.025 0.075 ? 0.000 {?} {297.HG2} 2.210 0.065 0.129 ? 0.000 {?} {297.N} 120.008 0.167 0.167 EE 0.000 {?} 98.49710 3.12050 0 {?} 0 1490 {?} 8.425 0.041 0.038 ++ 0.000 {?} {?} 1.218 0.061 0.057 ++ 0.000 {?} {?} 117.244 0.083 0.083 EE 0.000 {?} 10.33200 1.16040 0 {?} 0 1491 {?} 6.848 0.044 0.042 ++ 0.000 {?} {?} 3.475 0.111 0.110 ? 0.000 {?} {?} 120.276 0.080 0.080 EE 0.000 {?} 21.84770 1.12700 0 {?} 0 1492 {284.HN} 8.580 0.016 0.036 ? 0.000 {?} {280.HD21} 0.942 0.035 0.098 ? 0.000 {?} {284.N} 118.671 0.146 0.146 EE 0.000 {?} 18.97910 2.88990 0 {?} 0 1493 {?} 8.559 0.033 0.037 ++ 0.000 {?} {?} 0.824 0.039 0.086 ? 0.000 {?} {?} 118.671 0.110 0.110 EE 0.000 {?} 22.37790 1.62020 0 {?} 0 1494 {287.HN} 8.211 0.038 0.036 ++ 0.000 {?} {295.HD1} 7.262 0.035 0.093 ? 0.000 {?} {287.N} 120.543 0.081 0.081 EE 0.000 {?} 11.89190 1.13860 0 {?} 0 1495 {330.HN} 8.653 0.017 0.054 ? 0.000 {?} {327.HN} 8.784 0.042 0.119 ? 0.000 {?} {330.N} 119.473 0.174 0.174 EE 0.000 {?} 84.91660 6.10360 0 {?} 0 1496 {327.HN} 8.784 0.015 0.049 ? 0.000 {?} {330.HN} 8.639 0.038 0.108 ? 0.000 {?} {327.N} 116.084 0.175 0.175 EE 0.000 {?} 33.08180 3.24200 0 {?} 0 1497 {332.HN} 8.559 0.017 0.048 ? 0.000 {?} {341.HN} 8.433 0.046 0.098 ? 0.000 {?} {332.N} 118.760 0.174 0.174 EE 0.000 {?} 89.17470 6.24890 0 {?} 0 1498 {336.HN} 7.672 0.032 0.032 ++ 0.000 {?} {334.HB2} 1.867 0.111 0.111 ? 0.000 {?} {336.N} 113.854 0.074 0.074 EE 0.000 {?} 24.02110 1.06000 0 {?} 0 1499 {337.HN} 8.211 0.032 0.032 ++ 0.000 {?} {334.HB1} 1.998 0.100 0.102 ? 0.000 {?} {337.N} 108.771 0.089 0.089 EE 0.000 {?} 26.32200 1.14750 0 {?} 0 1500 {338.HN} 8.233 0.040 0.041 ++ 0.000 {?} {335.HB1} 1.499 0.121 0.128 ++ 0.000 {?} {338.N} 117.868 0.091 0.091 EE 0.000 {?} 37.01320 1.26860 0 {?} 0 1501 {339.HN} 8.421 0.041 0.045 ? 0.000 {?} {333.HA} 4.712 0.067 0.067 ? 0.000 {?} {339.N} 120.276 0.103 0.103 EE 0.000 {?} 29.88200 1.46860 0 {?} 0 1502 {341.HN} 8.454 0.043 0.040 ++ 0.000 {?} {331.HB} 3.832 0.067 0.067 ? 0.000 {?} {341.N} 118.314 0.082 0.082 EE 0.000 {?} 17.62630 1.14110 0 {?} 0 1503 {341.HN} 8.452 0.023 0.051 ? 0.000 {?} {341.HB1} 4.387 0.042 0.119 ? 0.000 {?} {341.N} 118.314 0.172 0.172 EE 0.000 {?} 54.64810 3.49450 0 {?} 0 1504 {342.HN} 8.213 0.010 0.049 ? 0.000 {?} {341.HN} 8.445 0.045 0.080 ? 0.000 {?} {342.N} 119.206 0.130 0.130 EE 0.000 {?} 10.37760 2.17490 0 {?} 0 1505 {343.HN} 8.555 0.054 0.054 ++ 0.000 {?} {354.HD11} 0.904 0.118 0.094 ++ 0.000 {?} {343.N} 117.511 0.058 0.058 ? 0.000 {?} 73.43930 2.51830 0 {?} 0 1506 {344.HN} 8.184 0.034 0.051 ++ 0.000 {?} {342.HA} 4.543 0.066 0.126 ? 0.000 {?} {344.N} 119.384 0.155 0.155 EE 0.000 {?} 94.90180 2.85620 0 {?} 0 1507 {344.HN} 8.185 0.035 0.054 ? 0.000 {?} {341.HB1} 4.421 0.046 0.101 ? 0.000 {?} {344.N} 119.384 0.147 0.147 EE 0.000 {?} 58.62640 2.68010 0 {?} 0 1508 {345.HN} 8.933 0.036 0.039 ++ 0.000 {?} {346.HA} 3.795 0.074 0.126 ? 0.000 {?} {345.N} 121.168 0.101 0.101 EE 0.000 {?} 27.68980 1.36720 0 {?} 0 1509 {?} 7.574 0.034 0.032 ++ 0.000 {?} {?} 6.911 0.084 0.081 ++ 0.000 {?} {?} 120.811 0.084 0.084 EE 0.000 {?} 13.93500 1.17270 0 {?} 0 1510 {347.HN} 7.572 0.029 0.027 ++ 0.000 {?} {312.HD1} 6.611 0.083 0.083 ? 0.000 {?} {347.N} 120.811 0.082 0.082 EE 0.000 {?} 13.32750 1.14450 0 {?} 0 1511 {?} 7.576 0.035 0.040 ++ 0.000 {?} {?} 0.894 0.087 0.106 ? 0.000 {?} {?} 120.811 0.105 0.105 EE 0.000 {?} 36.20470 1.50100 0 {?} 0 1512 {?} 8.400 0.027 0.030 ++ 0.000 {?} {?} 2.326 0.078 0.090 ? 0.000 {?} {?} 118.581 0.099 0.099 EE 0.000 {?} 22.29470 1.38520 0 {?} 0 1513 {352.HN} 7.895 0.034 0.034 ++ 0.000 {?} {312.HD1} 6.644 0.096 0.090 ++ 0.000 {?} {352.N} 115.727 0.079 0.079 EE 0.000 {?} 16.80900 1.11590 0 {?} 0 1514 {356.HN} 8.344 0.036 0.036 ++ 0.000 {?} {357.HA} 4.308 0.069 0.070 ++ 0.000 {?} {356.N} 125.003 0.090 0.090 EE 0.000 {?} 20.31500 1.25460 0 {?} 0 1515 {357.HN} 8.886 0.041 0.041 ? 0.000 {?} {358.HB1} 2.054 0.065 0.104 ? 0.000 {?} {357.N} 124.735 0.110 0.110 EE 0.000 {?} 31.00360 1.61340 0 {?} 0 1516 {357.HN} 8.893 0.032 0.028 ++ 0.000 {?} {359.HN} 7.220 0.117 0.107 ++ 0.000 {?} {357.N} 124.735 0.077 0.077 EE 0.000 {?} 14.80550 1.08470 0 {?} 0 1517 {358.HN} 8.591 0.031 0.032 ++ 0.000 {?} {356.HB1} 3.055 0.044 0.097 ? 0.000 {?} {358.N} 118.135 0.094 0.094 EE 0.000 {?} 16.65140 1.24470 0 {?} 0 1518 {359.HN} 7.230 0.040 0.040 ++ 0.000 {?} {328.HD1} 3.552 0.110 0.104 ? 0.000 {?} {359.N} 121.881 0.080 0.080 EE 0.000 {?} 25.07220 1.12630 0 {?} 0 1519 {359.HN} 7.228 0.028 0.028 ++ 0.000 {?} {360.HD1} 3.667 0.073 0.073 ? 0.000 {?} {359.N} 121.881 0.065 0.065 ? 0.000 {?} 14.66620 0.94750 0 {?} 0 1520 {359.HN} 7.230 0.044 0.044 ++ 0.000 {?} {357.HA} 4.274 0.108 0.109 ++ 0.000 {?} {359.N} 121.881 0.090 0.090 EE 0.000 {?} 31.00200 1.25300 0 {?} 0 1521 {329.HN} 8.465 0.029 0.038 ? 0.000 {?} {357.HA} 4.300 0.080 0.080 ? 0.000 {?} {329.N} 111.446 0.098 0.098 EE 0.000 {?} 26.05660 1.29540 0 {?} 0 ; save_ save_peak_list_2 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_2 _Spectral_peak_list.Entry_ID 17273 _Spectral_peak_list.ID 2 _Spectral_peak_list.Sample_ID . _Spectral_peak_list.Sample_label . _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID . _Spectral_peak_list.Experiment_name . _Spectral_peak_list.Number_of_spectral_dimensions . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; label dataset sw sf H1 H2 C anoe.nv {8011.28 } {3208.71 } {5681.82 } {800.3538 } {800.3538 } {201.2727 } H1.L H1.P H1.W H1.B H1.E H1.J H1.U H2.L H2.P H2.W H2.B H2.E H2.J H2.U C.L C.P C.W C.B C.E C.J C.U vol int stat comment flag0 0 {346.HA} 3.809 0.071 0.078 ++ 0.000 {?} {350.HD1} 6.932 0.110 0.120 ++ 0.000 {?} {350.CD1} 133.438 0.680 1.103 ? 0.000 {?} 51.90750 0.46480 0 {?} 0 1 {350.HB1} 3.465 0.093 0.092 ++ 0.000 {?} {350.HD1} 6.924 0.100 0.099 ++ 0.000 {?} {350.CD1} 133.414 0.750 1.103 ? 0.000 {?} 35.75950 0.37860 0 {?} 0 2 {350.HB2} 2.495 0.084 0.081 ++ 0.000 {?} {350.HD1} 6.921 0.142 0.142 ++ 0.000 {?} {350.CD1} 133.436 0.792 1.103 ? 0.000 {?} 43.39940 0.32960 0 {?} 0 3 {349.HB1} 1.161 0.071 0.071 ? 0.000 {?} {350.HD1} 6.921 0.098 0.098 ? 0.000 {?} {350.CD1} 133.364 0.020 0.020 ? 0.000 {?} 5.77400 0.19010 0 {?} 0 4 {349.HB2} 0.662 0.062 0.062 ? 0.000 {?} {350.HD1} 6.918 0.094 0.094 ? 0.000 {?} {350.CD1} 133.415 0.046 0.046 ++ 0.000 {?} 5.45280 0.18640 0 {?} 0 5 {?} 3.676 0.060 0.052 ++ 0.000 {?} {?} 6.926 0.077 0.077 ++ 0.000 {?} {?} 133.228 0.542 0.454 ++ 0.000 {?} 5.51650 0.33110 0 {?} 0 6 {317.HB2} 2.242 0.109 0.109 ++ 0.000 {?} {317.HD1} 6.831 0.125 0.125 ++ 0.000 {?} {317.CD1} 133.193 0.469 0.469 ++ 0.000 {?} 80.81880 0.61340 0 {?} 0 7 {380.HB1} 1.245 0.063 0.112 ++ 0.000 {?} {317.HD1} 6.832 0.081 0.131 ++ 0.000 {?} {317.CD1} 133.175 0.702 1.103 ? 0.000 {?} 94.79900 1.04530 0 {?} 0 8 {309.HD21} 0.757 0.094 0.099 ++ 0.000 {?} {317.HD1} 6.834 0.114 0.121 ++ 0.000 {?} {317.CD1} 133.206 0.801 1.103 ? 0.000 {?} 93.07930 0.57380 0 {?} 0 9 {382.HD11} 0.094 0.090 0.109 ++ 0.000 {?} {317.HD1} 6.828 0.104 0.143 ++ 0.000 {?} {317.CD1} 133.205 0.760 1.103 ? 0.000 {?} 85.65960 0.56880 0 {?} 0 10 {345.HA} 4.269 0.053 0.081 ++ 0.000 {?} {345.HD1} 6.709 0.064 0.095 ++ 0.000 {?} {345.CD1} 133.158 0.740 1.103 ? 0.000 {?} 12.76820 0.15800 0 {?} 0 11 {364.HB1} 3.657 0.083 0.083 ++ 0.000 {?} {317.HD1} 6.828 0.097 0.097 ++ 0.000 {?} {317.CD1} 133.009 0.199 0.199 ++ 0.000 {?} 13.30890 0.30340 0 {?} 0 12 {364.HB2} 3.446 0.056 0.109 ? 0.000 {?} {317.HD1} 6.828 0.115 0.115 ? 0.000 {?} {317.CD1} 133.036 0.226 0.226 ++ 0.000 {?} 13.89970 0.34490 0 {?} 0 13 {388.HB1} 3.094 0.102 0.141 ++ 0.000 {?} {388.HD1} 7.144 0.075 0.103 ++ 0.000 {?} {388.CD1} 133.109 0.689 1.103 ? 0.000 {?} 103.56340 0.72530 0 {?} 0 14 {317.HB1} 2.926 0.164 0.141 ++ 0.000 {?} {317.HD1} 6.831 0.143 0.112 ++ 0.000 {?} {317.CD1} 133.129 0.695 0.577 ++ 0.000 {?} 47.60180 0.49540 0 {?} 0 15 {309.HB1} 1.665 0.086 0.086 ++ 0.000 {?} {388.HD1} 7.142 0.115 0.115 ++ 0.000 {?} {388.CD1} 133.041 0.489 0.489 ++ 0.000 {?} 44.43650 0.35510 0 {?} 0 16 {311.HG1} 1.235 0.094 0.099 ++ 0.000 {?} {388.HD1} 7.142 0.091 0.098 ++ 0.000 {?} {388.CD1} 133.152 0.677 0.739 ? 0.000 {?} 77.30590 0.56560 0 {?} 0 17 {278.HG21} 0.938 0.067 0.084 ++ 0.000 {?} {388.HD1} 7.139 0.114 0.138 ++ 0.000 {?} {388.CD1} 133.147 0.795 1.103 ? 0.000 {?} 66.16910 0.43150 0 {?} 0 18 {309.HD11} 0.779 0.073 0.113 ++ 0.000 {?} {388.HD1} 7.141 0.104 0.130 ++ 0.000 {?} {388.CD1} 133.113 1.103 1.103 ? 0.000 {?} 106.54450 0.62670 0 {?} 0 19 {346.HA} 3.812 0.098 0.085 ++ 0.000 {?} {346.HD1} 7.213 0.105 0.105 ++ 0.000 {?} {346.CD1} 132.878 0.652 0.479 ++ 0.000 {?} 11.43090 0.25370 0 {?} 0 20 {287.HA} 3.950 0.089 0.099 ++ 0.000 {?} {287.HD1} 6.073 0.124 0.133 ++ 0.000 {?} {287.CD1} 132.556 0.747 1.103 ? 0.000 {?} 94.59030 0.64510 0 {?} 0 21 {332.HB1} 2.926 0.057 0.092 ++ 0.000 {?} {332.HD1} 6.295 0.079 0.119 ++ 0.000 {?} {332.CD1} 132.619 0.861 1.103 ? 0.000 {?} 26.94620 0.25420 0 {?} 0 22 {287.HB1} 2.832 0.093 0.108 ? 0.000 {?} {287.HD1} 6.077 0.092 0.096 ++ 0.000 {?} {287.CD1} 132.529 0.729 1.103 ? 0.000 {?} 71.62290 0.60530 0 {?} 0 23 {287.HB2} 2.716 0.076 0.078 ? 0.000 {?} {287.HD1} 6.073 0.083 0.085 ++ 0.000 {?} {287.CD1} 132.549 0.753 1.103 ? 0.000 {?} 57.43840 0.52790 0 {?} 0 24 {332.HB2} 2.620 0.066 0.087 ++ 0.000 {?} {332.HD1} 6.295 0.055 0.073 ++ 0.000 {?} {332.CD1} 132.616 1.103 1.103 ? 0.000 {?} 21.95210 0.20260 0 {?} 0 25 {284.HA} 4.366 0.067 0.067 ++ 0.000 {?} {287.HD1} 6.073 0.095 0.095 ++ 0.000 {?} {287.CD1} 132.402 0.334 0.334 ++ 0.000 {?} 8.18400 0.20050 0 {?} 0 26 {295.HB2} 3.005 0.081 0.081 ++ 0.000 {?} {295.HD1} 7.206 0.109 0.109 ++ 0.000 {?} {295.CD1} 132.145 1.103 1.103 ? 0.000 {?} 152.40880 0.72670 0 {?} 0 27 {282.HA} 4.315 0.058 0.079 ++ 0.000 {?} {282.HD1} 7.187 0.097 0.130 ? 0.000 {?} {282.CD1} 131.963 0.878 1.103 ? 0.000 {?} 156.78059 1.33330 0 {?} 0 28 {287.HA} 3.968 0.068 0.077 ++ 0.000 {?} {286.HD1} 7.177 0.092 0.105 ++ 0.000 {?} {286.CD1} 131.800 1.103 1.103 ? 0.000 {?} 160.66670 0.93230 0 {?} 0 29 {282.HB1} 3.463 0.068 0.070 ++ 0.000 {?} {282.HD1} 7.189 0.087 0.090 ++ 0.000 {?} {282.CD1} 132.016 0.755 0.792 ? 0.000 {?} 83.75660 0.80100 0 {?} 0 30 {282.HB2} 3.307 0.056 0.096 ? 0.000 {?} {282.HD1} 7.187 0.076 0.108 ? 0.000 {?} {282.CD1} 131.969 1.103 1.103 ? 0.000 {?} 172.27570 1.40110 0 {?} 0 31 {286.HB1} 3.185 0.097 0.108 ? 0.000 {?} {286.HD1} 7.176 0.108 0.139 ++ 0.000 {?} {286.CD1} 131.867 0.831 1.103 ? 0.000 {?} 244.85941 1.20270 0 {?} 0 32 {286.HB2} 2.921 0.073 0.086 ++ 0.000 {?} {286.HD1} 7.170 0.079 0.092 ++ 0.000 {?} {286.CD1} 131.834 0.849 1.103 ? 0.000 {?} 112.50960 0.85450 0 {?} 0 33 {298.HG2} 2.455 0.069 0.069 ++ 0.000 {?} {286.HD1} 7.179 0.075 0.075 ++ 0.000 {?} {286.CD1} 131.883 0.270 0.270 ++ 0.000 {?} 15.32930 0.47770 0 {?} 0 34 {299.HB} 1.742 0.060 0.066 ++ 0.000 {?} {286.HD1} 7.183 0.099 0.107 ++ 0.000 {?} {286.CD1} 131.836 1.103 1.103 ? 0.000 {?} 114.51250 0.68420 0 {?} 0 35 {290.HG21} 1.220 0.054 0.054 ++ 0.000 {?} {286.HD1} 7.173 0.111 0.111 ++ 0.000 {?} {286.CD1} 131.839 0.586 0.586 ++ 0.000 {?} 50.27400 0.63130 0 {?} 0 36 {279.HG21} 0.946 0.086 0.086 ++ 0.000 {?} {282.HD1} 7.187 0.092 0.080 ++ 0.000 {?} {282.CD1} 131.881 1.103 1.103 ? 0.000 {?} 60.50920 0.37130 0 {?} 0 37 {299.HG11} 0.649 0.050 0.083 ? 0.000 {?} {286.HD1} 7.180 0.063 0.117 ++ 0.000 {?} {286.CD1} 131.838 1.103 1.103 ? 0.000 {?} 183.71120 1.79580 0 {?} 0 38 {286.HA} 4.166 0.056 0.074 ++ 0.000 {?} {286.HD1} 7.167 0.102 0.124 ++ 0.000 {?} {286.CD1} 131.830 1.103 1.103 ? 0.000 {?} 127.72170 0.96690 0 {?} 0 39 {383.HD11} 0.174 0.071 0.071 ++ 0.000 {?} {342.HD1} 7.437 0.103 0.103 ++ 0.000 {?} {342.CD1} 131.645 0.562 0.562 ++ 0.000 {?} 14.58900 0.17450 0 {?} 0 40 {342.HA} 4.562 0.116 0.116 +E 0.000 {?} {342.HD1} 7.437 0.156 0.158 ++ 0.000 {?} {342.CD1} 131.546 1.103 1.103 ? 0.000 {?} 236.02750 0.82320 0 {?} 0 41 {281.HA} 4.427 0.041 0.059 ? 0.000 {?} {284.HD1} 7.313 0.081 0.096 ++ 0.000 {?} {284.CD1} 131.437 0.723 1.103 ? 0.000 {?} 32.14360 0.42420 0 {?} 0 42 {284.HA} 4.360 0.053 0.068 ? 0.000 {?} {284.HD1} 7.310 0.077 0.128 ? 0.000 {?} {284.CD1} 131.531 1.103 1.103 ? 0.000 {?} 90.94130 0.90280 0 {?} 0 43 {284.HB1} 3.300 0.063 0.108 ++ 0.000 {?} {284.HD1} 7.307 0.064 0.136 ? 0.000 {?} {284.CD1} 131.490 1.103 1.103 ? 0.000 {?} 148.23680 1.47180 0 {?} 0 44 {342.HB2} 3.172 0.080 0.080 ++ 0.000 {?} {342.HD1} 7.426 0.093 0.093 ++ 0.000 {?} {342.CD1} 131.521 0.868 0.868 ++ 0.000 {?} 50.03800 0.32270 0 {?} 0 45 {280.HD11} 0.951 0.071 0.116 ++ 0.000 {?} {284.HD1} 7.310 0.076 0.117 ++ 0.000 {?} {284.CD1} 131.473 1.103 1.103 ? 0.000 {?} 115.85100 0.96030 0 {?} 0 46 {298.HB1} 2.301 0.070 0.088 ? 0.000 {?} {286.HE1} 7.100 0.089 0.096 ++ 0.000 {?} {286.CE1} 131.094 0.772 0.835 ? 0.000 {?} 87.52280 0.73970 0 {?} 0 47 {298.HB2} 2.215 0.078 0.091 ? 0.000 {?} {286.HE1} 7.098 0.090 0.108 ++ 0.000 {?} {286.CE1} 131.089 1.103 1.103 ? 0.000 {?} 103.96300 0.60610 0 {?} 0 48 {290.HG21} 1.219 0.072 0.072 ++ 0.000 {?} {286.HE1} 7.099 0.094 0.085 ++ 0.000 {?} {286.CE1} 131.046 1.103 1.103 ? 0.000 {?} 41.89280 0.45220 0 {?} 0 49 {302.HB1} 2.196 0.066 0.066 ++ 0.000 {?} {282.HZ} 7.349 0.112 0.112 ++ 0.000 {?} {282.CZ} 130.093 0.159 0.159 ++ 0.000 {?} 9.98310 0.28640 0 {?} 0 50 {381.HG1} 2.716 0.081 0.081 ++ 0.000 {?} {342.HZ} 7.212 0.090 0.090 ++ 0.000 {?} {342.CZ} 129.964 0.472 0.456 ++ 0.000 {?} 11.79400 0.28170 0 {?} 0 51 {381.HE1} 2.050 0.065 0.065 ++ 0.000 {?} {342.HZ} 7.194 0.121 0.121 ++ 0.000 {?} {342.CZ} 129.956 0.535 0.535 ++ 0.000 {?} 41.93950 0.41880 0 {?} 0 52 {280.HD21} 0.950 0.099 0.089 ++ 0.000 {?} {284.HE1} 7.358 0.130 0.109 ++ 0.000 {?} {284.CE1} 130.014 0.703 0.603 ++ 0.000 {?} 26.49130 0.50130 0 {?} 0 53 {299.HG11} 0.665 0.075 0.075 ++ 0.000 {?} {295.HZ} 7.254 0.120 0.120 ++ 0.000 {?} {295.CZ} 129.750 0.240 0.240 ++ 0.000 {?} 15.79540 0.32540 0 {?} 0 54 {361.HG11} 0.446 0.049 0.049 ? 0.000 {?} {342.HZ} 7.217 0.052 0.052 ++ 0.000 {?} {342.CZ} 129.982 0.084 0.084 ++ 0.000 {?} 2.34470 0.16070 0 {?} 0 55 {298.HB1} 2.309 0.056 0.064 ? 0.000 {?} {286.HZ} 7.194 0.101 0.101 ++ 0.000 {?} {286.CZ} 129.839 0.863 0.686 ? 0.000 {?} 40.26380 0.57010 0 {?} 0 56 {298.HB2} 2.220 0.075 0.080 ? 0.000 {?} {286.HZ} 7.191 0.093 0.100 ++ 0.000 {?} {286.CZ} 129.837 0.793 0.845 ? 0.000 {?} 80.49940 0.63560 0 {?} 0 57 {324.HB2} 3.021 0.085 0.109 ++ 0.000 {?} {324.HD1} 7.293 0.084 0.103 ++ 0.000 {?} {324.CD1} 128.092 0.599 1.103 ? 0.000 {?} 60.37220 0.65330 0 {?} 0 58 {324.HA} 4.497 0.075 0.075 +E 0.000 {?} {324.HD1} 7.290 0.077 0.077 ++ 0.000 {?} {324.CD1} 128.009 0.678 0.462 ++ 0.000 {?} 5.74170 0.20840 0 {?} 0 59 {324.HB1} 3.636 0.084 0.080 ++ 0.000 {?} {324.HD1} 7.288 0.100 0.096 ++ 0.000 {?} {324.CD1} 128.068 0.655 0.627 ? 0.000 {?} 21.38530 0.43140 0 {?} 0 60 {283.HE1} 1.926 0.086 0.066 ++ 0.000 {?} {324.HH2} 6.769 0.121 0.121 ++ 0.000 {?} {324.CH2} 123.495 0.683 0.510 ++ 0.000 {?} 22.73500 0.54150 0 {?} 0 61 {299.HG21} 0.827 0.027 0.095 ? 0.000 {?} {324.HH2} 6.772 0.098 0.133 ++ 0.000 {?} {324.CH2} 123.500 0.865 1.103 ? 0.000 {?} 36.17040 0.61040 0 {?} 0 62 {324.HA} 4.490 0.077 0.077 +E 0.000 {?} {324.HE3} 7.948 0.110 0.110 ++ 0.000 {?} {324.CZ3} 121.643 0.407 0.407 ++ 0.000 {?} 19.89620 0.25760 0 {?} 0 63 {288.HA} 4.450 0.086 0.086 ++ 0.000 {?} {288.HD2} 7.135 0.096 0.083 ++ 0.000 {?} {288.CD2} 120.275 0.734 0.650 ++ 0.000 {?} 22.39620 0.42210 0 {?} 0 64 {288.HB1} 3.295 0.072 0.071 ++ 0.000 {?} {288.HD2} 7.136 0.073 0.072 ++ 0.000 {?} {288.CD2} 120.289 0.828 0.812 ? 0.000 {?} 15.52670 0.40240 0 {?} 0 65 {288.HB2} 3.073 0.080 0.078 ++ 0.000 {?} {288.HD2} 7.137 0.073 0.073 ++ 0.000 {?} {288.CD2} 120.276 0.859 1.103 ? 0.000 {?} 34.53400 0.42910 0 {?} 0 66 {271.HB1} 3.258 0.050 0.069 ++ 0.000 {?} {271.HD2} 7.197 0.073 0.088 ++ 0.000 {?} {271.CD2} 119.860 1.103 1.103 ? 0.000 {?} 42.14970 0.45210 0 {?} 0 67 {271.HB2} 3.142 0.041 0.058 ++ 0.000 {?} {271.HD2} 7.194 0.062 0.085 ++ 0.000 {?} {271.CD2} 119.851 0.692 1.103 ? 0.000 {?} 26.34420 0.52920 0 {?} 0 68 {274.HD11} 0.933 0.062 0.051 ++ 0.000 {?} {271.HD2} 7.192 0.050 0.050 ++ 0.000 {?} {271.CD2} 119.876 0.635 0.484 ++ 0.000 {?} 1.87730 0.14240 0 {?} 0 69 {293.HA} 4.491 0.055 0.055 +E 0.000 {?} {293.HD2} 7.183 0.080 0.080 ++ 0.000 {?} {293.CD2} 119.287 0.347 0.347 ++ 0.000 {?} 7.82070 0.32630 0 {?} 0 70 {293.HB1} 3.340 0.049 0.084 ? 0.000 {?} {293.HD2} 7.185 0.094 0.093 ++ 0.000 {?} {293.CD2} 119.284 0.811 1.103 ? 0.000 {?} 34.71420 0.54890 0 {?} 0 71 {293.HB2} 3.223 0.033 0.074 ? 0.000 {?} {293.HD2} 7.188 0.135 0.131 ++ 0.000 {?} {293.CD2} 119.311 1.103 1.103 ? 0.000 {?} 52.92240 0.70710 0 {?} 0 72 {313.HB1} 3.402 0.059 0.072 ++ 0.000 {?} {312.HE1} 6.721 0.095 0.117 ++ 0.000 {?} {312.CE1} 118.727 0.873 1.103 ? 0.000 {?} 42.60430 0.33120 0 {?} 0 73 {386.HB2} 1.972 0.022 0.108 ? 0.000 {?} {312.HE1} 6.726 0.105 0.099 ++ 0.000 {?} {312.CE1} 118.755 0.762 0.725 ? 0.000 {?} 15.00300 0.50580 0 {?} 0 74 {?} 1.705 0.053 0.053 ++ 0.000 {?} {?} 6.718 0.091 0.091 ++ 0.000 {?} {?} 118.707 0.270 0.270 ++ 0.000 {?} 3.95900 0.13670 0 {?} 0 75 {315.HD1} 1.673 0.037 0.068 ? 0.000 {?} {317.HE1} 6.925 0.095 0.095 ++ 0.000 {?} {317.CE1} 118.633 0.713 0.487 ++ 0.000 {?} 7.59870 0.21010 0 {?} 0 76 {380.HB1} 1.247 0.026 0.081 ? 0.000 {?} {317.HE1} 6.922 0.037 0.092 ? 0.000 {?} {317.CE1} 118.612 0.686 1.103 ? 0.000 {?} 17.64410 0.66760 0 {?} 0 77 {386.HD11} 0.279 0.055 0.066 ++ 0.000 {?} {312.HE1} 6.721 0.104 0.125 ++ 0.000 {?} {312.CE1} 118.737 1.103 1.103 ? 0.000 {?} 50.17600 0.41710 0 {?} 0 78 {382.HD11} 0.054 0.087 0.087 ++ 0.000 {?} {317.HE1} 6.921 0.087 0.082 ++ 0.000 {?} {317.CE1} 118.617 0.810 1.103 ? 0.000 {?} 16.13050 0.14450 0 {?} 0 79 {309.HD11} 0.777 0.073 0.073 ++ 0.000 {?} {388.HE1} 6.834 0.091 0.091 ++ 0.000 {?} {388.CE1} 118.391 0.696 1.103 ? 0.000 {?} 44.67180 0.41370 0 {?} 0 80 {?} 4.055 0.073 0.073 ++ 0.000 {?} {?} 6.833 0.067 0.067 ++ 0.000 {?} {?} 118.345 0.660 0.471 ? 0.000 {?} 5.35720 0.15670 0 {?} 0 81 {276.HB1} 3.870 0.079 0.079 ++ 0.000 {?} {388.HE1} 6.832 0.097 0.097 ++ 0.000 {?} {388.CE1} 118.320 0.749 0.502 ++ 0.000 {?} 20.50190 0.38350 0 {?} 0 82 {388.HB1} 3.084 0.112 0.095 ++ 0.000 {?} {388.HE1} 6.825 0.093 0.093 ++ 0.000 {?} {388.CE1} 118.281 0.867 0.747 ? 0.000 {?} 25.62410 0.29230 0 {?} 0 83 {388.HB2} 2.837 0.103 0.103 ++ 0.000 {?} {388.HE1} 6.832 0.075 0.075 ++ 0.000 {?} {388.CE1} 118.310 0.376 0.376 ++ 0.000 {?} 24.72790 0.30830 0 {?} 0 84 {?} 1.708 0.066 0.114 ? 0.000 {?} {?} 6.830 0.085 0.085 ++ 0.000 {?} {?} 118.344 0.149 0.149 ++ 0.000 {?} 17.15110 0.41590 0 {?} 0 85 {278.HG21} 0.954 0.076 0.114 ++ 0.000 {?} {388.HE1} 6.831 0.073 0.107 ++ 0.000 {?} {388.CE1} 118.377 0.694 1.103 ? 0.000 {?} 81.55120 0.80190 0 {?} 0 86 {346.HA} 3.820 0.065 0.065 ++ 0.000 {?} {350.HE1} 6.800 0.093 0.093 ++ 0.000 {?} {350.CE1} 118.119 0.741 0.502 ++ 0.000 {?} 9.76750 0.17850 0 {?} 0 87 {287.HA} 3.954 0.080 0.080 ++ 0.000 {?} {287.HE1} 6.578 0.093 0.093 ++ 0.000 {?} {287.CE1} 117.812 0.228 0.228 ++ 0.000 {?} 18.99440 0.62910 0 {?} 0 88 {292.HG1} 2.271 0.070 0.070 ? 0.000 {?} {287.HE1} 6.578 0.090 0.090 ? 0.000 {?} {287.CE1} 117.969 0.017 0.017 ? 0.000 {?} 9.01410 0.30820 0 {?} 0 89 {349.HB1} 1.157 0.065 0.065 ++ 0.000 {?} {345.HE1} 6.611 0.087 0.087 ++ 0.000 {?} {345.CE1} 117.781 0.284 0.284 ++ 0.000 {?} 5.57350 0.16940 0 {?} 0 90 {345.HA} 4.286 0.068 0.068 ++ 0.000 {?} {345.HE1} 6.610 0.083 0.083 ++ 0.000 {?} {345.CE1} 117.613 0.547 0.547 ++ 0.000 {?} 19.34760 0.26030 0 {?} 0 91 {345.HB2} 3.093 0.084 0.084 ++ 0.000 {?} {345.HE1} 6.610 0.091 0.091 ++ 0.000 {?} {345.CE1} 117.644 0.573 0.573 ++ 0.000 {?} 20.85210 0.18080 0 {?} 0 92 {349.HG1} 1.658 0.077 0.073 ++ 0.000 {?} {345.HE1} 6.613 0.083 0.079 ++ 0.000 {?} {345.CE1} 117.685 0.815 0.773 ? 0.000 {?} 10.30110 0.21440 0 {?} 0 93 {296.HA} 3.023 0.070 0.070 ++ 0.000 {?} {324.HZ2} 7.131 0.102 0.102 ++ 0.000 {?} {324.CZ2} 113.750 0.144 0.144 ? 0.000 {?} 20.51050 0.65250 0 {?} 0 94 {299.HG21} 0.818 0.048 0.078 ? 0.000 {?} {324.HZ2} 7.130 0.113 0.136 ++ 0.000 {?} {324.CZ2} 113.750 0.275 0.275 ? 0.000 {?} 31.92300 1.02430 0 {?} 0 95 {322.HD11} 0.757 0.053 0.053 ? 0.000 {?} {324.HZ2} 7.132 0.142 0.142 ++ 0.000 {?} {324.CZ2} 113.750 0.202 0.202 ? 0.000 {?} 25.81730 0.68920 0 {?} 0 96 {312.HD1} 6.621 0.059 0.081 ? 0.000 {?} {350.HD1} 6.918 0.084 0.168 ? 0.000 {?} {350.CD1} 133.394 0.620 1.103 ? 0.000 {?} 29.49250 0.34220 0 {?} 0 97 {346.HD1} 7.218 0.067 0.097 ++ 0.000 {?} {350.HD1} 6.929 0.101 0.170 ? 0.000 {?} {350.CD1} 133.361 0.842 1.103 ? 0.000 {?} 68.97520 0.51490 0 {?} 0 98 {350.HE1} 6.821 0.032 0.106 ? 0.000 {?} {350.HD1} 6.917 0.063 0.136 ? 0.000 {?} {350.CD1} 133.359 0.805 1.103 ? 0.000 {?} 116.38030 1.82650 0 {?} 0 99 {388.HE1} 6.830 0.029 0.122 ? 0.000 {?} {388.HD1} 7.142 0.058 0.154 ? 0.000 {?} {388.CD1} 133.163 0.702 1.103 ? 0.000 {?} 154.35660 4.32370 0 {?} 0 100 {345.HE1} 6.625 0.039 0.104 ? 0.000 {?} {345.HD1} 6.696 0.052 0.133 ? 0.000 {?} {345.CD1} 133.123 0.775 1.103 ? 0.000 {?} 27.46880 0.57890 0 {?} 0 101 {316.HA} 5.613 0.089 0.089 ++ 0.000 {?} {317.HD1} 6.823 0.121 0.097 ++ 0.000 {?} {317.CD1} 133.143 0.288 0.288 ++ 0.000 {?} 6.83300 0.23320 0 {?} 0 102 {346.HE1} 6.655 0.043 0.087 ? 0.000 {?} {346.HD1} 7.218 0.063 0.132 ++ 0.000 {?} {346.CD1} 132.884 0.867 1.103 ? 0.000 {?} 26.85800 0.35500 0 {?} 0 103 {295.HD1} 7.204 0.081 0.081 ++ 0.000 {?} {287.HD1} 6.073 0.109 0.109 ++ 0.000 {?} {287.CD1} 132.540 0.068 0.068 ++ 0.000 {?} 12.34850 0.37050 0 {?} 0 104 {287.HE1} 6.583 0.048 0.099 ++ 0.000 {?} {287.HD1} 6.077 0.100 0.262 ? 0.000 {?} {287.CD1} 132.543 0.752 1.103 ? 0.000 {?} 315.40350 4.12910 0 {?} 0 105 {332.HE1} 6.439 0.023 0.096 ? 0.000 {?} {332.HD1} 6.307 0.044 0.150 ? 0.000 {?} {332.CD1} 132.606 0.854 1.103 ? 0.000 {?} 14.14450 0.49210 0 {?} 0 106 {295.HE1} 7.553 0.054 0.110 ++ 0.000 {?} {295.HD1} 7.190 0.092 0.167 ? 0.000 {?} {295.CD1} 132.147 1.103 1.103 ? 0.000 {?} 220.07430 1.63700 0 {?} 0 107 {342.HD1} 7.434 0.036 0.114 ? 0.000 {?} {342.HE1} 7.094 0.101 0.173 ? 0.000 {?} {342.CE1} 131.931 1.103 1.103 ? 0.000 {?} 60.83040 0.54690 0 {?} 0 108 {324.HZ3} 7.307 0.048 0.090 ? 0.000 {?} {295.HE1} 7.552 0.074 0.174 ? 0.000 {?} {295.CE1} 131.722 1.103 1.103 ? 0.000 {?} 73.08700 0.69340 0 {?} 0 109 {295.HD1} 7.209 0.022 0.063 ? 0.000 {?} {295.HE1} 7.550 0.083 0.170 ? 0.000 {?} {295.CE1} 131.715 1.103 1.103 ? 0.000 {?} 105.36090 2.00250 0 {?} 0 110 {346.HE1} 6.666 0.075 0.074 ++ 0.000 {?} {342.HD1} 7.423 0.117 0.117 ++ 0.000 {?} {342.CD1} 131.655 0.843 1.103 ? 0.000 {?} 25.48330 0.22290 0 {?} 0 111 {342.HZ} 7.204 0.062 0.086 ? 0.000 {?} {342.HD1} 7.435 0.030 0.134 ? 0.000 {?} {342.CD1} 131.577 1.103 1.103 ? 0.000 {?} 60.45430 0.91700 0 {?} 0 112 {342.HE1} 7.108 0.047 0.098 ? 0.000 {?} {342.HD1} 7.433 0.058 0.138 ? 0.000 {?} {342.CD1} 131.598 1.103 1.103 ? 0.000 {?} 74.85990 0.88140 0 {?} 0 113 {282.HE1} 7.198 0.031 0.121 ? 0.000 {?} {282.HZ} 7.344 0.053 0.161 ? 0.000 {?} {282.CZ} 130.052 0.844 1.103 ? 0.000 {?} 183.37460 3.86190 0 {?} 0 114 {286.HE1} 7.097 0.096 0.096 ? 0.000 {?} {286.HZ} 7.192 0.049 0.150 ? 0.000 {?} {286.CZ} 129.901 1.103 1.103 ? 0.000 {?} 418.47470 4.63170 0 {?} 0 115 {332.HD1} 6.290 0.035 0.088 ? 0.000 {?} {332.HE1} 6.450 0.056 0.139 ? 0.000 {?} {332.CE1} 130.061 0.728 1.103 ? 0.000 {?} 12.29800 0.25730 0 {?} 0 116 {295.HE1} 7.553 0.063 0.120 ++ 0.000 {?} {295.HZ} 7.249 0.079 0.161 ++ 0.000 {?} {295.CZ} 129.842 0.717 1.103 ? 0.000 {?} 151.64290 1.70380 0 {?} 0 117 {295.HE1} 7.552 0.064 0.064 ++ 0.000 {?} {324.HH2} 6.774 0.113 0.113 ++ 0.000 {?} {324.CH2} 123.500 0.743 0.552 ++ 0.000 {?} 25.33660 0.41080 0 {?} 0 118 {324.HZ3} 7.300 0.071 0.118 ++ 0.000 {?} {324.HH2} 6.772 0.097 0.148 ++ 0.000 {?} {324.CH2} 123.500 1.103 1.103 ? 0.000 {?} 131.65860 0.94560 0 {?} 0 119 {324.HZ2} 7.126 0.064 0.084 ++ 0.000 {?} {324.HH2} 6.772 0.093 0.120 ++ 0.000 {?} {324.CH2} 123.500 0.732 1.103 ? 0.000 {?} 102.85590 1.02550 0 {?} 0 120 {324.HE3} 7.946 0.080 0.080 ++ 0.000 {?} {324.HZ3} 7.298 0.105 0.105 ++ 0.000 {?} {324.CZ3} 121.750 0.624 0.624 ++ 0.000 {?} 35.21350 0.36740 0 {?} 0 121 {324.HZ3} 7.302 0.093 0.080 ++ 0.000 {?} {324.HE3} 7.943 0.118 0.105 ++ 0.000 {?} {324.CE3} 121.619 1.103 1.103 ? 0.000 {?} 46.79590 0.42780 0 {?} 0 122 {324.HH2} 6.768 0.067 0.067 ++ 0.000 {?} {324.HZ3} 7.293 0.106 0.106 ++ 0.000 {?} {324.CZ3} 121.727 0.790 0.461 ++ 0.000 {?} 10.13460 0.27060 0 {?} 0 123 {342.HD1} 7.433 0.062 0.091 ++ 0.000 {?} {346.HE1} 6.642 0.093 0.164 ++ 0.000 {?} {346.CE1} 118.469 0.826 1.103 ? 0.000 {?} 23.66110 0.19980 0 {?} 0 124 {346.HD1} 7.218 0.058 0.159 ? 0.000 {?} {346.HE1} 6.644 0.084 0.183 ? 0.000 {?} {346.CE1} 118.478 0.841 1.103 ? 0.000 {?} 53.99640 0.40240 0 {?} 0 125 {388.HD1} 7.140 0.045 0.170 ? 0.000 {?} {388.HE1} 6.831 0.072 0.218 ? 0.000 {?} {388.CE1} 118.359 0.737 1.103 ? 0.000 {?} 379.90640 5.68590 0 {?} 0 126 {350.HD1} 6.923 0.032 0.116 ? 0.000 {?} {350.HE1} 6.806 0.070 0.176 ? 0.000 {?} {350.CE1} 118.201 0.821 1.103 ? 0.000 {?} 122.96490 1.92120 0 {?} 0 127 {295.HZ} 7.309 0.065 0.065 ++ 0.000 {?} {287.HE1} 6.585 0.121 0.096 ++ 0.000 {?} {287.CE1} 117.964 0.864 0.649 ++ 0.000 {?} 17.08220 0.32810 0 {?} 0 128 {295.HE1} 7.557 0.056 0.056 ++ 0.000 {?} {287.HE1} 6.580 0.090 0.090 ++ 0.000 {?} {287.CE1} 117.818 0.331 0.331 ++ 0.000 {?} 5.41870 0.20530 0 {?} 0 129 {287.HD1} 6.078 0.061 0.167 ++ 0.000 {?} {287.HE1} 6.578 0.072 0.192 ++ 0.000 {?} {287.CE1} 117.833 0.845 1.103 ? 0.000 {?} 526.92200 6.57630 0 {?} 0 130 {345.HD1} 6.711 0.030 0.106 ? 0.000 {?} {345.HE1} 6.609 0.064 0.158 ? 0.000 {?} {345.CE1} 117.709 0.772 1.103 ? 0.000 {?} 106.00750 1.81750 0 {?} 0 131 {324.HZ3} 7.296 0.077 0.077 ++ 0.000 {?} {324.HZ2} 7.126 0.125 0.125 ++ 0.000 {?} {324.CZ2} 113.785 0.133 0.133 ? 0.000 {?} 21.18770 0.49280 0 {?} 0 132 {324.HH2} 6.775 0.062 0.069 ++ 0.000 {?} {324.HZ2} 7.130 0.102 0.113 ++ 0.000 {?} {324.CZ2} 113.750 0.253 0.253 ? 0.000 {?} 37.63370 1.17650 0 {?} 0 133 {312.HD1} 6.610 0.041 0.108 ? 0.000 {?} {350.HE1} 6.802 0.025 0.123 ? 0.000 {?} {350.CE1} 118.050 0.404 0.404 EE 0.000 {?} 11.36070 0.73080 0 {?} 0 134 {317.HA} 4.670 0.036 0.089 ? 0.000 {?} {317.HD1} 6.837 0.068 0.109 ++ 0.000 {?} {317.CD1} 133.205 0.360 0.360 EE 0.000 {?} 13.49200 0.65450 0 {?} 0 135 {317.HE1} 6.905 0.068 0.089 ++ 0.000 {?} {317.HD1} 6.832 0.073 0.100 ++ 0.000 {?} {317.CD1} 133.205 0.296 0.296 EE 0.000 {?} 99.14740 2.28880 0 {?} 0 136 {350.HA} 5.062 0.057 0.092 ++ 0.000 {?} {350.HD1} 6.927 0.082 0.142 ++ 0.000 {?} {350.CD1} 133.365 0.392 0.392 EE 0.000 {?} 41.74710 0.86300 0 {?} 0 137 {346.HB2} 2.925 0.060 0.078 ++ 0.000 {?} {346.HD1} 7.206 0.090 0.110 ++ 0.000 {?} {346.CD1} 132.833 0.300 0.300 EE 0.000 {?} 16.76870 0.36700 0 {?} 0 138 {350.HD1} 6.936 0.048 0.096 ? 0.000 {?} {346.HD1} 7.200 0.073 0.152 ? 0.000 {?} {346.CD1} 132.833 0.347 0.347 EE 0.000 {?} 11.96340 0.33440 0 {?} 0 139 {388.HB2} 2.839 0.080 0.136 ? 0.000 {?} {388.HD1} 7.139 0.073 0.123 ++ 0.000 {?} {388.CD1} 133.054 0.346 0.346 EE 0.000 {?} 36.79350 0.73720 0 {?} 0 140 {317.HD1} 6.837 0.024 0.085 ? 0.000 {?} {317.HE1} 6.922 0.059 0.137 ? 0.000 {?} {317.CE1} 118.717 0.436 0.436 EE 0.000 {?} 65.21580 2.01090 0 {?} 0 141 {271.HA} 4.704 0.046 0.062 ++ 0.000 {?} {271.HD2} 7.191 0.062 0.088 ++ 0.000 {?} {271.CD2} 119.819 0.347 0.347 EE 0.000 {?} 10.50330 0.47500 0 {?} 0 142 {?} 2.934 0.069 0.069 ? 0.000 {?} {?} 7.198 0.077 0.107 ++ 0.000 {?} {?} 132.392 0.322 0.322 EE 0.000 {?} 23.95310 0.57260 0 {?} 0 143 {287.HA} 3.958 0.070 0.085 ++ 0.000 {?} {295.HE1} 7.550 0.112 0.135 ++ 0.000 {?} {295.CE1} 131.731 0.285 0.285 EE 0.000 {?} 17.53280 0.41720 0 {?} 0 144 {299.HG11} 0.673 0.057 0.063 ++ 0.000 {?} {295.HE1} 7.550 0.086 0.091 ++ 0.000 {?} {295.CE1} 131.731 0.239 0.239 EE 0.000 {?} 10.68470 0.34650 0 {?} 0 145 {299.HG21} 0.816 0.064 0.071 ++ 0.000 {?} {295.HE1} 7.554 0.098 0.109 ++ 0.000 {?} {295.CE1} 131.731 0.255 0.255 EE 0.000 {?} 8.81020 0.21860 0 {?} 0 146 {342.HA} 4.550 0.079 0.096 ? 0.000 {?} {342.HE1} 7.100 0.060 0.114 ++ 0.000 {?} {342.CE1} 131.951 0.384 0.384 EE 0.000 {?} 22.02720 0.35660 0 {?} 0 147 {295.HA} 4.314 0.028 0.090 ? 0.000 {?} {295.HD1} 7.187 0.085 0.139 ? 0.000 {?} {295.CD1} 132.172 0.384 0.384 EE 0.000 {?} 41.50910 1.24500 0 {?} 0 148 {276.HB1} 3.876 0.064 0.078 ? 0.000 {?} {388.HD1} 7.138 0.090 0.081 ++ 0.000 {?} {388.CD1} 133.054 0.193 0.193 EE 0.000 {?} 7.11990 0.24240 0 {?} 0 149 {276.HA} 4.589 0.099 0.099 ? 0.000 {?} {388.HD1} 7.139 0.080 0.100 ++ 0.000 {?} {388.CD1} 133.054 0.316 0.316 EE 0.000 {?} 13.02600 0.32060 0 {?} 0 150 {278.HA} 5.031 0.082 0.102 ++ 0.000 {?} {388.HD1} 7.136 0.082 0.125 ++ 0.000 {?} {388.CD1} 133.054 0.309 0.309 EE 0.000 {?} 23.52520 0.62480 0 {?} 0 151 {295.HE1} 7.561 0.055 0.060 ++ 0.000 {?} {287.HD1} 6.075 0.092 0.104 ++ 0.000 {?} {287.CD1} 132.543 0.258 0.258 EE 0.000 {?} 6.01210 0.22210 0 {?} 0 152 {290.HG21} 1.234 0.042 0.051 ++ 0.000 {?} {295.HD1} 7.217 0.122 0.150 ++ 0.000 {?} {295.CD1} 132.392 0.276 0.276 EE 0.000 {?} 17.02270 0.44500 0 {?} 0 153 {286.HB1} 3.184 0.049 0.085 ++ 0.000 {?} {286.HE1} 7.104 0.071 0.103 ? 0.000 {?} {286.CE1} 131.069 0.335 0.335 EE 0.000 {?} 12.13280 0.47100 0 {?} 0 154 {289.HB1} 2.110 0.053 0.054 ++ 0.000 {?} {287.HE1} 6.579 0.080 0.080 ++ 0.000 {?} {287.CE1} 117.834 0.223 0.223 EE 0.000 {?} 5.15560 0.24710 0 {?} 0 155 {298.HB1} 2.300 0.049 0.077 ? 0.000 {?} {286.HD1} 7.180 0.081 0.084 ++ 0.000 {?} {286.CD1} 131.835 0.228 0.228 EE 0.000 {?} 14.31520 0.43310 0 {?} 0 156 {298.HB2} 2.209 0.065 0.071 ? 0.000 {?} {286.HD1} 7.180 0.082 0.089 ++ 0.000 {?} {286.CD1} 131.831 0.247 0.247 EE 0.000 {?} 15.92020 0.42740 0 {?} 0 157 {302.HB2} 1.865 0.063 0.065 ? 0.000 {?} {282.HZ} 7.352 0.085 0.088 ++ 0.000 {?} {282.CZ} 130.027 0.232 0.232 EE 0.000 {?} 9.33760 0.29110 0 {?} 0 158 {?} 1.893 0.061 0.063 ++ 0.000 {?} {?} 7.180 0.055 0.062 ? 0.000 {?} {?} 131.831 0.234 0.234 EE 0.000 {?} 10.49230 0.38470 0 {?} 0 159 {379.HA} 4.531 0.060 0.089 ? 0.000 {?} {317.HD1} 6.835 0.043 0.100 ? 0.000 {?} {317.CD1} 133.205 0.342 0.342 EE 0.000 {?} 6.45470 0.30190 0 {?} 0 160 {322.HG21} -0.504 0.057 0.050 ++ 0.000 {?} {324.HZ2} 7.130 0.100 0.092 ++ 0.000 {?} {324.CZ2} 113.760 0.190 0.190 EE 0.000 {?} 4.19400 0.26210 0 {?} 0 161 {322.HG21} -0.512 0.076 0.078 ++ 0.000 {?} {324.HD1} 7.284 0.087 0.089 ++ 0.000 {?} {324.CD1} 128.010 0.228 0.228 EE 0.000 {?} 7.44940 0.22610 0 {?} 0 162 {322.HB} 1.414 0.061 0.074 ++ 0.000 {?} {324.HD1} 7.300 0.072 0.086 ++ 0.000 {?} {324.CD1} 128.010 0.270 0.270 EE 0.000 {?} 4.90290 0.18540 0 {?} 0 163 {295.HD1} 7.204 0.064 0.102 ++ 0.000 {?} {287.HE1} 6.589 0.061 0.138 ? 0.000 {?} {287.CE1} 117.964 0.372 0.372 EE 0.000 {?} 26.16600 0.56350 0 {?} 0 164 {361.HG21} 0.244 0.051 0.049 ++ 0.000 {?} {342.HZ} 7.197 0.065 0.051 ++ 0.000 {?} {342.CZ} 129.966 0.155 0.155 EE 0.000 {?} 1.18820 0.13270 0 {?} 0 165 {345.HB1} 3.292 0.057 0.068 ++ 0.000 {?} {345.HE1} 6.614 0.077 0.086 ++ 0.000 {?} {345.CE1} 117.614 0.264 0.264 EE 0.000 {?} 7.83730 0.20720 0 {?} 0 166 {349.HB2} 0.674 0.045 0.053 ++ 0.000 {?} {345.HE1} 6.617 0.085 0.097 ++ 0.000 {?} {345.CE1} 117.614 0.261 0.261 EE 0.000 {?} 5.46150 0.22080 0 {?} 0 167 {386.HD11} 0.274 0.041 0.048 ++ 0.000 {?} {346.HD1} 7.225 0.061 0.075 ++ 0.000 {?} {346.CD1} 132.833 0.288 0.289 EE 0.000 {?} 2.81070 0.13950 0 {?} 0 168 {299.HG11} 0.650 0.037 0.087 ? 0.000 {?} {295.HD1} 7.186 0.052 0.106 ? 0.000 {?} {295.CD1} 132.233 0.374 0.374 EE 0.000 {?} 39.86820 1.58220 0 {?} 0 169 {?} 0.752 0.031 0.073 ? 0.000 {?} {?} 7.187 0.052 0.106 ? 0.000 {?} {?} 132.233 0.374 0.374 EE 0.000 {?} 21.15590 0.88500 0 {?} 0 170 {349.HG1} 1.648 0.058 0.062 ++ 0.000 {?} {350.HD1} 6.936 0.074 0.080 ++ 0.000 {?} {350.CD1} 133.365 0.239 0.239 EE 0.000 {?} 4.90090 0.17770 0 {?} 0 171 {302.HG2} 2.077 0.056 0.057 ? 0.000 {?} {286.HE1} 7.100 0.026 0.075 ? 0.000 {?} {286.CE1} 131.069 0.230 0.230 EE 0.000 {?} 1.96760 0.22140 0 {?} 0 172 {290.HB} 3.972 0.069 0.078 ++ 0.000 {?} {286.HE1} 7.105 0.085 0.106 ++ 0.000 {?} {286.CE1} 131.069 0.267 0.267 EE 0.000 {?} 11.23710 0.30070 0 {?} 0 173 {299.HB} 1.742 0.042 0.058 ? 0.000 {?} {286.HE1} 7.103 0.087 0.114 ++ 0.000 {?} {286.CE1} 131.069 0.336 0.336 EE 0.000 {?} 7.39980 0.27420 0 {?} 0 174 {299.HG21} 0.786 0.047 0.068 ? 0.000 {?} {295.HZ} 7.246 0.085 0.090 ++ 0.000 {?} {295.CZ} 129.745 0.239 0.239 EE 0.000 {?} 6.76390 0.21040 0 {?} 0 175 {287.HD1} 6.080 0.050 0.047 ++ 0.000 {?} {295.HD1} 7.207 0.097 0.090 ++ 0.000 {?} {295.CD1} 132.172 0.195 0.195 EE 0.000 {?} 2.79330 0.18990 0 {?} 0 176 {283.HE1} 1.920 0.054 0.067 ++ 0.000 {?} {324.HZ2} 7.130 0.079 0.104 ++ 0.000 {?} {324.CZ2} 113.764 0.287 0.287 EE 0.000 {?} 8.66430 0.27890 0 {?} 0 177 {299.HB} 1.751 0.065 0.101 ++ 0.000 {?} {324.HZ2} 7.133 0.060 0.096 ? 0.000 {?} {324.CZ2} 113.764 0.304 0.304 EE 0.000 {?} 12.08170 0.44930 0 {?} 0 178 {299.HG11} 0.705 0.051 0.048 ++ 0.000 {?} {324.HZ2} 7.131 0.149 0.137 ++ 0.000 {?} {324.CZ2} 113.764 0.206 0.206 EE 0.000 {?} 16.34760 0.78340 0 {?} 0 179 {299.HG11} 0.682 0.019 0.068 ? 0.000 {?} {324.HH2} 6.774 0.063 0.148 ? 0.000 {?} {324.CH2} 123.500 0.380 0.380 EE 0.000 {?} 4.11560 0.34700 0 {?} 0 180 {291.HB2} 1.789 0.064 0.073 ++ 0.000 {?} {293.HE1} 8.191 0.065 0.073 ++ 0.000 {?} {293.CE1} 137.770 0.251 0.251 EE 0.000 {?} 4.61850 0.20000 0 {?} 0 181 {291.HB1} 2.158 0.068 0.081 ++ 0.000 {?} {293.HE1} 8.191 0.049 0.063 ++ 0.000 {?} {293.CE1} 137.770 0.294 0.294 EE 0.000 {?} 5.04310 0.23200 0 {?} 0 182 {291.HG1} 2.325 0.068 0.065 ++ 0.000 {?} {293.HE1} 8.188 0.064 0.060 ++ 0.000 {?} {293.CE1} 137.770 0.206 0.206 EE 0.000 {?} 3.70840 0.29020 0 {?} 0 183 {311.HG1} 1.237 0.035 0.090 ? 0.000 {?} {388.HE1} 6.835 0.036 0.093 ? 0.000 {?} {388.CE1} 118.275 0.413 0.413 EE 0.000 {?} 16.23520 0.86250 0 {?} 0 184 {276.HA} 4.592 0.049 0.075 ++ 0.000 {?} {388.HE1} 6.832 0.047 0.074 ? 0.000 {?} {388.CE1} 118.275 0.372 0.372 EE 0.000 {?} 10.61000 0.41750 0 {?} 0 185 {278.HA} 5.051 0.058 0.083 ++ 0.000 {?} {388.HE1} 6.825 0.024 0.090 ? 0.000 {?} {388.CE1} 118.275 0.363 0.363 EE 0.000 {?} 4.75090 0.28860 0 {?} 0 186 {309.HG} 1.345 0.043 0.065 ? 0.000 {?} {388.HD1} 7.149 0.079 0.087 ++ 0.000 {?} {388.CD1} 133.054 0.266 0.266 EE 0.000 {?} 8.42560 0.35550 0 {?} 0 187 {324.HH2} 6.761 0.050 0.057 ++ 0.000 {?} {295.HZ} 7.255 0.096 0.107 ++ 0.000 {?} {295.CZ} 129.846 0.259 0.259 EE 0.000 {?} 4.53120 0.16780 0 {?} 0 188 {294.HG1} 1.159 0.060 0.064 ++ 0.000 {?} {293.HD2} 7.184 0.076 0.085 ++ 0.000 {?} {293.CD2} 119.284 0.254 0.254 EE 0.000 {?} 5.76170 0.28890 0 {?} 0 189 {302.HB2} 1.874 0.090 0.098 ++ 0.000 {?} {282.HE1} 7.193 0.089 0.094 ++ 0.000 {?} {282.CE1} 131.349 0.240 0.240 EE 0.000 {?} 16.89590 0.35790 0 {?} 0 190 {282.HA} 4.315 0.038 0.098 ? 0.000 {?} {282.HE1} 7.189 0.113 0.113 ? 0.000 {?} {282.CE1} 131.349 0.312 0.312 EE 0.000 {?} 17.20430 0.66150 0 {?} 0 191 {381.HB1} 1.936 0.053 0.055 ++ 0.000 {?} {342.HZ} 7.206 0.096 0.100 ? 0.000 {?} {342.CZ} 130.025 0.230 0.230 EE 0.000 {?} 10.63140 0.27660 0 {?} 0 192 {287.HB1} 2.847 0.047 0.043 ++ 0.000 {?} {295.HE1} 7.547 0.065 0.065 ++ 0.000 {?} {295.CE1} 131.731 0.156 0.156 EE 0.000 {?} 3.18910 0.18210 0 {?} 0 193 {287.HB2} 2.717 0.052 0.047 ++ 0.000 {?} {295.HE1} 7.545 0.084 0.077 ++ 0.000 {?} {295.CE1} 131.731 0.196 0.196 EE 0.000 {?} 2.59490 0.18500 0 {?} 0 194 {322.HD11} 0.747 0.076 0.076 ++ 0.000 {?} {324.HH2} 6.772 0.133 0.135 ++ 0.000 {?} {324.CH2} 123.500 0.225 0.225 EE 0.000 {?} 17.32660 0.30040 0 {?} 0 195 {?} 0.760 0.020 0.072 ? 0.000 {?} {?} 7.190 0.060 0.129 ? 0.000 {?} {?} 131.349 0.405 0.405 EE 0.000 {?} 10.56870 0.68280 0 {?} 0 196 {389.HD11} 0.646 0.026 0.093 ? 0.000 {?} {282.HE1} 7.186 0.053 0.146 ? 0.000 {?} {282.CE1} 131.349 0.404 0.404 EE 0.000 {?} 26.13420 1.23190 0 {?} 0 197 {302.HB1} 2.202 0.078 0.078 ++ 0.000 {?} {282.HE1} 7.191 0.103 0.103 ? 0.000 {?} {282.CE1} 131.349 0.153 0.153 EE 0.000 {?} 20.09400 0.40980 0 {?} 0 198 {282.HB1} 3.470 0.069 0.072 ++ 0.000 {?} {282.HE1} 7.187 0.066 0.082 ? 0.000 {?} {282.CE1} 131.349 0.235 0.235 EE 0.000 {?} 12.13020 0.42400 0 {?} 0 199 {282.HB2} 3.304 0.022 0.070 ? 0.000 {?} {282.HE1} 7.190 0.039 0.089 ? 0.000 {?} {282.CE1} 131.349 0.410 0.410 EE 0.000 {?} 10.47850 0.73330 0 {?} 0 200 {?} 3.179 0.022 0.080 ? 0.000 {?} {?} 7.189 0.085 0.106 ++ 0.000 {?} {?} 131.349 0.327 0.327 EE 0.000 {?} 9.75910 0.60190 0 {?} 0 201 {312.HB1} 3.122 0.067 0.074 ++ 0.000 {?} {350.HD1} 6.930 0.080 0.080 ? 0.000 {?} {350.CD1} 133.275 0.255 0.255 EE 0.000 {?} 5.54290 0.14700 0 {?} 0 202 {312.HA} 4.587 0.041 0.072 ++ 0.000 {?} {312.HE1} 6.722 0.076 0.122 ? 0.000 {?} {312.CE1} 118.737 0.380 0.380 EE 0.000 {?} 10.49260 0.26310 0 {?} 0 203 {312.HB1} 3.141 0.054 0.068 ++ 0.000 {?} {312.HE1} 6.717 0.065 0.093 ? 0.000 {?} {312.CE1} 118.717 0.314 0.314 EE 0.000 {?} 5.09140 0.19050 0 {?} 0 204 {313.HB2} 2.828 0.072 0.087 ? 0.000 {?} {312.HE1} 6.720 0.043 0.069 ? 0.000 {?} {312.CE1} 118.717 0.242 0.242 EE 0.000 {?} 4.20660 0.18520 0 {?} 0 205 {386.HD21} 0.815 0.070 0.091 ++ 0.000 {?} {312.HE1} 6.722 0.061 0.092 ? 0.000 {?} {312.CE1} 118.717 0.308 0.308 EE 0.000 {?} 7.02620 0.20580 0 {?} 0 206 {312.HD1} 6.611 0.033 0.091 ? 0.000 {?} {312.HE1} 6.723 0.084 0.107 ++ 0.000 {?} {312.CE1} 118.717 0.334 0.334 EE 0.000 {?} 24.70470 0.90110 0 {?} 0 207 {313.HB2} 2.900 0.044 0.064 ++ 0.000 {?} {350.HD1} 6.921 0.044 0.083 ++ 0.000 {?} {350.CD1} 133.275 0.351 0.351 EE 0.000 {?} 4.10690 0.20090 0 {?} 0 208 {383.HB} 1.696 0.049 0.066 ++ 0.000 {?} {346.HD1} 7.208 0.040 0.094 ? 0.000 {?} {346.CD1} 132.833 0.308 0.308 EE 0.000 {?} 5.10990 0.21930 0 {?} 0 209 {383.HG11} 1.225 0.037 0.048 ++ 0.000 {?} {346.HD1} 7.213 0.054 0.078 ++ 0.000 {?} {346.CD1} 132.833 0.349 0.349 EE 0.000 {?} 8.75740 0.33040 0 {?} 0 210 {350.HE1} 6.800 0.028 0.066 ? 0.000 {?} {345.HE1} 6.607 0.102 0.131 ? 0.000 {?} {345.CE1} 117.614 0.401 0.401 EE 0.000 {?} 38.83410 0.97280 0 {?} 0 211 {350.HD1} 6.892 0.061 0.078 ? 0.000 {?} {345.HE1} 6.608 0.098 0.125 ++ 0.000 {?} {345.CE1} 117.704 0.315 0.315 EE 0.000 {?} 24.39120 0.50230 0 {?} 0 212 {?} 0.763 0.053 0.074 ? 0.000 {?} {?} 7.203 0.050 0.076 ++ 0.000 {?} {?} 129.966 0.300 0.300 EE 0.000 {?} 4.02980 0.19360 0 {?} 0 213 {295.HE1} 7.540 0.067 0.073 ++ 0.000 {?} {324.HZ2} 7.138 0.075 0.084 ++ 0.000 {?} {324.CZ2} 113.704 0.246 0.246 EE 0.000 {?} 6.08750 0.21370 0 {?} 0 214 {300.HA} 4.175 0.060 0.077 ++ 0.000 {?} {324.HZ2} 7.133 0.089 0.118 ++ 0.000 {?} {324.CZ2} 113.704 0.289 0.289 EE 0.000 {?} 8.80470 0.27420 0 {?} 0 215 {299.HA} 3.233 0.023 0.070 ? 0.000 {?} {324.HZ2} 7.130 0.054 0.068 ++ 0.000 {?} {324.CZ2} 113.704 0.284 0.284 EE 0.000 {?} 2.29140 0.26460 0 {?} 0 216 {284.HA} 4.355 0.047 0.063 ++ 0.000 {?} {287.HE1} 6.579 0.050 0.075 ++ 0.000 {?} {287.CE1} 117.895 0.316 0.316 EE 0.000 {?} 5.29440 0.33350 0 {?} 0 217 {287.HB1} 2.826 0.062 0.095 ? 0.000 {?} {287.HE1} 6.581 0.059 0.091 ++ 0.000 {?} {287.CE1} 117.895 0.331 0.331 EE 0.000 {?} 11.11770 0.37980 0 {?} 0 218 {287.HB2} 2.717 0.078 0.096 ++ 0.000 {?} {287.HE1} 6.580 0.063 0.085 ++ 0.000 {?} {287.CE1} 117.895 0.278 0.278 EE 0.000 {?} 7.79220 0.25550 0 {?} 0 219 {295.HB2} 2.985 0.092 0.100 ? 0.000 {?} {287.HE1} 6.582 0.059 0.066 ++ 0.000 {?} {287.CE1} 117.895 0.249 0.249 EE 0.000 {?} 7.41900 0.21660 0 {?} 0 220 {295.HB1} 3.316 0.068 0.080 ? 0.000 {?} {287.HE1} 6.592 0.076 0.095 ++ 0.000 {?} {287.CE1} 117.895 0.279 0.279 EE 0.000 {?} 8.81450 0.25670 0 {?} 0 221 {277.HG1} 2.474 0.057 0.062 ++ 0.000 {?} {388.HE1} 6.825 0.067 0.080 ++ 0.000 {?} {388.CE1} 118.336 0.248 0.248 EE 0.000 {?} 5.29600 0.21620 0 {?} 0 222 {315.HG1} 1.364 0.051 0.067 ? 0.000 {?} {317.HE1} 6.928 0.045 0.082 ? 0.000 {?} {317.CE1} 118.556 0.279 0.279 EE 0.000 {?} 4.48690 0.25620 0 {?} 0 223 {324.HB2} 3.030 0.050 0.045 ++ 0.000 {?} {324.HE3} 7.950 0.095 0.088 ++ 0.000 {?} {324.CE3} 121.644 0.194 0.194 EE 0.000 {?} 2.90110 0.16850 0 {?} 0 224 {324.HE3} 7.938 0.059 0.069 ++ 0.000 {?} {324.HH2} 6.773 0.092 0.111 ++ 0.000 {?} {324.CH2} 123.500 0.279 0.279 EE 0.000 {?} 7.42950 0.27950 0 {?} 0 225 {299.HB} 1.744 0.044 0.069 ? 0.000 {?} {324.HH2} 6.769 0.076 0.097 ++ 0.000 {?} {324.CH2} 123.408 0.293 0.293 EE 0.000 {?} 5.79800 0.28210 0 {?} 0 226 {296.HA} 3.021 0.051 0.056 ++ 0.000 {?} {324.HH2} 6.775 0.072 0.081 ++ 0.000 {?} {324.CH2} 123.408 0.250 0.250 EE 0.000 {?} 4.89930 0.21800 0 {?} 0 227 {342.HA} 4.555 0.110 0.135 ++ 0.000 {?} {342.HZ} 7.205 0.066 0.089 ++ 0.000 {?} {342.CZ} 130.025 0.279 0.279 EE 0.000 {?} 11.25210 0.25650 0 {?} 0 228 {342.HD1} 7.433 0.053 0.088 ? 0.000 {?} {342.HZ} 7.211 0.056 0.134 ? 0.000 {?} {342.CZ} 130.025 0.368 0.368 EE 0.000 {?} 20.48090 0.56690 0 {?} 0 229 {299.HA} 3.214 0.054 0.068 ++ 0.000 {?} {286.HZ} 7.200 0.076 0.091 ++ 0.000 {?} {286.CZ} 130.025 0.281 0.281 EE 0.000 {?} 7.81300 0.25970 0 {?} 0 230 {298.HG1} 2.626 0.065 0.092 ? 0.000 {?} {286.HZ} 7.208 0.081 0.107 ? 0.000 {?} {286.CZ} 130.025 0.294 0.294 EE 0.000 {?} 10.58840 0.28420 0 {?} 0 231 {298.HG2} 2.449 0.060 0.100 ? 0.000 {?} {286.HZ} 7.201 0.061 0.086 ++ 0.000 {?} {286.CZ} 130.025 0.325 0.325 EE 0.000 {?} 11.64640 0.34240 0 {?} 0 232 {286.HA} 4.184 0.042 0.076 ? 0.000 {?} {286.HZ} 7.203 0.087 0.088 ++ 0.000 {?} {286.CZ} 129.804 0.226 0.226 EE 0.000 {?} 5.42890 0.19340 0 {?} 0 233 {381.HB2} 1.419 0.040 0.067 ? 0.000 {?} {342.HZ} 7.204 0.061 0.065 ++ 0.000 {?} {342.CZ} 130.025 0.238 0.238 EE 0.000 {?} 3.66250 0.20480 0 {?} 0 234 {?} 3.246 0.045 0.083 ? 0.000 {?} {?} 7.267 0.060 0.090 ++ 0.000 {?} {?} 129.804 0.344 0.344 EE 0.000 {?} 9.81890 0.42810 0 {?} 0 235 {302.HG1} 2.294 0.044 0.065 ? 0.000 {?} {282.HZ} 7.357 0.055 0.106 ? 0.000 {?} {282.CZ} 130.025 0.284 0.284 EE 0.000 {?} 5.68680 0.26560 0 {?} 0 236 {302.HG2} 2.075 0.061 0.066 ++ 0.000 {?} {282.HZ} 7.356 0.099 0.108 ? 0.000 {?} {282.CZ} 130.025 0.237 0.237 EE 0.000 {?} 8.41860 0.20410 0 {?} 0 237 {?} 0.869 0.058 0.075 ? 0.000 {?} {?} 7.346 0.087 0.087 ? 0.000 {?} {?} 130.025 0.193 0.193 EE 0.000 {?} 5.47700 0.16800 0 {?} 0 238 {?} 0.772 0.099 0.108 ? 0.000 {?} {?} 7.333 0.122 0.130 ? 0.000 {?} {?} 130.025 0.236 0.236 EE 0.000 {?} 14.15620 0.20320 0 {?} 0 239 {282.HZ} 7.318 0.025 0.108 ? 0.000 {?} {282.HE1} 7.186 0.036 0.120 ? 0.000 {?} {282.CE1} 131.348 0.434 0.434 EE 0.000 {?} 93.80680 6.31760 0 {?} 0 240 {?} 2.456 0.050 0.082 ++ 0.000 {?} {?} 7.192 0.052 0.092 ? 0.000 {?} {?} 131.348 0.323 0.323 EE 0.000 {?} 7.56910 0.35240 0 {?} 0 241 {?} 1.735 0.047 0.084 ? 0.000 {?} {?} 7.191 0.048 0.099 ? 0.000 {?} {?} 131.348 0.353 0.353 EE 0.000 {?} 11.23950 0.47330 0 {?} 0 242 {286.HD1} 7.181 0.025 0.067 ? 0.000 {?} {286.HE1} 7.108 0.040 0.108 ? 0.000 {?} {286.CE1} 131.127 0.439 0.439 EE 0.000 {?} 195.53040 9.80940 0 {?} 0 243 {299.HG11} 0.672 0.045 0.076 ? 0.000 {?} {286.HE1} 7.103 0.021 0.075 ? 0.000 {?} {286.CE1} 131.127 0.400 0.400 EE 0.000 {?} 6.40220 0.43050 0 {?} 0 244 {280.HG} 1.557 0.064 0.084 ++ 0.000 {?} {284.HD1} 7.311 0.058 0.083 ++ 0.000 {?} {284.CD1} 131.480 0.315 0.315 EE 0.000 {?} 7.77950 0.33890 0 {?} 0 245 {280.HB1} 1.912 0.049 0.052 ++ 0.000 {?} {284.HD1} 7.309 0.071 0.077 ++ 0.000 {?} {284.CD1} 131.480 0.240 0.240 EE 0.000 {?} 4.47500 0.19660 0 {?} 0 246 {?} 7.315 0.027 0.074 ? 0.000 {?} {?} 7.438 0.037 0.135 ? 0.000 {?} {?} 131.568 0.433 0.433 EE 0.000 {?} 77.24490 5.15990 0 {?} 0 247 {324.HH2} 6.773 0.031 0.057 ? 0.000 {?} {295.HE1} 7.552 0.080 0.096 ? 0.000 {?} {295.CE1} 131.789 0.260 0.260 EE 0.000 {?} 3.75610 0.22960 0 {?} 0 248 {?} 0.742 0.046 0.060 ? 0.000 {?} {?} 7.559 0.081 0.100 ? 0.000 {?} {?} 131.789 0.237 0.237 EE 0.000 {?} 5.41360 0.20400 0 {?} 0 249 {285.HB2} 2.649 0.027 0.070 ? 0.000 {?} {282.HD1} 7.173 0.072 0.092 ++ 0.000 {?} {282.CD1} 132.009 0.280 0.280 EE 0.000 {?} 4.70570 0.25070 0 {?} 0 250 {285.HB1} 2.788 0.045 0.071 ? 0.000 {?} {282.HD1} 7.175 0.069 0.095 ++ 0.000 {?} {282.CD1} 132.009 0.300 0.300 EE 0.000 {?} 7.92110 0.29300 0 {?} 0 251 {286.HE1} 7.099 0.012 0.070 ? 0.000 {?} {286.HD1} 7.160 0.033 0.106 ? 0.000 {?} {286.CD1} 131.789 0.435 0.435 EE 0.000 {?} 31.81100 6.74840 0 {?} 0 252 {279.HA} 3.593 0.046 0.092 ? 0.000 {?} {282.HD1} 7.193 0.070 0.103 ++ 0.000 {?} {282.CD1} 132.009 0.348 0.348 EE 0.000 {?} 14.02490 0.44550 0 {?} 0 253 {388.HA} 4.795 0.067 0.075 ? 0.000 {?} {388.HD1} 7.138 0.063 0.106 ++ 0.000 {?} {388.CD1} 133.112 0.370 0.370 EE 0.000 {?} 28.59130 0.58340 0 {?} 0 254 {287.HB1} 2.836 0.073 0.083 ++ 0.000 {?} {284.HD1} 7.317 0.090 0.104 ++ 0.000 {?} {284.CD1} 131.568 0.256 0.256 EE 0.000 {?} 8.99120 0.22470 0 {?} 0 255 {286.HB1} 3.193 0.055 0.078 ++ 0.000 {?} {295.HE1} 7.550 0.043 0.081 ? 0.000 {?} {295.CE1} 131.789 0.328 0.328 EE 0.000 {?} 7.50520 0.36830 0 {?} 0 256 {295.HE1} 7.549 0.054 0.099 ? 0.000 {?} {286.HE1} 7.103 0.064 0.106 ? 0.000 {?} {286.CE1} 131.127 0.337 0.337 EE 0.000 {?} 8.64780 0.22880 0 {?} 0 257 {?} 1.936 0.035 0.044 ++ 0.000 {?} {?} 6.824 0.065 0.087 ? 0.000 {?} {?} 118.336 0.279 0.279 EE 0.000 {?} 3.94990 0.25680 0 {?} 0 258 {311.HE2} 2.186 0.053 0.075 ? 0.000 {?} {388.HD1} 7.133 0.061 0.067 ++ 0.000 {?} {388.CD1} 133.112 0.252 0.252 EE 0.000 {?} 4.98980 0.22060 0 {?} 0 ; save_ save_peak_list_3 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_3 _Spectral_peak_list.Entry_ID 17273 _Spectral_peak_list.ID 3 _Spectral_peak_list.Sample_ID . _Spectral_peak_list.Sample_label . _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID . _Spectral_peak_list.Experiment_name . _Spectral_peak_list.Number_of_spectral_dimensions . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; label dataset sw sf H1 H2 C cnoe800.nv {8012.31 } {5311.13 } {13513.50 } {800.2338 } {800.2338 } {201.2254 } H1.L H1.P H1.W H1.B H1.E H1.J H1.U H2.L H2.P H2.W H2.B H2.E H2.J H2.U C.L C.P C.W C.B C.E C.J C.U vol int stat comment flag0 0 {278.HG21} 0.96000 0.08800 0.11100 ++ 0.00000 {?} {278.HB} 4.67000 0.12700 0.16800 ++ 0.00000 {?} {278.CB} 72.58100 0.78700 0.78700 ? 0.00000 {?} 25.64280 0.20170 0 {?} 0 1 {339.HG2} 1.92000 0.03700 0.05200 ++ 0.00000 {?} {331.HB} 3.80500 0.04600 0.10700 ? 0.00000 {?} {331.CB} 71.76800 0.78700 0.78700 ? 0.00000 {?} 2.32040 0.07390 0 {?} 0 2 {339.HB1} 1.75300 0.09400 0.09400 ++ 0.00000 {?} {331.HB} 3.82200 0.18000 0.18000 ++ 0.00000 {?} {331.CB} 71.79800 0.14200 0.14200 ++ 0.00000 {?} 8.21760 0.14590 0 {?} 0 3 {331.HG21} 0.96900 0.04200 0.06400 ++ 0.00000 {?} {331.HB} 3.82600 0.10200 0.15700 ++ 0.00000 {?} {331.CB} 71.78700 0.78700 0.78700 ? 0.00000 {?} 23.37090 0.36260 0 {?} 0 4 {316.HG21} 1.03800 0.04500 0.07000 ++ 0.00000 {?} {316.HB} 3.89400 0.09200 0.16800 ++ 0.00000 {?} {316.CB} 71.71900 0.78700 0.78700 ? 0.00000 {?} 46.49520 0.76250 0 {?} 0 5 {307.HG21} 0.80300 0.05400 0.08200 ++ 0.00000 {?} {316.HB} 3.89000 0.08900 0.15400 ++ 0.00000 {?} {316.CB} 71.71400 0.78700 0.78700 ? 0.00000 {?} 43.50180 0.60710 0 {?} 0 6 {392.HD21} 0.91700 0.07800 0.07800 ? 0.00000 {?} {390.HB} 4.26100 0.15100 0.15100 ? 0.00000 {?} {390.CB} 71.26900 0.03000 0.03000 ? 0.00000 {?} 7.42410 0.23440 0 {?} 0 7 {376.HA} 4.70200 0.06400 0.06400 ++ 0.00000 {?} {375.HB} 4.22400 0.09700 0.09700 ++ 0.00000 {?} {375.CB} 70.69600 0.09200 0.09200 ++ 0.00000 {?} 6.75250 0.17950 0 {?} 0 8 {393.HA} 4.61000 0.05300 0.08900 ++ 0.00000 {?} {393.HB} 4.23300 0.08600 0.16800 ++ 0.00000 {?} {393.CB} 70.72000 0.78700 0.78700 ? 0.00000 {?} 93.86900 1.33570 0 {?} 0 9 {393.HG21} 1.21800 0.05900 0.11100 ++ 0.00000 {?} {393.HB} 4.22100 0.11000 0.23600 ? 0.00000 {?} {393.CB} 70.61000 0.78700 0.78700 ? 0.00000 {?} 218.80020 2.33140 0 {?} 0 10 {306.HD21} 0.80600 0.07600 0.07600 ++ 0.00000 {?} {393.HB} 4.22100 0.16400 0.16400 ++ 0.00000 {?} {393.CB} 70.61000 0.29300 0.29300 ? 0.00000 {?} 10.34580 0.27810 0 {?} 0 11 {355.HA} 4.47500 0.05300 0.12700 ? 0.00000 {?} {355.HB} 4.17600 0.08800 0.14700 ++ 0.00000 {?} {355.CB} 70.26700 0.78700 0.78700 ? 0.00000 {?} 80.78730 1.24540 0 {?} 0 12 {290.HA} 4.47900 0.06000 0.08300 ++ 0.00000 {?} {290.HB} 3.97900 0.10900 0.15500 ++ 0.00000 {?} {290.CB} 70.16000 0.78700 0.78700 ? 0.00000 {?} 55.78860 0.78070 0 {?} 0 13 {375.HA} 4.36700 0.04900 0.09300 ? 0.00000 {?} {375.HB} 4.18600 0.07100 0.14000 ++ 0.00000 {?} {375.CB} 70.23300 0.78700 0.78700 ? 0.00000 {?} 106.13880 2.24630 0 {?} 0 14 {375.HG21} 1.22700 0.04800 0.08300 ++ 0.00000 {?} {375.HB} 4.19300 0.10000 0.23600 ? 0.00000 {?} {375.CB} 70.23800 0.78700 0.78700 ? 0.00000 {?} 182.21880 2.54300 0 {?} 0 15 {290.HG21} 1.22700 0.07700 0.11400 ++ 0.00000 {?} {290.HB} 3.98300 0.11900 0.17400 ? 0.00000 {?} {290.CB} 70.18400 0.78700 0.78700 ? 0.00000 {?} 64.24070 0.55110 0 {?} 0 16 {267.HA} 4.41600 0.03500 0.06600 ++ 0.00000 {?} {267.HB} 4.23900 0.07700 0.16200 ++ 0.00000 {?} {267.CB} 69.73200 0.78700 0.78700 ? 0.00000 {?} 131.86720 3.70580 0 {?} 0 17 {310.HG21} 1.25700 0.05400 0.06000 ++ 0.00000 {?} {310.HB} 3.39500 0.13800 0.15700 ++ 0.00000 {?} {310.CB} 68.80500 0.78700 0.78700 ? 0.00000 {?} 25.82830 0.30830 0 {?} 0 18 {279.HB} 2.21000 0.10900 0.10900 ++ 0.00000 {?} {384.HA} 3.80400 0.15600 0.15600 ++ 0.00000 {?} {384.CA} 67.64200 0.13600 0.13600 ++ 0.00000 {?} 12.31270 0.27570 0 {?} 0 19 {362.HD11} 0.70000 0.08300 0.08300 ? 0.00000 {?} {384.HA} 3.80300 0.11400 0.11400 ? 0.00000 {?} {384.CA} 67.65900 0.03400 0.03400 ++ 0.00000 {?} 8.88280 0.25010 0 {?} 0 20 {279.HG21} 0.98100 0.09800 0.08400 ++ 0.00000 {?} {279.HA} 3.60100 0.16400 0.16400 ++ 0.00000 {?} {279.CA} 66.04400 0.78700 0.78700 ? 0.00000 {?} 35.11240 0.39210 0 {?} 0 21 {279.HG11} 0.80000 0.08400 0.08200 ++ 0.00000 {?} {279.HA} 3.60500 0.17900 0.17600 ++ 0.00000 {?} {279.CA} 66.05400 0.78700 0.78700 ? 0.00000 {?} 38.21910 0.48120 0 {?} 0 22 {389.HD11} 0.64100 0.10300 0.10300 ++ 0.00000 {?} {279.HA} 3.60900 0.13300 0.13300 ++ 0.00000 {?} {279.CA} 66.05400 0.21100 0.21100 ++ 0.00000 {?} 13.48250 0.31730 0 {?} 0 23 {341.HB1} 4.39300 0.10700 0.10700 ++ 0.00000 {?} {341.HB2} 3.94000 0.18000 0.18000 ++ 0.00000 {?} {341.CB} 65.38800 0.21200 0.78700 ? 0.00000 {?} 8.18220 0.12480 0 {?} 0 24 {364.HB1} 3.67100 0.08000 0.08000 ++ 0.00000 {?} {364.HB2} 3.43400 0.15900 0.15900 ++ 0.00000 {?} {364.CB} 65.44900 0.46900 0.78700 ? 0.00000 {?} 25.42260 0.31590 0 {?} 0 25 {364.HB2} 3.45000 0.09700 0.09700 ++ 0.00000 {?} {364.HB1} 3.65000 0.15600 0.15600 ++ 0.00000 {?} {364.CB} 65.47400 0.50900 0.78700 ? 0.00000 {?} 21.13000 0.24700 0 {?} 0 26 {302.HB1} 2.21300 0.06000 0.08100 ++ 0.00000 {?} {299.HA} 3.19300 0.07100 0.13500 ++ 0.00000 {?} {299.CA} 65.40200 0.78700 0.78700 ? 0.00000 {?} 7.60470 0.12360 0 {?} 0 27 {299.HB} 1.74400 0.09700 0.09700 ++ 0.00000 {?} {299.HA} 3.18400 0.23100 0.16400 ++ 0.00000 {?} {299.CA} 65.40000 0.45300 0.78700 ? 0.00000 {?} 17.97990 0.28350 0 {?} 0 28 {299.HG21} 0.82600 0.08300 0.08300 ++ 0.00000 {?} {299.HA} 3.20100 0.15900 0.15900 ++ 0.00000 {?} {299.CA} 65.40000 0.15000 0.78700 ? 0.00000 {?} 7.71560 0.21350 0 {?} 0 29 {299.HG11} 0.67800 0.07200 0.08400 ++ 0.00000 {?} {299.HA} 3.19000 0.15900 0.19000 ++ 0.00000 {?} {299.CA} 65.40000 0.78700 0.78700 ? 0.00000 {?} 48.78440 0.48100 0 {?} 0 30 {304.HG21} 0.95400 0.09100 0.09800 ++ 0.00000 {?} {304.HA} 3.56300 0.17300 0.19000 ++ 0.00000 {?} {304.CA} 64.62800 0.78700 0.78700 ? 0.00000 {?} 64.96300 0.48320 0 {?} 0 31 {304.HG11} 1.76400 0.06600 0.10500 ++ 0.00000 {?} {304.HA} 3.56700 0.07300 0.15100 ? 0.00000 {?} {304.CA} 64.62400 0.78700 0.78700 ? 0.00000 {?} 12.97390 0.19280 0 {?} 0 32 {319.HB} 2.48300 0.09200 0.09200 ++ 0.00000 {?} {319.HA} 3.64400 0.13200 0.13200 ++ 0.00000 {?} {319.CA} 64.20000 0.21400 0.21400 ? 0.00000 {?} 8.73780 0.19260 0 {?} 0 33 {319.HG11} 0.82100 0.05800 0.08800 ? 0.00000 {?} {319.HA} 3.64200 0.11400 0.16400 ++ 0.00000 {?} {319.CA} 64.22000 0.78700 0.78700 ? 0.00000 {?} 45.60400 0.49680 0 {?} 0 34 {319.HG21} 0.74400 0.06500 0.08900 ? 0.00000 {?} {319.HA} 3.63900 0.08500 0.17400 ? 0.00000 {?} {319.CA} 64.20000 0.78700 0.78700 ? 0.00000 {?} 47.13840 0.57610 0 {?} 0 35 {276.HA} 4.60500 0.05900 0.10200 ++ 0.00000 {?} {276.HB1} 3.87700 0.10000 0.18100 ? 0.00000 {?} {276.CB} 63.89200 0.78700 0.78700 ? 0.00000 {?} 76.49190 1.12870 0 {?} 0 36 {270.HA} 4.39500 0.04700 0.08600 ++ 0.00000 {?} {270.HB1} 3.86800 0.09300 0.21700 ++ 0.00000 {?} {270.CB} 63.89000 0.78700 0.78700 ? 0.00000 {?} 108.64530 1.78180 0 {?} 0 37 {372.HD1} 3.67400 0.08200 0.08200 ++ 0.00000 {?} {372.HA} 4.47100 0.15300 0.15300 ++ 0.00000 {?} {372.CA} 63.65800 0.32900 0.32900 ++ 0.00000 {?} 9.39380 0.23610 0 {?} 0 38 {372.HB1} 2.33700 0.04600 0.08000 ++ 0.00000 {?} {372.HA} 4.47300 0.09400 0.17100 ? 0.00000 {?} {372.CA} 63.65600 0.78700 0.78700 ? 0.00000 {?} 73.71980 1.28630 0 {?} 0 39 {372.HB2} 2.00400 0.05400 0.07000 ? 0.00000 {?} {372.HA} 4.47400 0.12900 0.16900 ++ 0.00000 {?} {372.CA} 63.66700 0.78700 0.78700 ? 0.00000 {?} 52.60150 0.64380 0 {?} 0 40 {269.HG21} 0.93700 0.09600 0.09600 ++ 0.00000 {?} {270.HB1} 3.86900 0.13900 0.13900 ++ 0.00000 {?} {270.CB} 63.70000 0.38000 0.38000 ? 0.00000 {?} 8.69210 0.21960 0 {?} 0 41 {365.HA} 4.73000 0.03000 0.09200 ? 0.00000 {?} {379.HA} 4.54300 0.16300 0.13800 ++ 0.00000 {?} {379.CA} 62.86300 0.78700 0.78700 ? 0.00000 {?} 13.91400 0.29630 0 {?} 0 42 {355.HB} 4.17700 0.05600 0.09100 ++ 0.00000 {?} {355.HA} 4.47700 0.09500 0.20800 ++ 0.00000 {?} {355.CA} 62.97000 0.78700 0.78700 ? 0.00000 {?} 59.20420 0.93020 0 {?} 0 43 {366.HD1} 3.86500 0.04300 0.05500 ? 0.00000 {?} {379.HA} 4.55000 0.09200 0.09200 ++ 0.00000 {?} {379.CA} 62.90800 0.40000 0.40000 ? 0.00000 {?} 5.42530 0.18780 0 {?} 0 44 {366.HD2} 3.80300 0.06500 0.06500 ? 0.00000 {?} {379.HA} 4.55400 0.15000 0.10600 ++ 0.00000 {?} {379.CA} 62.89200 0.78700 0.78700 ? 0.00000 {?} 12.06750 0.16300 0 {?} 0 45 {377.HD2} 3.66600 0.07600 0.07600 ++ 0.00000 {?} {377.HA} 4.56700 0.15000 0.15000 ++ 0.00000 {?} {377.CA} 62.90800 0.14000 0.14000 ++ 0.00000 {?} 6.23290 0.16130 0 {?} 0 46 {377.HB1} 2.34400 0.08800 0.13600 ++ 0.00000 {?} {377.HA} 4.55200 0.11000 0.21300 ++ 0.00000 {?} {377.CA} 62.86700 0.78700 0.78700 ? 0.00000 {?} 89.43040 0.76060 0 {?} 0 47 {377.HB2} 2.04300 0.04200 0.12600 ? 0.00000 {?} {377.HA} 4.55700 0.09200 0.21900 ? 0.00000 {?} {377.CA} 62.86900 0.78700 0.78700 ? 0.00000 {?} 52.22060 0.97770 0 {?} 0 48 {379.HB1} 1.94300 0.09600 0.09900 ? 0.00000 {?} {379.HA} 4.54900 0.14100 0.17100 ++ 0.00000 {?} {379.CA} 62.95600 0.78700 0.78700 ? 0.00000 {?} 51.10280 0.37840 0 {?} 0 49 {379.HB2} 1.77900 0.09100 0.09100 ++ 0.00000 {?} {379.HA} 4.55400 0.16800 0.16800 ++ 0.00000 {?} {379.CA} 62.86400 0.33900 0.33900 ++ 0.00000 {?} 10.74040 0.23730 0 {?} 0 50 {355.HG21} 1.20000 0.05100 0.08700 ++ 0.00000 {?} {355.HA} 4.47500 0.10900 0.19500 ++ 0.00000 {?} {355.CA} 62.96400 0.78700 0.78700 ? 0.00000 {?} 53.24020 0.80200 0 {?} 0 51 {303.HD11} 0.73000 0.06700 0.06700 ++ 0.00000 {?} {300.HA} 4.16300 0.14900 0.14900 ++ 0.00000 {?} {300.CA} 62.99900 0.44900 0.44900 ? 0.00000 {?} 27.88160 0.45380 0 {?} 0 52 {273.HB} 2.06400 0.06100 0.07800 ++ 0.00000 {?} {273.HA} 4.09700 0.12200 0.16500 ++ 0.00000 {?} {273.CA} 62.28500 0.78700 0.78700 ? 0.00000 {?} 52.81470 0.74410 0 {?} 0 53 {273.HG21} 0.94000 0.05400 0.09700 ++ 0.00000 {?} {273.HA} 4.10500 0.07400 0.15000 ? 0.00000 {?} {273.CA} 62.30500 0.78700 0.78700 ? 0.00000 {?} 89.46470 1.44060 0 {?} 0 54 {269.HB} 2.18200 0.05900 0.07300 ++ 0.00000 {?} {269.HA} 4.19700 0.10100 0.13100 ++ 0.00000 {?} {269.CA} 62.16000 0.78700 0.78700 ? 0.00000 {?} 39.42500 0.67280 0 {?} 0 55 {269.HG11} 0.93600 0.04400 0.07100 ++ 0.00000 {?} {269.HA} 4.19200 0.08400 0.14300 ? 0.00000 {?} {269.CA} 62.19800 0.78700 0.78700 ? 0.00000 {?} 49.99000 0.80640 0 {?} 0 56 {267.HB} 4.23700 0.04300 0.08700 ++ 0.00000 {?} {267.HA} 4.42000 0.04300 0.14500 ? 0.00000 {?} {267.CA} 61.87300 0.78700 0.78700 ? 0.00000 {?} 95.48300 3.40640 0 {?} 0 57 {390.HB} 4.25000 0.06500 0.10200 ++ 0.00000 {?} {390.HA} 4.60600 0.10100 0.23600 ? 0.00000 {?} {390.CA} 61.62600 0.78700 0.78700 ? 0.00000 {?} 68.16940 0.80500 0 {?} 0 58 {375.HB} 4.18600 0.04000 0.07500 ? 0.00000 {?} {375.HA} 4.36400 0.06300 0.16300 ? 0.00000 {?} {375.CA} 61.54500 0.78700 0.78700 ? 0.00000 {?} 61.39560 1.76470 0 {?} 0 59 {354.HG11} 1.69400 0.12300 0.12300 ++ 0.00000 {?} {354.HA} 3.77800 0.17200 0.17200 ++ 0.00000 {?} {354.CA} 61.65800 0.36000 0.36000 ? 0.00000 {?} 17.76190 0.26970 0 {?} 0 60 {375.HG21} 1.23900 0.04100 0.07100 ++ 0.00000 {?} {375.HA} 4.37200 0.10400 0.20700 ++ 0.00000 {?} {375.CA} 61.56900 0.78700 0.78700 ? 0.00000 {?} 60.45120 1.10630 0 {?} 0 61 {390.HG21} 1.21200 0.04200 0.06700 ++ 0.00000 {?} {390.HA} 4.60100 0.10100 0.16300 ++ 0.00000 {?} {390.CA} 61.52800 0.78700 0.78700 ? 0.00000 {?} 46.75510 0.78400 0 {?} 0 62 {363.HG21} 0.90400 0.05500 0.05800 ++ 0.00000 {?} {363.HA} 4.59500 0.10700 0.11600 ++ 0.00000 {?} {363.CA} 61.57300 0.78700 0.78700 ? 0.00000 {?} 12.33800 0.15790 0 {?} 0 63 {386.HD21} 0.83400 0.09600 0.09100 ++ 0.00000 {?} {354.HA} 3.78100 0.16800 0.15100 ++ 0.00000 {?} {354.CA} 61.65700 0.78700 0.78700 ? 0.00000 {?} 29.85400 0.34820 0 {?} 0 64 {363.HG11} 0.78700 0.05600 0.07100 ++ 0.00000 {?} {363.HA} 4.60500 0.10400 0.13000 ++ 0.00000 {?} {363.CA} 61.53200 0.78700 0.78700 ? 0.00000 {?} 20.81380 0.22140 0 {?} 0 65 {362.HA} 4.46200 0.08000 0.08000 ++ 0.00000 {?} {322.HA} 4.13500 0.16300 0.16300 ++ 0.00000 {?} {322.CA} 61.22200 0.15500 0.78700 ? 0.00000 {?} 7.59620 0.15290 0 {?} 0 66 {307.HG21} 0.80600 0.06700 0.08500 ++ 0.00000 {?} {307.HA} 4.90300 0.13700 0.19000 ++ 0.00000 {?} {307.CA} 61.30100 0.78700 0.78700 ? 0.00000 {?} 19.62820 0.18230 0 {?} 0 67 {393.HB} 4.22800 0.07200 0.10900 ++ 0.00000 {?} {393.HA} 4.60400 0.10800 0.17300 ++ 0.00000 {?} {393.CA} 60.94400 0.78700 0.78700 ? 0.00000 {?} 68.11220 0.83890 0 {?} 0 68 {282.HB1} 3.47000 0.05300 0.08000 ++ 0.00000 {?} {282.HA} 4.32200 0.06500 0.15600 ? 0.00000 {?} {282.CA} 61.13500 0.78700 0.78700 ? 0.00000 {?} 9.93060 0.19790 0 {?} 0 69 {284.HB1} 3.30100 0.06500 0.10700 ++ 0.00000 {?} {284.HA} 4.34600 0.10000 0.23600 ? 0.00000 {?} {284.CA} 61.09700 0.78700 0.78700 ? 0.00000 {?} 79.76280 0.95220 0 {?} 0 70 {393.HG21} 1.21200 0.06100 0.08700 ++ 0.00000 {?} {393.HA} 4.60300 0.07800 0.18000 ? 0.00000 {?} {393.CA} 61.16800 0.78700 0.78700 ? 0.00000 {?} 46.49320 0.70060 0 {?} 0 71 {307.HG11} 0.80000 0.06000 0.07300 ++ 0.00000 {?} {393.HA} 4.60100 0.10000 0.12500 ++ 0.00000 {?} {393.CA} 60.98200 0.78700 0.78700 ? 0.00000 {?} 34.92220 0.44030 0 {?} 0 72 {306.HA} 4.39200 0.11500 0.10100 ++ 0.00000 {?} {393.HA} 4.60200 0.17400 0.17400 ++ 0.00000 {?} {393.CA} 60.94300 0.78700 0.78700 ? 0.00000 {?} 43.47670 0.31920 0 {?} 0 73 {283.HB1} 3.24100 0.03100 0.07600 ? 0.00000 {?} {283.HA} 3.99500 0.04900 0.11600 ? 0.00000 {?} {283.CA} 60.52600 0.78700 0.78700 ? 0.00000 {?} 5.35870 0.21950 0 {?} 0 74 {299.HG11} 0.68200 0.07100 0.07100 ++ 0.00000 {?} {283.HA} 3.97900 0.15000 0.15000 ++ 0.00000 {?} {283.CA} 60.52000 0.15600 0.78700 ? 0.00000 {?} 9.19870 0.25730 0 {?} 0 75 {361.HG11} 0.41900 0.07600 0.05100 ++ 0.00000 {?} {361.HA} 4.00800 0.15300 0.15300 ++ 0.00000 {?} {361.CA} 60.75200 0.51200 0.78700 ? 0.00000 {?} 1.46210 0.03070 0 {?} 0 76 {361.HG21} 0.19000 0.04900 0.05200 ++ 0.00000 {?} {361.HA} 4.01600 0.09300 0.10000 ++ 0.00000 {?} {361.CA} 60.75900 0.78700 0.78700 ? 0.00000 {?} 2.04840 0.03330 0 {?} 0 77 {290.HB} 3.97900 0.08300 0.10700 ++ 0.00000 {?} {290.HA} 4.47400 0.12700 0.17800 ++ 0.00000 {?} {290.CA} 60.78300 0.78700 0.78700 ? 0.00000 {?} 58.54830 0.63860 0 {?} 0 78 {283.HB2} 2.44400 0.09400 0.09400 ++ 0.00000 {?} {283.HA} 3.98300 0.16900 0.16900 ++ 0.00000 {?} {283.CA} 60.63700 0.36300 0.36300 ? 0.00000 {?} 16.59360 0.34130 0 {?} 0 79 {290.HG21} 1.22400 0.07600 0.08700 ++ 0.00000 {?} {290.HA} 4.48300 0.10500 0.11500 ? 0.00000 {?} {290.CA} 60.78300 0.78700 0.78700 ? 0.00000 {?} 33.45820 0.30710 0 {?} 0 80 {278.HB} 4.67200 0.07400 0.07400 ++ 0.00000 {?} {278.HA} 5.03900 0.17200 0.17200 ++ 0.00000 {?} {278.CA} 60.21400 0.78700 0.78700 ? 0.00000 {?} 14.74840 0.14470 0 {?} 0 81 {286.HB1} 3.19100 0.07800 0.07800 ++ 0.00000 {?} {286.HA} 4.16600 0.14000 0.14000 ++ 0.00000 {?} {286.CA} 60.19800 0.40300 0.78700 ? 0.00000 {?} 17.05850 0.30130 0 {?} 0 82 {286.HB2} 2.92400 0.08500 0.08500 ++ 0.00000 {?} {286.HA} 4.16200 0.14400 0.14400 ++ 0.00000 {?} {286.CA} 60.23400 0.39900 0.78700 ? 0.00000 {?} 15.86170 0.30550 0 {?} 0 83 {278.HG21} 0.96900 0.09400 0.08300 ++ 0.00000 {?} {278.HA} 5.04500 0.17800 0.17800 ++ 0.00000 {?} {278.CA} 60.20100 0.78700 0.78700 ? 0.00000 {?} 14.23960 0.12430 0 {?} 0 84 {292.HG1} 2.27200 0.07700 0.07700 ++ 0.00000 {?} {292.HA} 3.95300 0.13500 0.13500 ++ 0.00000 {?} {292.CA} 59.98100 0.24800 0.24800 ++ 0.00000 {?} 10.20230 0.28080 0 {?} 0 85 {292.HB1} 2.11500 0.07000 0.07400 ++ 0.00000 {?} {292.HA} 3.95800 0.12300 0.13500 ++ 0.00000 {?} {292.CA} 59.88800 0.78700 0.78700 ? 0.00000 {?} 46.16650 0.48980 0 {?} 0 86 {292.HB2} 2.00800 0.07400 0.07400 ++ 0.00000 {?} {292.HA} 3.95800 0.15800 0.14100 ++ 0.00000 {?} {292.CA} 59.91900 0.78700 0.78700 ? 0.00000 {?} 32.26080 0.42080 0 {?} 0 87 {347.HB1} 2.12000 0.11100 0.10600 ++ 0.00000 {?} {347.HA} 4.15200 0.17200 0.16200 ++ 0.00000 {?} {347.CA} 59.85800 0.78700 0.78700 ? 0.00000 {?} 47.43240 0.35620 0 {?} 0 88 {347.HG1} 1.78300 0.05800 0.05800 ++ 0.00000 {?} {347.HA} 4.15700 0.13800 0.13800 ++ 0.00000 {?} {347.CA} 59.83300 0.18500 0.18500 ? 0.00000 {?} 7.18190 0.19730 0 {?} 0 89 {297.HB1} 2.11900 0.06900 0.10600 ? 0.00000 {?} {297.HA} 4.03500 0.13600 0.18400 ? 0.00000 {?} {297.CA} 59.19100 0.78700 0.78700 ? 0.00000 {?} 91.01440 0.77030 0 {?} 0 90 {340.HB} 1.75100 0.08300 0.11500 ++ 0.00000 {?} {340.HA} 4.50000 0.08500 0.12500 ++ 0.00000 {?} {340.CA} 59.21700 0.78700 0.78700 ? 0.00000 {?} 30.81920 0.35920 0 {?} 0 91 {310.HG21} 1.26300 0.07300 0.07300 ++ 0.00000 {?} {310.HA} 4.89800 0.12200 0.12200 ++ 0.00000 {?} {310.CA} 59.14000 0.47900 0.78700 ? 0.00000 {?} 5.48920 0.09870 0 {?} 0 92 {340.HG21} 0.81500 0.06600 0.08500 ++ 0.00000 {?} {340.HA} 4.51200 0.10300 0.13300 ++ 0.00000 {?} {340.CA} 59.20800 0.78700 0.78700 ? 0.00000 {?} 16.00040 0.18230 0 {?} 0 93 {299.HG21} 0.82500 0.08000 0.08000 ++ 0.00000 {?} {296.HA} 3.02400 0.15700 0.15700 ++ 0.00000 {?} {296.CA} 59.19700 0.52000 0.78700 ? 0.00000 {?} 22.70160 0.23540 0 {?} 0 94 {340.HG11} 0.44400 0.11400 0.10400 ++ 0.00000 {?} {340.HA} 4.51500 0.16000 0.14300 ++ 0.00000 {?} {340.CA} 59.21300 0.78700 0.78700 ? 0.00000 {?} 11.12120 0.11230 0 {?} 0 95 {298.HG1} 2.63100 0.06600 0.06600 ++ 0.00000 {?} {298.HA} 4.09300 0.12800 0.12800 ++ 0.00000 {?} {298.CA} 58.98100 0.31500 0.31500 ? 0.00000 {?} 9.78480 0.29520 0 {?} 0 96 {298.HG2} 2.47700 0.06600 0.06400 ++ 0.00000 {?} {298.HA} 4.09400 0.13500 0.12000 ++ 0.00000 {?} {298.CA} 59.01900 0.78700 0.78700 ? 0.00000 {?} 21.97240 0.44340 0 {?} 0 97 {298.HB1} 2.32100 0.05800 0.07100 ? 0.00000 {?} {298.HA} 4.08900 0.12400 0.15000 ++ 0.00000 {?} {298.CA} 59.01000 0.78700 0.78700 ? 0.00000 {?} 70.45970 0.64970 0 {?} 0 98 {298.HB2} 2.22900 0.06600 0.07700 ? 0.00000 {?} {298.HA} 4.09100 0.13200 0.16700 ++ 0.00000 {?} {298.CA} 59.03300 0.78700 0.78700 ? 0.00000 {?} 83.27450 0.72420 0 {?} 0 99 {344.HB1} 2.16200 0.09700 0.09700 ? 0.00000 {?} {344.HA} 4.16800 0.14600 0.16200 ++ 0.00000 {?} {344.CA} 59.02200 0.78700 0.78700 ? 0.00000 {?} 96.12700 0.54520 0 {?} 0 100 {344.HB2} 2.06300 0.05400 0.10100 ? 0.00000 {?} {344.HA} 4.16000 0.10300 0.14100 ? 0.00000 {?} {344.CA} 59.01400 0.78700 0.78700 ? 0.00000 {?} 42.25390 0.51680 0 {?} 0 101 {316.HB} 3.89200 0.08100 0.08100 ++ 0.00000 {?} {316.HA} 5.61500 0.18800 0.18800 ++ 0.00000 {?} {316.CA} 58.63600 0.78700 0.78700 ? 0.00000 {?} 34.39270 0.30990 0 {?} 0 102 {270.HB1} 3.85800 0.06600 0.12600 ++ 0.00000 {?} {270.HA} 4.38500 0.08800 0.23600 ? 0.00000 {?} {270.CA} 58.68500 0.78700 0.78700 ? 0.00000 {?} 144.45860 1.94380 0 {?} 0 103 {301.HB1} 1.99200 0.03700 0.09900 ? 0.00000 {?} {301.HA} 4.05800 0.08600 0.18500 ? 0.00000 {?} {301.CA} 58.76400 0.78700 0.78700 ? 0.00000 {?} 77.45130 1.58240 0 {?} 0 104 {348.HB1} 1.91000 0.06200 0.09800 ? 0.00000 {?} {348.HA} 4.05300 0.13000 0.18700 ++ 0.00000 {?} {348.CA} 58.73300 0.78700 0.78700 ? 0.00000 {?} 78.56250 0.78810 0 {?} 0 105 {343.HB1} 1.83400 0.06800 0.06800 ++ 0.00000 {?} {343.HA} 4.20200 0.10000 0.15300 ? 0.00000 {?} {343.CA} 58.80400 0.36500 0.36500 ? 0.00000 {?} 10.24850 0.27120 0 {?} 0 106 {348.HB2} 1.79500 0.10100 0.16600 ? 0.00000 {?} {348.HA} 4.05400 0.10000 0.16800 ? 0.00000 {?} {348.CA} 58.68200 0.78700 0.78700 ? 0.00000 {?} 106.43090 0.84520 0 {?} 0 107 {301.HD1} 1.68500 0.04700 0.04700 ? 0.00000 {?} {301.HA} 4.05400 0.09200 0.12300 ++ 0.00000 {?} {301.CA} 58.65200 0.78700 0.78700 ? 0.00000 {?} 36.47720 0.52820 0 {?} 0 108 {343.HG} 1.66800 0.07600 0.07600 ++ 0.00000 {?} {343.HA} 4.19700 0.11200 0.14400 ? 0.00000 {?} {343.CA} 58.80300 0.48200 0.48200 ? 0.00000 {?} 24.74190 0.36140 0 {?} 0 109 {343.HB2} 1.57300 0.09600 0.06700 ++ 0.00000 {?} {343.HA} 4.20000 0.18700 0.15100 ++ 0.00000 {?} {343.CA} 58.79600 0.39800 0.39800 ? 0.00000 {?} 10.13760 0.31120 0 {?} 0 110 {301.HG2} 1.54600 0.04900 0.06600 ++ 0.00000 {?} {301.HA} 4.05600 0.10100 0.13000 ++ 0.00000 {?} {301.CA} 58.73200 0.78700 0.78700 ? 0.00000 {?} 40.20510 0.63750 0 {?} 0 111 {348.HG2} 1.45000 0.05800 0.05400 ++ 0.00000 {?} {348.HA} 4.04900 0.15100 0.14000 ++ 0.00000 {?} {348.CA} 58.71700 0.78700 0.78700 ? 0.00000 {?} 17.08850 0.37040 0 {?} 0 112 {343.HD11} 1.04400 0.02800 0.05800 ? 0.00000 {?} {343.HA} 4.20200 0.17900 0.17500 ++ 0.00000 {?} {343.CA} 58.76800 0.78700 0.78700 ? 0.00000 {?} 19.70040 0.47740 0 {?} 0 113 {316.HG21} 1.03600 0.05700 0.07000 ++ 0.00000 {?} {316.HA} 5.61500 0.16600 0.21500 ++ 0.00000 {?} {316.CA} 58.64500 0.78700 0.78700 ? 0.00000 {?} 38.34320 0.41840 0 {?} 0 114 {343.HD21} 0.98500 0.06600 0.06600 ? 0.00000 {?} {343.HA} 4.20400 0.13000 0.13000 ++ 0.00000 {?} {343.CA} 58.79700 0.30900 0.30900 ? 0.00000 {?} 12.65280 0.31890 0 {?} 0 115 {354.HD11} 0.92600 0.06200 0.06200 ++ 0.00000 {?} {343.HA} 4.20500 0.16500 0.16500 ? 0.00000 {?} {343.CA} 58.76000 0.04300 0.04300 ++ 0.00000 {?} 13.38290 0.35020 0 {?} 0 116 {307.HG21} 0.78700 0.03500 0.06500 ? 0.00000 {?} {316.HA} 5.61100 0.15700 0.15700 ++ 0.00000 {?} {316.CA} 58.62800 0.19800 0.19800 ++ 0.00000 {?} 4.28930 0.15680 0 {?} 0 117 {309.HD21} 0.75200 0.05900 0.05900 ? 0.00000 {?} {316.HA} 5.61500 0.14600 0.14600 ++ 0.00000 {?} {316.CA} 58.63200 0.20000 0.20000 ++ 0.00000 {?} 6.37140 0.15960 0 {?} 0 118 {311.HG1} 1.26400 0.08600 0.08600 ++ 0.00000 {?} {311.HA} 4.05700 0.11900 0.12100 ++ 0.00000 {?} {311.CA} 58.42500 0.78700 0.78700 ? 0.00000 {?} 15.65190 0.17170 0 {?} 0 119 {324.HB2} 3.01900 0.02700 0.08500 ? 0.00000 {?} {324.HA} 4.49200 0.04100 0.12100 ? 0.00000 {?} {324.CA} 58.20200 0.78700 0.78700 ? 0.00000 {?} 2.90820 0.16620 0 {?} 0 120 {324.HB1} 3.62600 0.02700 0.09300 ? 0.00000 {?} {324.HA} 4.48100 0.06500 0.17900 ? 0.00000 {?} {324.CA} 58.14500 0.78700 0.78700 ? 0.00000 {?} 4.28270 0.17830 0 {?} 0 121 {276.HB1} 3.87800 0.05400 0.09000 ++ 0.00000 {?} {276.HA} 4.61100 0.08000 0.15900 ++ 0.00000 {?} {276.CA} 58.21600 0.78700 0.78700 ? 0.00000 {?} 42.01130 0.72050 0 {?} 0 122 {293.HB1} 3.34400 0.05900 0.06700 ++ 0.00000 {?} {293.HA} 4.50100 0.15100 0.17900 ++ 0.00000 {?} {293.CA} 58.07900 0.78700 0.78700 ? 0.00000 {?} 43.12950 0.45610 0 {?} 0 123 {293.HB2} 3.21400 0.04700 0.05700 ++ 0.00000 {?} {293.HA} 4.50500 0.10300 0.13200 ++ 0.00000 {?} {293.CA} 58.08200 0.78700 0.78700 ? 0.00000 {?} 28.51860 0.43590 0 {?} 0 124 {308.HB} 1.97200 0.11100 0.11100 ++ 0.00000 {?} {308.HA} 5.29400 0.18300 0.18300 ++ 0.00000 {?} {308.CA} 58.14700 0.78700 0.78700 ? 0.00000 {?} 37.47400 0.29450 0 {?} 0 125 {390.HG21} 1.21100 0.08300 0.08300 ++ 0.00000 {?} {308.HA} 5.29500 0.17700 0.17700 ++ 0.00000 {?} {308.CA} 58.16900 0.78700 0.78700 ? 0.00000 {?} 31.92520 0.31690 0 {?} 0 126 {280.HD11} 0.95800 0.05800 0.06400 ++ 0.00000 {?} {385.HA} 4.01000 0.10200 0.11400 ? 0.00000 {?} {385.CA} 58.16900 0.78700 0.78700 ? 0.00000 {?} 38.26920 0.49330 0 {?} 0 127 {307.HG21} 0.79300 0.09300 0.09300 ++ 0.00000 {?} {308.HA} 5.29200 0.16300 0.16300 ++ 0.00000 {?} {308.CA} 58.16000 0.78700 0.78700 ? 0.00000 {?} 42.02220 0.31070 0 {?} 0 128 {308.HG11} 0.63300 0.08600 0.11300 ++ 0.00000 {?} {308.HA} 5.29400 0.14200 0.18300 ++ 0.00000 {?} {308.CA} 58.15400 0.78700 0.78700 ? 0.00000 {?} 61.38150 0.62500 0 {?} 0 129 {280.HD11} 0.95200 0.05700 0.07200 ++ 0.00000 {?} {280.HA} 4.12700 0.11900 0.15000 ? 0.00000 {?} {280.CA} 57.81400 0.78700 0.78700 ? 0.00000 {?} 55.63900 0.64500 0 {?} 0 130 {284.HB1} 3.30000 0.07900 0.07100 ++ 0.00000 {?} {281.HA} 4.44400 0.10100 0.10100 ++ 0.00000 {?} {281.CA} 57.74500 0.78700 0.78700 ? 0.00000 {?} 23.99750 0.34650 0 {?} 0 131 {281.HB2} 2.87000 0.09100 0.09100 ++ 0.00000 {?} {281.HA} 4.43400 0.14300 0.14300 ++ 0.00000 {?} {281.CA} 57.75900 0.31100 0.31100 ? 0.00000 {?} 13.55860 0.29240 0 {?} 0 132 {302.HG1} 2.31100 0.09100 0.09100 ++ 0.00000 {?} {302.HA} 4.20300 0.15600 0.15600 ++ 0.00000 {?} {302.CA} 57.35300 0.22700 0.22700 ++ 0.00000 {?} 10.75090 0.25720 0 {?} 0 133 {302.HB1} 2.20500 0.07600 0.07100 ++ 0.00000 {?} {302.HA} 4.20200 0.17200 0.16000 ++ 0.00000 {?} {302.CA} 57.37800 0.78700 0.78700 ? 0.00000 {?} 30.08510 0.41620 0 {?} 0 134 {302.HB2} 1.87700 0.10900 0.10900 ++ 0.00000 {?} {302.HA} 4.20200 0.23000 0.18100 ++ 0.00000 {?} {302.CA} 57.34300 0.78700 0.78700 ? 0.00000 {?} 54.30210 0.37320 0 {?} 0 135 {329.HB1} 2.10600 0.08700 0.09100 ++ 0.00000 {?} {329.HA} 4.48600 0.13400 0.14100 ++ 0.00000 {?} {329.CA} 57.02600 0.78700 0.78700 ? 0.00000 {?} 49.53910 0.42340 0 {?} 0 136 {329.HG2} 1.56000 0.10200 0.10200 ++ 0.00000 {?} {329.HA} 4.48200 0.17500 0.17500 ++ 0.00000 {?} {329.CA} 57.03500 0.78700 0.78700 ? 0.00000 {?} 38.45050 0.31800 0 {?} 0 137 {317.HB1} 2.92100 0.05500 0.08000 ++ 0.00000 {?} {317.HA} 4.66200 0.07700 0.16400 ? 0.00000 {?} {317.CA} 56.83600 0.78700 0.78700 ? 0.00000 {?} 6.60980 0.10700 0 {?} 0 138 {320.HB2} 2.48400 0.05400 0.09000 ++ 0.00000 {?} {364.HA} 5.21300 0.07200 0.14700 ? 0.00000 {?} {364.CA} 56.86100 0.78700 0.78700 ? 0.00000 {?} 6.41510 0.10820 0 {?} 0 139 {364.HB2} 3.45300 0.10300 0.10300 ++ 0.00000 {?} {364.HA} 5.21100 0.15800 0.15800 ++ 0.00000 {?} {364.CA} 56.80600 0.11100 0.11100 ++ 0.00000 {?} 8.30670 0.17930 0 {?} 0 140 {312.HB1} 3.11200 0.12700 0.12700 ++ 0.00000 {?} {312.HA} 4.60200 0.16900 0.16900 ++ 0.00000 {?} {312.CA} 56.87400 0.41100 0.41100 ? 0.00000 {?} 14.77420 0.15190 0 {?} 0 141 {312.HB2} 2.79200 0.08800 0.08800 ++ 0.00000 {?} {312.HA} 4.60800 0.14500 0.14500 ++ 0.00000 {?} {312.CA} 56.85800 0.40200 0.40200 ++ 0.00000 {?} 9.83880 0.15260 0 {?} 0 142 {349.HB1} 1.15500 0.10300 0.08800 ++ 0.00000 {?} {349.HA} 3.78000 0.18500 0.18500 ++ 0.00000 {?} {349.CA} 56.88100 0.78700 0.78700 ? 0.00000 {?} 32.54670 0.33230 0 {?} 0 143 {349.HB2} 0.67700 0.09500 0.09500 ++ 0.00000 {?} {349.HA} 3.77800 0.17700 0.17700 ++ 0.00000 {?} {349.CA} 56.89900 0.48900 0.48900 ? 0.00000 {?} 24.73420 0.25680 0 {?} 0 144 {288.HB1} 3.29900 0.10200 0.09800 ++ 0.00000 {?} {288.HA} 4.45600 0.16100 0.15300 ++ 0.00000 {?} {288.CA} 56.60800 0.78700 0.78700 ? 0.00000 {?} 27.31590 0.34390 0 {?} 0 145 {288.HB2} 3.07300 0.09900 0.09900 ++ 0.00000 {?} {288.HA} 4.44800 0.18400 0.14300 ++ 0.00000 {?} {288.CA} 56.60700 0.78700 0.78700 ? 0.00000 {?} 26.96080 0.30930 0 {?} 0 146 {277.HG1} 2.47400 0.09400 0.09400 ++ 0.00000 {?} {277.HA} 4.76600 0.20200 0.12600 ++ 0.00000 {?} {277.CA} 56.57700 0.78700 0.78700 ? 0.00000 {?} 15.03520 0.19910 0 {?} 0 147 {277.HB1} 2.29400 0.05800 0.05800 ++ 0.00000 {?} {277.HA} 4.76400 0.10800 0.10800 ++ 0.00000 {?} {277.CA} 56.54800 0.09600 0.09600 ++ 0.00000 {?} 4.18080 0.14530 0 {?} 0 148 {277.HB2} 2.21000 0.07300 0.07300 ++ 0.00000 {?} {277.HA} 4.76200 0.13500 0.13500 ++ 0.00000 {?} {277.CA} 56.61200 0.25800 0.25800 ++ 0.00000 {?} 5.82330 0.15750 0 {?} 0 149 {331.HG21} 0.95300 0.08900 0.08900 ++ 0.00000 {?} {341.HA} 5.13500 0.12800 0.12800 ++ 0.00000 {?} {341.CA} 56.27600 0.34100 0.78700 ? 0.00000 {?} 3.36240 0.06240 0 {?} 0 150 {395.HE1} 3.01400 0.01700 0.07500 ? 0.00000 {?} {395.HA} 4.30600 0.05200 0.13800 ? 0.00000 {?} {395.CA} 56.38600 0.78700 0.78700 ? 0.00000 {?} 2.65030 0.16580 0 {?} 0 151 {395.HG1} 1.46600 0.04000 0.11400 ? 0.00000 {?} {395.HA} 4.31400 0.07100 0.13300 ++ 0.00000 {?} {395.CA} 56.36700 0.78700 0.78700 ? 0.00000 {?} 44.93860 1.13210 0 {?} 0 152 {272.HG1} 1.38700 0.07300 0.07300 ? 0.00000 {?} {272.HA} 4.32300 0.09700 0.09900 ++ 0.00000 {?} {272.CA} 56.38200 0.78700 0.78700 ? 0.00000 {?} 34.72640 0.38490 0 {?} 0 153 {294.HG1} 1.15500 0.08900 0.08200 ++ 0.00000 {?} {294.HA} 4.44200 0.15200 0.13800 ++ 0.00000 {?} {294.CA} 56.23100 0.78700 0.78700 ? 0.00000 {?} 34.71080 0.47870 0 {?} 0 154 {308.HA} 5.29700 0.08300 0.08300 ++ 0.00000 {?} {389.HA} 4.40000 0.17000 0.17000 ++ 0.00000 {?} {389.CA} 55.75700 0.42600 0.78700 ? 0.00000 {?} 25.60260 0.29390 0 {?} 0 155 {397.HD1} 3.23200 0.05000 0.07200 ++ 0.00000 {?} {397.HA} 4.36300 0.09900 0.14900 ? 0.00000 {?} {397.CA} 55.97200 0.78700 0.78700 ? 0.00000 {?} 52.91250 0.82140 0 {?} 0 156 {291.HG1} 2.33700 0.04100 0.10000 ? 0.00000 {?} {291.HA} 4.36700 0.13800 0.19000 ++ 0.00000 {?} {291.CA} 56.11900 0.78700 0.78700 ? 0.00000 {?} 52.85550 0.84820 0 {?} 0 157 {397.HB1} 1.87900 0.04200 0.08900 ? 0.00000 {?} {397.HA} 4.36900 0.13200 0.23300 ? 0.00000 {?} {397.CA} 55.95100 0.78700 0.78700 ? 0.00000 {?} 246.72400 2.82910 0 {?} 0 158 {397.HB2} 1.79700 0.04400 0.08300 ? 0.00000 {?} {397.HA} 4.36500 0.13700 0.23500 ? 0.00000 {?} {397.CA} 55.99400 0.78700 0.78700 ? 0.00000 {?} 279.28049 3.20190 0 {?} 0 159 {275.HD1} 3.22800 0.02600 0.09500 ? 0.00000 {?} {275.HA} 4.37300 0.07600 0.20800 ? 0.00000 {?} {275.CA} 55.68800 0.78700 0.78700 ? 0.00000 {?} 26.37870 0.89240 0 {?} 0 160 {271.HB1} 3.27200 0.06500 0.08200 ++ 0.00000 {?} {271.HA} 4.71100 0.12700 0.16400 ++ 0.00000 {?} {271.CA} 55.81600 0.78700 0.78700 ? 0.00000 {?} 27.57680 0.37910 0 {?} 0 161 {271.HB2} 3.14900 0.07400 0.08800 ++ 0.00000 {?} {271.HA} 4.70900 0.13100 0.16800 ++ 0.00000 {?} {271.CA} 55.81100 0.78700 0.78700 ? 0.00000 {?} 28.58150 0.34860 0 {?} 0 162 {285.HB1} 2.78000 0.08000 0.07300 ++ 0.00000 {?} {285.HA} 4.52100 0.14000 0.14000 ++ 0.00000 {?} {285.CA} 55.79000 0.78700 0.78700 ? 0.00000 {?} 26.20510 0.30530 0 {?} 0 163 {320.HB1} 2.77700 0.10600 0.10600 ++ 0.00000 {?} {320.HA} 5.02100 0.15900 0.15900 ++ 0.00000 {?} {320.CA} 55.83200 0.44500 0.44500 ? 0.00000 {?} 14.97850 0.16910 0 {?} 0 164 {285.HB2} 2.67200 0.07800 0.08200 ++ 0.00000 {?} {285.HA} 4.52400 0.08200 0.12600 ? 0.00000 {?} {285.CA} 55.77100 0.78700 0.78700 ? 0.00000 {?} 31.14080 0.37240 0 {?} 0 165 {320.HB2} 2.48500 0.08700 0.08700 ++ 0.00000 {?} {320.HA} 5.01700 0.13100 0.13100 ++ 0.00000 {?} {320.CA} 55.83800 0.09100 0.09100 ++ 0.00000 {?} 6.52710 0.15630 0 {?} 0 166 {274.HG} 1.66000 0.04000 0.08200 ? 0.00000 {?} {271.HA} 4.70800 0.08000 0.13500 ? 0.00000 {?} {271.CA} 55.90300 0.78700 0.78700 ? 0.00000 {?} 4.48800 0.07420 0 {?} 0 167 {303.HB2} 1.32000 0.08900 0.08900 ++ 0.00000 {?} {303.HA} 4.25900 0.14700 0.14700 ? 0.00000 {?} {303.CA} 55.87700 0.28600 0.28600 ? 0.00000 {?} 14.05180 0.27660 0 {?} 0 168 {376.HD21} 0.92900 0.08300 0.08300 ++ 0.00000 {?} {397.HA} 4.39400 0.15300 0.13800 ++ 0.00000 {?} {397.CA} 55.71400 0.78700 0.78700 ? 0.00000 {?} 48.13820 0.39110 0 {?} 0 169 {303.HD11} 0.79200 0.07700 0.09900 ++ 0.00000 {?} {303.HA} 4.25800 0.10200 0.14500 ? 0.00000 {?} {303.CA} 55.80200 0.78700 0.78700 ? 0.00000 {?} 73.66210 0.71730 0 {?} 0 170 {389.HD21} 0.63300 0.05900 0.09000 ++ 0.00000 {?} {389.HA} 4.42400 0.09900 0.17100 ++ 0.00000 {?} {389.CA} 55.76400 0.78700 0.78700 ? 0.00000 {?} 69.87430 1.05590 0 {?} 0 171 {303.HD21} 0.61300 0.05500 0.06300 ++ 0.00000 {?} {303.HA} 4.25700 0.10000 0.11600 ++ 0.00000 {?} {303.CA} 55.83700 0.78700 0.78700 ? 0.00000 {?} 33.86620 0.54140 0 {?} 0 172 {399.HB2} 2.64300 0.04900 0.06300 ++ 0.00000 {?} {399.HA} 4.41900 0.08100 0.10700 ++ 0.00000 {?} {399.CA} 55.65500 0.78700 0.78700 ? 0.00000 {?} 46.58510 0.76630 0 {?} 0 173 {396.HB2} 2.55900 0.06900 0.06900 ++ 0.00000 {?} {396.HA} 4.45400 0.12000 0.11100 ++ 0.00000 {?} {396.CA} 55.58800 0.78700 0.78700 ? 0.00000 {?} 24.31430 0.44130 0 {?} 0 174 {289.HG1} 2.26900 0.06000 0.06800 ++ 0.00000 {?} {289.HA} 4.36100 0.08000 0.09000 ++ 0.00000 {?} {289.CA} 55.57600 0.78700 0.78700 ? 0.00000 {?} 33.47800 0.51320 0 {?} 0 175 {396.HG1} 2.12900 0.04000 0.06300 ? 0.00000 {?} {396.HA} 4.43900 0.09300 0.18300 ? 0.00000 {?} {396.CA} 55.55500 0.78700 0.78700 ? 0.00000 {?} 66.99720 1.24890 0 {?} 0 176 {396.HG2} 2.06300 0.06300 0.07100 ? 0.00000 {?} {396.HA} 4.44100 0.05600 0.16700 ? 0.00000 {?} {396.CA} 55.63700 0.78700 0.78700 ? 0.00000 {?} 45.95140 0.84570 0 {?} 0 177 {358.HB1} 2.04000 0.05100 0.05900 ? 0.00000 {?} {358.HA} 4.60200 0.09700 0.09700 ++ 0.00000 {?} {358.CA} 55.58700 0.78700 0.78700 ? 0.00000 {?} 22.15980 0.33320 0 {?} 0 178 {358.HB2} 1.94200 0.05700 0.04600 ? 0.00000 {?} {358.HA} 4.59600 0.10700 0.10700 ++ 0.00000 {?} {358.CA} 55.58400 0.78700 0.78700 ? 0.00000 {?} 15.91090 0.32400 0 {?} 0 179 {358.HD1} 1.75600 0.08200 0.08200 ++ 0.00000 {?} {358.HA} 4.59800 0.13300 0.13300 ++ 0.00000 {?} {358.CA} 55.52900 0.36500 0.36500 ++ 0.00000 {?} 11.09650 0.22280 0 {?} 0 180 {358.HG1} 1.50200 0.06500 0.06700 ? 0.00000 {?} {358.HA} 4.60100 0.14000 0.14000 ++ 0.00000 {?} {358.CA} 55.53100 0.78700 0.78700 ? 0.00000 {?} 28.91420 0.23990 0 {?} 0 181 {358.HG2} 1.43700 0.08400 0.07400 ? 0.00000 {?} {358.HA} 4.60200 0.18000 0.15600 ++ 0.00000 {?} {358.CA} 55.57400 0.78700 0.78700 ? 0.00000 {?} 24.02380 0.31250 0 {?} 0 182 {393.HG21} 1.21200 0.06200 0.06200 ? 0.00000 {?} {306.HA} 4.39800 0.15100 0.15100 ++ 0.00000 {?} {306.CA} 55.34900 0.78700 0.78700 ? 0.00000 {?} 27.88300 0.26570 0 {?} 0 183 {393.HA} 4.59100 0.06400 0.08800 ? 0.00000 {?} {306.HA} 4.41400 0.10700 0.10700 ? 0.00000 {?} {306.CA} 55.27200 0.78700 0.78700 ? 0.00000 {?} 102.61680 0.90360 0 {?} 0 184 {315.HD1} 1.64800 0.07300 0.10800 ? 0.00000 {?} {315.HA} 4.51800 0.06400 0.15800 ? 0.00000 {?} {315.CA} 55.31100 0.78700 0.78700 ? 0.00000 {?} 43.69150 0.48270 0 {?} 0 185 {306.HB2} 1.36500 0.10400 0.08700 ++ 0.00000 {?} {306.HA} 4.40400 0.15900 0.12900 ++ 0.00000 {?} {306.CA} 55.34800 0.78700 0.78700 ? 0.00000 {?} 27.43710 0.32070 0 {?} 0 186 {315.HB2} 1.35100 0.11200 0.11600 ++ 0.00000 {?} {315.HA} 4.52400 0.10700 0.11500 ++ 0.00000 {?} {315.CA} 55.24700 0.78700 0.78700 ? 0.00000 {?} 34.35380 0.26630 0 {?} 0 187 {315.HG2} 1.15000 0.08500 0.08400 ++ 0.00000 {?} {315.HA} 4.53200 0.14500 0.14300 ++ 0.00000 {?} {315.CA} 55.25300 0.78700 0.78700 ? 0.00000 {?} 20.18520 0.29330 0 {?} 0 188 {306.HD21} 0.80600 0.03200 0.06400 ? 0.00000 {?} {306.HA} 4.39200 0.07300 0.16800 ? 0.00000 {?} {306.CA} 55.29500 0.78700 0.78700 ? 0.00000 {?} 49.26420 1.15630 0 {?} 0 189 {333.HA} 4.73200 0.07500 0.07500 +E 0.00000 {?} {339.HA} 5.00100 0.16500 0.16300 ++ 0.00000 {?} {339.CA} 55.01000 0.78700 0.78700 ? 0.00000 {?} 15.51750 0.17630 0 {?} 0 190 {332.HB1} 2.94800 0.08100 0.08100 ++ 0.00000 {?} {332.HA} 4.80600 0.10400 0.10400 ++ 0.00000 {?} {332.CA} 55.01500 0.37400 0.37400 ++ 0.00000 {?} 3.21020 0.08080 0 {?} 0 191 {332.HB2} 2.64000 0.06600 0.06600 ++ 0.00000 {?} {332.HA} 4.80400 0.14900 0.14900 ++ 0.00000 {?} {332.CA} 54.96900 0.29500 0.78700 ? 0.00000 {?} 3.91980 0.10960 0 {?} 0 192 {326.HG2} 2.13900 0.09300 0.09300 ++ 0.00000 {?} {326.HA} 4.71600 0.13800 0.13800 ++ 0.00000 {?} {326.CA} 55.04800 0.17600 0.17600 ++ 0.00000 {?} 5.15720 0.12570 0 {?} 0 193 {339.HB1} 1.74700 0.07500 0.07500 ++ 0.00000 {?} {339.HA} 4.99200 0.16000 0.16000 ++ 0.00000 {?} {339.CA} 55.02000 0.78700 0.78700 ? 0.00000 {?} 24.45900 0.21210 0 {?} 0 194 {274.HB2} 1.60300 0.08100 0.08100 ? 0.00000 {?} {274.HA} 4.42400 0.09900 0.18900 ? 0.00000 {?} {274.CA} 55.14100 0.78700 0.78700 ? 0.00000 {?} 119.25340 1.06070 0 {?} 0 195 {335.HB1} 1.53100 0.07000 0.10700 ++ 0.00000 {?} {335.HA} 4.16900 0.07200 0.14300 ++ 0.00000 {?} {335.CA} 54.97300 0.78700 0.78700 ? 0.00000 {?} 36.56750 0.44740 0 {?} 0 196 {274.HD11} 0.93300 0.05100 0.06100 ? 0.00000 {?} {274.HA} 4.41900 0.13200 0.16100 ++ 0.00000 {?} {274.CA} 55.03900 0.78700 0.78700 ? 0.00000 {?} 51.73020 0.61950 0 {?} 0 197 {274.HD21} 0.88100 0.03000 0.05700 ? 0.00000 {?} {274.HA} 4.41700 0.09000 0.17100 ? 0.00000 {?} {274.CA} 55.00100 0.78700 0.78700 ? 0.00000 {?} 48.12460 1.28450 0 {?} 0 198 {307.HG21} 0.80000 0.08000 0.08000 ++ 0.00000 {?} {318.HA} 4.84500 0.16700 0.16700 ++ 0.00000 {?} {318.CA} 54.96000 0.23100 0.78700 ? 0.00000 {?} 4.58510 0.09980 0 {?} 0 199 {325.HB1} 2.94500 0.11500 0.11500 ++ 0.00000 {?} {325.HA} 4.93000 0.14300 0.14300 ++ 0.00000 {?} {325.CA} 54.74400 0.78700 0.78700 ? 0.00000 {?} 22.32580 0.15300 0 {?} 0 200 {392.HB1} 1.72000 0.13800 0.12500 ++ 0.00000 {?} {392.HA} 4.58000 0.16900 0.16900 ++ 0.00000 {?} {392.CA} 54.80700 0.78700 0.78700 ? 0.00000 {?} 56.91940 0.37490 0 {?} 0 201 {333.HB2} 1.66600 0.09500 0.09600 ++ 0.00000 {?} {333.HA} 4.71800 0.12200 0.12500 ++ 0.00000 {?} {333.CA} 54.74800 0.78700 0.78700 ? 0.00000 {?} 31.13700 0.20590 0 {?} 0 202 {392.HB2} 1.56600 0.06500 0.10100 ++ 0.00000 {?} {392.HA} 4.58300 0.10800 0.17000 ++ 0.00000 {?} {392.CA} 54.81600 0.78700 0.78700 ? 0.00000 {?} 63.12220 0.74560 0 {?} 0 203 {333.HG1} 1.35900 0.08000 0.08000 ++ 0.00000 {?} {333.HA} 4.72600 0.13900 0.13900 ++ 0.00000 {?} {333.CA} 54.74800 0.15700 0.15700 ? 0.00000 {?} 5.52070 0.14660 0 {?} 0 204 {392.HD21} 0.89700 0.04900 0.08100 ++ 0.00000 {?} {392.HA} 4.58300 0.09400 0.20800 ? 0.00000 {?} {392.CA} 54.77300 0.78700 0.78700 ? 0.00000 {?} 65.17340 1.11620 0 {?} 0 205 {351.HB1} 3.26900 0.07900 0.06800 ++ 0.00000 {?} {351.HA} 4.93500 0.14100 0.14100 ++ 0.00000 {?} {351.CA} 54.50100 0.78700 0.78700 ? 0.00000 {?} 9.55090 0.12590 0 {?} 0 206 {351.HB2} 2.79800 0.06900 0.06900 ++ 0.00000 {?} {351.HA} 4.92000 0.14900 0.14900 ++ 0.00000 {?} {351.CA} 54.50700 0.78700 0.78700 ? 0.00000 {?} 14.35880 0.18470 0 {?} 0 207 {268.HB1} 2.75500 0.07100 0.07100 ++ 0.00000 {?} {268.HA} 4.70000 0.19300 0.13300 ++ 0.00000 {?} {268.CA} 54.20900 0.78700 0.78700 ? 0.00000 {?} 15.01250 0.24640 0 {?} 0 208 {268.HB2} 2.65500 0.02900 0.05600 ? 0.00000 {?} {268.HA} 4.70000 0.09000 0.10800 ++ 0.00000 {?} {268.CA} 54.18300 0.78700 0.78700 ? 0.00000 {?} 16.89150 0.43580 0 {?} 0 209 {394.HB2} 2.56800 0.07400 0.07400 ? 0.00000 {?} {394.HA} 4.69800 0.12300 0.14000 ++ 0.00000 {?} {394.CA} 54.12200 0.78700 0.78700 ? 0.00000 {?} 30.85280 0.35390 0 {?} 0 210 {314.HB1} 3.08800 0.05400 0.06100 ++ 0.00000 {?} {314.HA} 4.44700 0.11500 0.13200 ++ 0.00000 {?} {314.CA} 54.03800 0.78700 0.78700 ? 0.00000 {?} 21.35640 0.24700 0 {?} 0 211 {314.HB2} 2.66100 0.05600 0.06500 ++ 0.00000 {?} {314.HA} 4.46300 0.11800 0.13800 ++ 0.00000 {?} {314.CA} 54.02300 0.78700 0.78700 ? 0.00000 {?} 18.05700 0.17690 0 {?} 0 212 {309.HD21} 0.74200 0.04600 0.05100 ++ 0.00000 {?} {314.HA} 4.44700 0.10900 0.11800 ++ 0.00000 {?} {314.CA} 54.05100 0.78700 0.78700 ? 0.00000 {?} 17.35490 0.25980 0 {?} 0 213 {356.HB2} 2.37600 0.08000 0.08000 ++ 0.00000 {?} {356.HA} 4.88400 0.12500 0.12500 ++ 0.00000 {?} {356.CA} 53.80800 0.17700 0.17700 ? 0.00000 {?} 4.45620 0.11580 0 {?} 0 214 {366.HD2} 3.82300 0.02600 0.05000 ++ 0.00000 {?} {365.HA} 4.74300 0.06900 0.15600 ? 0.00000 {?} {365.CA} 53.37700 0.78700 0.78700 ? 0.00000 {?} 1.90020 0.07150 0 {?} 0 215 {366.HD1} 3.86700 0.05800 0.05800 ++ 0.00000 {?} {365.HA} 4.74500 0.13300 0.13300 ++ 0.00000 {?} {365.CA} 53.37300 0.14300 0.14300 ++ 0.00000 {?} 3.47110 0.09670 0 {?} 0 216 {336.HB1} 3.12200 0.07000 0.09100 ++ 0.00000 {?} {336.HA} 4.51400 0.08500 0.11200 ++ 0.00000 {?} {336.CA} 53.35600 0.78700 0.78700 ? 0.00000 {?} 34.21060 0.44140 0 {?} 0 217 {336.HB2} 2.65800 0.10300 0.12800 ++ 0.00000 {?} {336.HA} 4.51200 0.08900 0.11900 ++ 0.00000 {?} {336.CA} 53.35400 0.78700 0.78700 ? 0.00000 {?} 39.92140 0.39990 0 {?} 0 218 {352.HB1} 2.08000 0.08800 0.08800 ++ 0.00000 {?} {352.HA} 4.55100 0.12100 0.12100 ++ 0.00000 {?} {352.CA} 53.45500 0.32000 0.32000 ++ 0.00000 {?} 6.62960 0.16310 0 {?} 0 219 {352.HB2} 1.69800 0.07800 0.07800 ++ 0.00000 {?} {352.HA} 4.55100 0.11200 0.11200 ++ 0.00000 {?} {352.CA} 53.44900 0.09700 0.09700 ++ 0.00000 {?} 5.14870 0.14630 0 {?} 0 220 {382.HA} 4.59000 0.08000 0.08000 ++ 0.00000 {?} {381.HA} 5.08100 0.16000 0.16000 ++ 0.00000 {?} {381.CA} 53.14900 0.09800 0.09800 ++ 0.00000 {?} 2.78100 0.06360 0 {?} 0 221 {398.HB1} 2.87300 0.06500 0.07600 ++ 0.00000 {?} {398.HA} 4.83000 0.12200 0.14600 ++ 0.00000 {?} {398.CA} 52.90000 0.78700 0.78700 ? 0.00000 {?} 24.90710 0.35970 0 {?} 0 222 {398.HB2} 2.72500 0.06900 0.06500 ++ 0.00000 {?} {398.HA} 4.82400 0.15000 0.14100 ++ 0.00000 {?} {398.CA} 52.90000 0.78700 0.78700 ? 0.00000 {?} 14.61460 0.25920 0 {?} 0 223 {361.HG11} 0.42500 0.06100 0.06100 ? 0.00000 {?} {381.HA} 5.09900 0.12400 0.12400 ++ 0.00000 {?} {381.CA} 53.15900 0.10900 0.10900 ++ 0.00000 {?} 1.24370 0.03420 0 {?} 0 224 {322.HA} 4.13900 0.09300 0.09300 ++ 0.00000 {?} {362.HA} 4.45100 0.16900 0.16900 ++ 0.00000 {?} {362.CA} 52.85000 0.15400 0.15400 ++ 0.00000 {?} 11.88480 0.20330 0 {?} 0 225 {377.HD1} 3.94600 0.07000 0.08800 ++ 0.00000 {?} {376.HA} 4.70200 0.10900 0.14600 ++ 0.00000 {?} {376.CA} 52.85800 0.78700 0.78700 ? 0.00000 {?} 17.39610 0.20270 0 {?} 0 226 {377.HD2} 3.64800 0.05500 0.06800 ++ 0.00000 {?} {376.HA} 4.70000 0.08300 0.10600 ++ 0.00000 {?} {376.CA} 52.88100 0.78700 0.78700 ? 0.00000 {?} 11.49010 0.17350 0 {?} 0 227 {376.HG} 2.04000 0.09100 0.09100 ++ 0.00000 {?} {376.HA} 4.70400 0.27500 0.15000 ++ 0.00000 {?} {376.CA} 52.98700 0.50700 0.50700 ? 0.00000 {?} 10.44790 0.11060 0 {?} 0 228 {376.HB1} 1.64400 0.08700 0.09500 ++ 0.00000 {?} {376.HA} 4.70200 0.14300 0.16900 ++ 0.00000 {?} {376.CA} 52.85700 0.78700 0.78700 ? 0.00000 {?} 26.90120 0.20840 0 {?} 0 229 {309.HB2} 1.35400 0.06500 0.06500 ++ 0.00000 {?} {309.HA} 5.32200 0.14000 0.14000 ++ 0.00000 {?} {309.CA} 52.94400 0.49500 0.49500 ? 0.00000 {?} 17.17510 0.22370 0 {?} 0 230 {316.HG21} 1.03700 0.08800 0.08200 ++ 0.00000 {?} {309.HA} 5.32000 0.17100 0.16000 ++ 0.00000 {?} {309.CA} 52.91800 0.78700 0.78700 ? 0.00000 {?} 17.22380 0.23480 0 {?} 0 231 {309.HD21} 0.75100 0.06700 0.06900 ++ 0.00000 {?} {309.HA} 5.31800 0.14900 0.15400 ++ 0.00000 {?} {309.CA} 52.92200 0.78700 0.78700 ? 0.00000 {?} 28.48000 0.29610 0 {?} 0 232 {362.HD21} 0.53700 0.10200 0.09100 ++ 0.00000 {?} {362.HA} 4.45900 0.13300 0.13300 ++ 0.00000 {?} {362.CA} 52.82500 0.78700 0.78700 ? 0.00000 {?} 29.31200 0.35100 0 {?} 0 233 {304.HD11} 0.95000 0.08800 0.10900 ++ 0.00000 {?} {321.HA} 4.73800 0.06100 0.14600 ? 0.00000 {?} {321.CA} 52.78300 0.78700 0.78700 ? 0.00000 {?} 22.17380 0.34980 0 {?} 0 234 {386.HD21} 0.83900 0.04900 0.06000 ++ 0.00000 {?} {386.HA} 4.58100 0.09600 0.11800 ++ 0.00000 {?} {386.CA} 52.53000 0.78700 0.78700 ? 0.00000 {?} 27.02110 0.43030 0 {?} 0 235 {358.HA} 4.60400 0.07800 0.07800 ++ 0.00000 {?} {327.HA} 5.48800 0.12500 0.12500 ++ 0.00000 {?} {327.CA} 52.39300 0.78700 0.78700 ? 0.00000 {?} 13.59340 0.11170 0 {?} 0 236 {327.HB1} 3.14800 0.05600 0.10500 ++ 0.00000 {?} {327.HA} 5.48300 0.06800 0.15600 ? 0.00000 {?} {327.CA} 52.41700 0.78700 0.78700 ? 0.00000 {?} 9.86670 0.17360 0 {?} 0 237 {327.HB2} 2.79800 0.09700 0.09700 ++ 0.00000 {?} {327.HA} 5.47800 0.15500 0.15500 ++ 0.00000 {?} {327.CA} 52.37400 0.15600 0.15600 ++ 0.00000 {?} 9.73280 0.19730 0 {?} 0 238 {310.HG21} 1.26100 0.06800 0.06800 ++ 0.00000 {?} {382.HA} 4.60000 0.09900 0.09900 ++ 0.00000 {?} {382.CA} 52.39200 0.78700 0.78700 ? 0.00000 {?} 22.63990 0.24680 0 {?} 0 239 {382.HG} 0.95300 0.09000 0.09000 ++ 0.00000 {?} {382.HA} 4.60600 0.11600 0.11600 ? 0.00000 {?} {382.CA} 52.42500 0.78700 0.78700 ? 0.00000 {?} 25.14280 0.20850 0 {?} 0 240 {382.HD21} 0.06900 0.08500 0.10200 ++ 0.00000 {?} {382.HA} 4.61400 0.16400 0.20700 ++ 0.00000 {?} {382.CA} 52.30300 0.78700 0.78700 ? 0.00000 {?} 37.28680 0.29640 0 {?} 0 241 {313.HB1} 3.37600 0.13500 0.11900 ++ 0.00000 {?} {313.HA} 4.83300 0.14800 0.14800 ++ 0.00000 {?} {313.CA} 52.06100 0.49900 0.78700 ? 0.00000 {?} 8.10920 0.09060 0 {?} 0 242 {313.HB2} 2.86100 0.10500 0.10500 ++ 0.00000 {?} {313.HA} 4.83900 0.15800 0.14800 ++ 0.00000 {?} {313.CA} 52.11000 0.78700 0.78700 ? 0.00000 {?} 14.46940 0.11630 0 {?} 0 243 {380.HB1} 1.24500 0.04500 0.07300 ++ 0.00000 {?} {380.HA} 4.44400 0.09700 0.16800 ++ 0.00000 {?} {380.CA} 51.25200 0.78700 0.78700 ? 0.00000 {?} 16.64210 0.25190 0 {?} 0 244 {379.HA} 4.55600 0.06700 0.06700 ++ 0.00000 {?} {379.HD1} 3.83800 0.15400 0.15400 ++ 0.00000 {?} {379.CD} 50.97300 0.22400 0.78700 ? 0.00000 {?} 8.31610 0.20410 0 {?} 0 245 {376.HA} 4.71100 0.05500 0.05500 ? 0.00000 {?} {377.HD1} 3.93700 0.08300 0.14900 ? 0.00000 {?} {377.CD} 50.81700 0.78700 0.78700 ? 0.00000 {?} 24.49680 0.33850 0 {?} 0 246 {376.HA} 4.71000 0.06100 0.06100 ? 0.00000 {?} {377.HD2} 3.65700 0.11300 0.14600 ? 0.00000 {?} {377.CD} 50.72400 0.78700 0.78700 ? 0.00000 {?} 34.10120 0.40060 0 {?} 0 247 {377.HD1} 3.94600 0.06100 0.10300 ++ 0.00000 {?} {377.HD2} 3.64800 0.09600 0.17000 ++ 0.00000 {?} {377.CD} 50.79600 0.78700 0.78700 ? 0.00000 {?} 49.92850 0.64800 0 {?} 0 248 {377.HD2} 3.65400 0.05400 0.09300 ++ 0.00000 {?} {377.HD1} 3.94000 0.09400 0.23600 ? 0.00000 {?} {377.CD} 50.79900 0.78700 0.78700 ? 0.00000 {?} 36.71880 0.54500 0 {?} 0 249 {379.HG1} 2.05700 0.06600 0.09200 ++ 0.00000 {?} {379.HD1} 3.84200 0.07300 0.16100 ? 0.00000 {?} {379.CD} 50.92600 0.78700 0.78700 ? 0.00000 {?} 32.67130 0.45950 0 {?} 0 250 {377.HG1} 2.04100 0.05700 0.07900 ++ 0.00000 {?} {377.HD1} 3.94600 0.09400 0.19300 ? 0.00000 {?} {377.CD} 50.80700 0.78700 0.78700 ? 0.00000 {?} 31.46200 0.41430 0 {?} 0 251 {377.HG1} 2.04200 0.06000 0.09700 ++ 0.00000 {?} {377.HD2} 3.65400 0.11300 0.17500 ? 0.00000 {?} {377.CD} 50.75400 0.78700 0.78700 ? 0.00000 {?} 53.98060 0.57960 0 {?} 0 252 {376.HB1} 1.64500 0.08900 0.08900 ++ 0.00000 {?} {377.HD2} 3.65000 0.12900 0.12900 ++ 0.00000 {?} {377.CD} 50.76800 0.41800 0.78700 ? 0.00000 {?} 14.03020 0.21540 0 {?} 0 253 {372.HA} 4.46900 0.07800 0.07800 ++ 0.00000 {?} {372.HD1} 3.67500 0.16000 0.16000 ++ 0.00000 {?} {372.CD} 49.80900 0.44500 0.44500 ? 0.00000 {?} 19.59080 0.26630 0 {?} 0 254 {370.HA} 4.35100 0.08700 0.10700 ? 0.00000 {?} {372.HD1} 3.69800 0.24300 0.20900 ++ 0.00000 {?} {372.CD} 49.69000 0.78700 0.78700 ? 0.00000 {?} 48.13120 0.32480 0 {?} 0 255 {371.HA1} 4.22900 0.06200 0.12700 ? 0.00000 {?} {372.HD1} 3.66600 0.08300 0.14900 ++ 0.00000 {?} {372.CD} 49.79500 0.78700 0.78700 ? 0.00000 {?} 78.71230 1.10360 0 {?} 0 256 {371.HA2} 4.08500 0.06400 0.11100 ++ 0.00000 {?} {372.HD1} 3.66900 0.08100 0.14500 ++ 0.00000 {?} {372.CD} 49.79500 0.78700 0.78700 ? 0.00000 {?} 75.07910 1.07370 0 {?} 0 257 {373.HA2} 3.93400 0.09800 0.07800 ++ 0.00000 {?} {372.HD1} 3.69400 0.16600 0.14000 ++ 0.00000 {?} {372.CD} 49.72900 0.78700 0.78700 ? 0.00000 {?} 25.93830 0.30060 0 {?} 0 258 {372.HB1} 2.33900 0.08700 0.08700 ++ 0.00000 {?} {372.HD1} 3.66900 0.16600 0.16600 ++ 0.00000 {?} {372.CD} 49.79900 0.78700 0.78700 ? 0.00000 {?} 34.83240 0.35390 0 {?} 0 259 {372.HG1} 2.08100 0.02900 0.07400 ? 0.00000 {?} {372.HD1} 3.67200 0.07300 0.15900 ++ 0.00000 {?} {372.CD} 49.79200 0.78700 0.78700 ? 0.00000 {?} 59.70780 1.65170 0 {?} 0 260 {309.HB1} 1.68200 0.06700 0.06700 ? 0.00000 {?} {309.HB2} 1.32800 0.13600 0.13600 ? 0.00000 {?} {309.CB} 46.44500 0.02200 0.02200 ? 0.00000 {?} 6.97920 0.19020 0 {?} 0 261 {390.HG21} 1.21400 0.05000 0.05000 ++ 0.00000 {?} {309.HB1} 1.68200 0.15100 0.13800 ++ 0.00000 {?} {309.CB} 46.48200 0.51500 0.51500 ? 0.00000 {?} 5.91740 0.11790 0 {?} 0 262 {309.HD11} 0.77300 0.09700 0.08500 ++ 0.00000 {?} {309.HB1} 1.68500 0.15800 0.13200 ++ 0.00000 {?} {309.CB} 46.46500 0.52100 0.52100 ? 0.00000 {?} 14.41240 0.26340 0 {?} 0 263 {316.HG21} 1.03800 0.07700 0.07700 ++ 0.00000 {?} {309.HB2} 1.33000 0.11600 0.11600 ++ 0.00000 {?} {309.CB} 46.45500 0.51500 0.51500 ? 0.00000 {?} 8.95540 0.11680 0 {?} 0 264 {391.HA1} 4.14600 0.01600 0.08900 ? 0.00000 {?} {391.HA2} 4.00400 0.10400 0.17100 ? 0.00000 {?} {391.CA} 45.25900 0.78700 0.78700 ? 0.00000 {?} 47.94790 1.48170 0 {?} 0 265 {382.HD21} 0.08300 0.10900 0.10900 ++ 0.00000 {?} {382.HB2} 1.02200 0.19500 0.19500 ++ 0.00000 {?} {382.CB} 45.39800 0.33000 0.33000 ? 0.00000 {?} 13.14790 0.18510 0 {?} 0 266 {337.HA1} 4.40100 0.07700 0.11600 ++ 0.00000 {?} {337.HA2} 3.58700 0.12100 0.18500 ++ 0.00000 {?} {337.CA} 44.98000 0.78700 0.78700 ? 0.00000 {?} 77.90430 0.69490 0 {?} 0 267 {337.HA2} 3.58800 0.07300 0.11200 ++ 0.00000 {?} {337.HA1} 4.40200 0.11500 0.18100 ++ 0.00000 {?} {337.CA} 44.99200 0.78700 0.78700 ? 0.00000 {?} 73.83590 0.69050 0 {?} 0 268 {303.HB1} 1.70800 0.07600 0.09700 ++ 0.00000 {?} {303.HB2} 1.31000 0.10200 0.13000 ++ 0.00000 {?} {303.CB} 44.95700 0.78700 0.78700 ? 0.00000 {?} 65.58280 0.71520 0 {?} 0 269 {303.HB2} 1.30600 0.06200 0.07200 ++ 0.00000 {?} {303.HB1} 1.69000 0.08200 0.09900 ++ 0.00000 {?} {303.CB} 44.95500 0.78700 0.78700 ? 0.00000 {?} 39.34840 0.49740 0 {?} 0 270 {382.HG} 0.96000 0.05500 0.06800 ++ 0.00000 {?} {382.HB1} 1.28700 0.09900 0.12600 ++ 0.00000 {?} {382.CB} 45.30700 0.78700 0.78700 ? 0.00000 {?} 13.71180 0.16080 0 {?} 0 271 {303.HD11} 0.74200 0.06100 0.07300 ++ 0.00000 {?} {303.HB1} 1.69600 0.12100 0.14600 ++ 0.00000 {?} {303.CB} 44.94800 0.78700 0.78700 ? 0.00000 {?} 51.48880 0.57090 0 {?} 0 272 {303.HD11} 0.74400 0.06200 0.09000 ++ 0.00000 {?} {303.HB2} 1.31000 0.10500 0.12800 ++ 0.00000 {?} {303.CB} 44.95500 0.78700 0.78700 ? 0.00000 {?} 48.78860 0.57200 0 {?} 0 273 {303.HD21} 0.61500 0.06900 0.06900 ++ 0.00000 {?} {303.HB1} 1.69900 0.12500 0.12500 ++ 0.00000 {?} {303.CB} 44.95600 0.34400 0.78700 ? 0.00000 {?} 8.55870 0.26660 0 {?} 0 274 {303.HD21} 0.61200 0.06700 0.06700 ++ 0.00000 {?} {303.HB2} 1.31800 0.13900 0.13900 ++ 0.00000 {?} {303.CB} 44.94800 0.39100 0.78700 ? 0.00000 {?} 11.81860 0.32510 0 {?} 0 275 {305.HA1} 4.50200 0.11800 0.11800 ++ 0.00000 {?} {305.HA2} 3.42500 0.19400 0.17000 ++ 0.00000 {?} {305.CA} 44.34500 0.78700 0.78700 ? 0.00000 {?} 43.93090 0.32340 0 {?} 0 276 {371.HA1} 4.23300 0.05800 0.11300 ++ 0.00000 {?} {371.HA2} 4.07600 0.12100 0.23600 ? 0.00000 {?} {371.CA} 44.36900 0.78700 0.78700 ? 0.00000 {?} 158.45081 1.74310 0 {?} 0 277 {371.HA2} 4.08300 0.06200 0.11600 ++ 0.00000 {?} {371.HA1} 4.23600 0.11200 0.23600 ? 0.00000 {?} {371.CA} 44.36100 0.78700 0.78700 ? 0.00000 {?} 140.97411 1.55290 0 {?} 0 278 {372.HD1} 3.67400 0.03600 0.06200 ++ 0.00000 {?} {371.HA1} 4.23100 0.08700 0.13500 ? 0.00000 {?} {371.CA} 44.35300 0.78700 0.78700 ? 0.00000 {?} 43.77840 0.87440 0 {?} 0 279 {372.HD1} 3.67000 0.04900 0.08000 ++ 0.00000 {?} {371.HA2} 4.08500 0.09400 0.17400 ? 0.00000 {?} {371.CA} 44.38600 0.78700 0.78700 ? 0.00000 {?} 60.46410 0.92120 0 {?} 0 280 {305.HA2} 3.43100 0.10100 0.10200 ++ 0.00000 {?} {305.HA1} 4.50000 0.23600 0.23600 ++ 0.00000 {?} {305.CA} 44.32500 0.78700 0.78700 ? 0.00000 {?} 61.94710 0.36780 0 {?} 0 281 {378.HA1} 4.35000 0.06800 0.08200 ++ 0.00000 {?} {378.HA2} 3.92900 0.10800 0.12700 ++ 0.00000 {?} {378.CA} 44.09600 0.78700 0.78700 ? 0.00000 {?} 29.89870 0.30510 0 {?} 0 282 {378.HA2} 3.93100 0.07000 0.08000 ++ 0.00000 {?} {378.HA1} 4.35200 0.11200 0.12800 ++ 0.00000 {?} {378.CA} 44.10800 0.78700 0.78700 ? 0.00000 {?} 30.04390 0.30490 0 {?} 0 283 {?} 3.72400 0.05700 0.05700 ++ 0.00000 {?} {?} 3.92900 0.12900 0.12900 ++ 0.00000 {?} {?} 44.04100 0.19100 0.19100 ++ 0.00000 {?} 5.62490 0.13790 0 {?} 0 284 {343.HA} 4.20500 0.09400 0.09400 ++ 0.00000 {?} {343.HB1} 1.83900 0.11400 0.11400 ++ 0.00000 {?} {343.CB} 43.72300 0.49000 0.78700 ? 0.00000 {?} 18.09660 0.23320 0 {?} 0 285 {343.HA} 4.20500 0.11800 0.09000 ++ 0.00000 {?} {343.HB2} 1.57400 0.15800 0.16000 ++ 0.00000 {?} {343.CB} 43.69100 0.78700 0.78700 ? 0.00000 {?} 31.07250 0.31850 0 {?} 0 286 {320.HB1} 2.77400 0.09500 0.08300 ++ 0.00000 {?} {320.HB2} 2.47900 0.15300 0.13200 ++ 0.00000 {?} {320.CB} 43.77700 0.78700 0.78700 ? 0.00000 {?} 22.23240 0.30340 0 {?} 0 287 {320.HB2} 2.47900 0.09600 0.09800 ++ 0.00000 {?} {320.HB1} 2.77800 0.15200 0.15300 ++ 0.00000 {?} {320.CB} 43.77300 0.78700 0.78700 ? 0.00000 {?} 43.31590 0.33080 0 {?} 0 288 {343.HB1} 1.83500 0.06000 0.09100 ++ 0.00000 {?} {343.HB2} 1.56900 0.09400 0.15100 ++ 0.00000 {?} {343.CB} 43.70600 0.78700 0.78700 ? 0.00000 {?} 55.58390 0.81210 0 {?} 0 289 {343.HG} 1.66700 0.05000 0.05000 ++ 0.00000 {?} {343.HB1} 1.84300 0.11000 0.11000 ++ 0.00000 {?} {343.CB} 43.70300 0.78700 0.78700 ? 0.00000 {?} 16.46990 0.35900 0 {?} 0 290 {354.HG21} 0.81600 0.05000 0.07000 ++ 0.00000 {?} {343.HB2} 1.55600 0.08700 0.12500 ++ 0.00000 {?} {343.CB} 43.64600 0.52300 0.78700 ? 0.00000 {?} 6.02410 0.12720 0 {?} 0 291 {343.HB2} 1.57700 0.05400 0.08900 ++ 0.00000 {?} {343.HB1} 1.83700 0.08900 0.13800 ++ 0.00000 {?} {343.CB} 43.71800 0.78700 0.78700 ? 0.00000 {?} 51.44440 0.79780 0 {?} 0 292 {343.HD11} 1.04600 0.03300 0.05400 ? 0.00000 {?} {343.HB1} 1.84300 0.17500 0.17500 ++ 0.00000 {?} {343.CB} 43.72700 0.78700 0.78700 ? 0.00000 {?} 17.14330 0.24860 0 {?} 0 293 {343.HD11} 1.04100 0.04500 0.07000 ? 0.00000 {?} {343.HB2} 1.56500 0.16400 0.15400 ++ 0.00000 {?} {343.CB} 43.72500 0.78700 0.78700 ? 0.00000 {?} 27.74420 0.40420 0 {?} 0 294 {343.HD21} 0.98700 0.05000 0.05800 ? 0.00000 {?} {343.HB1} 1.83700 0.14700 0.17300 ++ 0.00000 {?} {343.CB} 43.71400 0.78700 0.78700 ? 0.00000 {?} 29.44670 0.40370 0 {?} 0 295 {343.HD21} 0.99000 0.03600 0.03800 ? 0.00000 {?} {343.HB2} 1.57400 0.11800 0.12700 ++ 0.00000 {?} {343.CB} 43.70900 0.78700 0.78700 ? 0.00000 {?} 23.49660 0.44130 0 {?} 0 296 {347.HA} 4.16000 0.07100 0.09100 ++ 0.00000 {?} {347.HD1} 3.21800 0.12400 0.15800 ++ 0.00000 {?} {347.CD} 43.48900 0.78700 0.78700 ? 0.00000 {?} 58.72770 0.60350 0 {?} 0 297 {347.HB1} 2.12100 0.07100 0.09100 ? 0.00000 {?} {347.HD1} 3.21500 0.11300 0.14900 ++ 0.00000 {?} {347.CD} 43.49000 0.78700 0.78700 ? 0.00000 {?} 50.13650 0.57030 0 {?} 0 298 {347.HB2} 1.99600 0.06900 0.09400 ? 0.00000 {?} {347.HD1} 3.21500 0.14400 0.17300 ++ 0.00000 {?} {347.CD} 43.48200 0.78700 0.78700 ? 0.00000 {?} 59.63960 0.53360 0 {?} 0 299 {318.HG1} 1.33300 0.07700 0.07700 ++ 0.00000 {?} {318.HD2} 3.23000 0.14900 0.13400 ? 0.00000 {?} {318.CD} 43.35500 0.78700 0.78700 ? 0.00000 {?} 30.97660 0.37040 0 {?} 0 300 {275.HA} 4.42500 0.03400 0.07000 ? 0.00000 {?} {275.HD1} 3.21600 0.10700 0.16100 ++ 0.00000 {?} {275.CD} 43.26900 0.78700 0.78700 ? 0.00000 {?} 45.09390 0.93170 0 {?} 0 301 {397.HA} 4.37200 0.06100 0.09100 ? 0.00000 {?} {397.HD1} 3.22700 0.12000 0.20400 ++ 0.00000 {?} {397.CD} 43.26500 0.78700 0.78700 ? 0.00000 {?} 121.42370 1.48980 0 {?} 0 302 {?} 4.27200 0.04800 0.05300 ++ 0.00000 {?} {?} 3.96900 0.13800 0.15000 ++ 0.00000 {?} {?} 43.27500 0.78700 0.78700 ? 0.00000 {?} 43.79950 0.75900 0 {?} 0 303 {?} 3.52500 0.08200 0.10100 ++ 0.00000 {?} {?} 3.22000 0.12700 0.17000 ++ 0.00000 {?} {?} 43.26100 0.78700 0.78700 ? 0.00000 {?} 161.95180 1.56780 0 {?} 0 304 {321.HB1} 2.69500 0.08100 0.08300 ++ 0.00000 {?} {321.HB2} 2.24400 0.17500 0.18000 ++ 0.00000 {?} {321.CB} 43.29200 0.78700 0.78700 ? 0.00000 {?} 48.63890 0.38090 0 {?} 0 305 {321.HB2} 2.25000 0.10200 0.11200 ++ 0.00000 {?} {321.HB1} 2.69100 0.14500 0.16100 ++ 0.00000 {?} {321.CB} 43.31100 0.78700 0.78700 ? 0.00000 {?} 48.75510 0.37440 0 {?} 0 306 {397.HB1} 1.88100 0.02800 0.08300 ? 0.00000 {?} {397.HD1} 3.22000 0.08700 0.21900 ++ 0.00000 {?} {397.CD} 43.26300 0.78700 0.78700 ? 0.00000 {?} 117.68900 3.00650 0 {?} 0 307 {347.HG1} 1.79800 0.04600 0.07600 ? 0.00000 {?} {347.HD1} 3.22000 0.07000 0.21200 ? 0.00000 {?} {347.CD} 43.30500 0.78700 0.78700 ? 0.00000 {?} 172.19450 3.86190 0 {?} 0 308 {275.HG1} 1.63700 0.04300 0.14500 ? 0.00000 {?} {275.HD1} 3.22000 0.09400 0.28100 ? 0.00000 {?} {275.CD} 43.29100 0.78700 0.78700 ? 0.00000 {?} 409.12329 7.15540 0 {?} 0 309 {376.HD11} 0.93200 0.08600 0.09300 ++ 0.00000 {?} {397.HD1} 3.22000 0.15200 0.16600 ++ 0.00000 {?} {397.CD} 43.26300 0.78700 0.78700 ? 0.00000 {?} 50.40190 0.41810 0 {?} 0 310 {307.HG21} 0.79600 0.06800 0.08000 ++ 0.00000 {?} {318.HD2} 3.22300 0.16300 0.18900 ++ 0.00000 {?} {318.CD} 43.28200 0.78700 0.78700 ? 0.00000 {?} 37.20470 0.36280 0 {?} 0 311 {363.HG11} 0.77700 0.07800 0.07800 ++ 0.00000 {?} {321.HB2} 2.24100 0.18100 0.18100 ++ 0.00000 {?} {321.CB} 43.23500 0.26500 0.26500 ++ 0.00000 {?} 8.22420 0.17280 0 {?} 0 312 {392.HA} 4.58800 0.06900 0.07000 ++ 0.00000 {?} {392.HB1} 1.70500 0.10400 0.14800 ? 0.00000 {?} {392.CB} 42.64600 0.78700 0.78700 ? 0.00000 {?} 35.73110 0.40490 0 {?} 0 313 {392.HA} 4.58800 0.05300 0.05800 ++ 0.00000 {?} {392.HB2} 1.56800 0.12600 0.13500 ? 0.00000 {?} {392.CB} 42.65700 0.78700 0.78700 ? 0.00000 {?} 46.08090 0.52800 0 {?} 0 314 {307.HG21} 0.79700 0.07200 0.07200 ++ 0.00000 {?} {392.HB2} 1.56600 0.18300 0.18300 ++ 0.00000 {?} {392.CB} 42.52900 0.78700 0.78700 ? 0.00000 {?} 39.67570 0.25900 0 {?} 0 315 {274.HA} 4.41900 0.05100 0.09000 ++ 0.00000 {?} {274.HB2} 1.62400 0.11200 0.18600 ? 0.00000 {?} {274.CB} 42.33800 0.78700 0.78700 ? 0.00000 {?} 98.44190 1.25080 0 {?} 0 316 {356.HB1} 3.04200 0.11200 0.11200 ++ 0.00000 {?} {356.HB2} 2.37700 0.21200 0.21200 ++ 0.00000 {?} {356.CB} 42.30500 0.46400 0.78700 ? 0.00000 {?} 40.52980 0.25840 0 {?} 0 317 {376.HD21} 0.93100 0.07000 0.11600 ++ 0.00000 {?} {376.HB1} 1.64100 0.14400 0.23600 ? 0.00000 {?} {376.CB} 42.32900 0.78700 0.78700 ? 0.00000 {?} 292.90790 2.35280 0 {?} 0 318 {307.HG21} 0.80400 0.05600 0.05600 ++ 0.00000 {?} {392.HB1} 1.71100 0.11600 0.10700 ++ 0.00000 {?} {392.CB} 42.52000 0.78700 0.78700 ? 0.00000 {?} 21.16000 0.31190 0 {?} 0 319 {376.HA} 4.70800 0.05500 0.06800 ? 0.00000 {?} {376.HB1} 1.63900 0.10600 0.14000 ++ 0.00000 {?} {376.CB} 42.19800 0.78700 0.78700 ? 0.00000 {?} 37.48320 0.53010 0 {?} 0 320 {315.HA} 4.51900 0.07600 0.07600 ++ 0.00000 {?} {315.HE1} 2.98100 0.14400 0.14400 ++ 0.00000 {?} {315.CE} 42.12900 0.38800 0.78700 ? 0.00000 {?} 14.82920 0.28560 0 {?} 0 321 {399.HA} 4.41000 0.04500 0.06300 ++ 0.00000 {?} {399.HB1} 2.66100 0.10400 0.15200 ++ 0.00000 {?} {399.CB} 42.17100 0.78700 0.78700 ? 0.00000 {?} 53.41870 0.98220 0 {?} 0 322 {377.HD2} 3.95100 0.08900 0.08900 ++ 0.00000 {?} {376.HB1} 1.63700 0.14800 0.14800 ++ 0.00000 {?} {376.CB} 42.26600 0.25100 0.25100 ? 0.00000 {?} 7.95350 0.16970 0 {?} 0 323 {377.HD1} 3.64800 0.09900 0.09900 ++ 0.00000 {?} {376.HB1} 1.63400 0.17000 0.17000 ++ 0.00000 {?} {376.CB} 42.23500 0.78700 0.78700 ? 0.00000 {?} 34.28630 0.27530 0 {?} 0 324 {389.HD21} 0.64400 0.08200 0.09700 ++ 0.00000 {?} {389.HB1} 1.71900 0.13600 0.17000 ? 0.00000 {?} {389.CB} 42.01500 0.78700 0.78700 ? 0.00000 {?} 72.50920 0.58490 0 {?} 0 325 {358.HA} 4.59800 0.06100 0.06100 ++ 0.00000 {?} {358.HE1} 3.04000 0.10700 0.10700 ++ 0.00000 {?} {358.CE} 41.87100 0.07900 0.07900 ++ 0.00000 {?} 5.09760 0.18320 0 {?} 0 326 {306.HA} 4.39800 0.08600 0.08600 ++ 0.00000 {?} {306.HB2} 1.36000 0.17500 0.17500 ++ 0.00000 {?} {306.CB} 41.93500 0.22300 0.22300 ++ 0.00000 {?} 11.42650 0.24250 0 {?} 0 327 {395.HA} 4.31800 0.07000 0.06600 ++ 0.00000 {?} {395.HE1} 3.01400 0.11700 0.10900 ++ 0.00000 {?} {395.CE} 41.88300 0.78700 0.78700 ? 0.00000 {?} 21.43160 0.39210 0 {?} 0 328 {?} 4.19600 0.05300 0.11600 ? 0.00000 {?} {?} 3.03500 0.13400 0.14900 ++ 0.00000 {?} {?} 41.93500 0.78700 0.78700 ? 0.00000 {?} 17.86640 0.23640 0 {?} 0 329 {301.HA} 4.06800 0.08200 0.09900 ? 0.00000 {?} {301.HE1} 3.03200 0.10900 0.13000 ++ 0.00000 {?} {301.CE} 41.95700 0.78700 0.78700 ? 0.00000 {?} 48.55590 0.45490 0 {?} 0 330 {301.HB1} 1.98900 0.02900 0.08100 ? 0.00000 {?} {301.HE1} 3.04400 0.05200 0.14700 ? 0.00000 {?} {301.CE} 41.93800 0.78700 0.78700 ? 0.00000 {?} 10.10280 0.39640 0 {?} 0 331 {348.HB1} 1.91500 0.03700 0.08200 ? 0.00000 {?} {348.HE1} 2.98900 0.11500 0.13700 ? 0.00000 {?} {348.CE} 41.86000 0.78700 0.78700 ? 0.00000 {?} 42.50890 0.68320 0 {?} 0 332 {306.HB1} 1.85700 0.06800 0.08700 ++ 0.00000 {?} {306.HB2} 1.36400 0.09100 0.12100 ++ 0.00000 {?} {306.CB} 41.90700 0.78700 0.78700 ? 0.00000 {?} 47.06070 0.55450 0 {?} 0 333 {?} 1.70200 0.02200 0.05900 ? 0.00000 {?} {?} 3.00300 0.06000 0.16400 ? 0.00000 {?} {?} 41.89700 0.78700 0.78700 ? 0.00000 {?} 147.45360 6.69440 0 {?} 0 334 {315.HD1} 1.64600 0.02600 0.07000 ? 0.00000 {?} {315.HE1} 2.97100 0.04200 0.12700 ? 0.00000 {?} {315.CE} 41.97000 0.78700 0.78700 ? 0.00000 {?} 80.71210 4.31010 0 {?} 0 335 {?} 1.54000 0.04700 0.07500 ? 0.00000 {?} {?} 3.01100 0.07300 0.16300 ? 0.00000 {?} {?} 41.92200 0.78700 0.78700 ? 0.00000 {?} 80.05040 1.54620 0 {?} 0 336 {?} 1.46200 0.05100 0.08200 ? 0.00000 {?} {?} 3.00500 0.06500 0.17200 ? 0.00000 {?} {?} 41.91600 0.78700 0.78700 ? 0.00000 {?} 115.78520 2.21920 0 {?} 0 337 {315.HB2} 1.36200 0.04700 0.10600 ? 0.00000 {?} {315.HE1} 2.96800 0.09100 0.16300 ++ 0.00000 {?} {315.CE} 41.89000 0.78700 0.78700 ? 0.00000 {?} 92.91370 1.47740 0 {?} 0 338 {306.HB2} 1.35800 0.07300 0.07600 ++ 0.00000 {?} {306.HB1} 1.86700 0.10900 0.11300 ++ 0.00000 {?} {306.CB} 41.90500 0.78700 0.78700 ? 0.00000 {?} 38.22190 0.41760 0 {?} 0 339 {294.HG1} 1.15300 0.07200 0.12200 ? 0.00000 {?} {294.HE1} 2.95900 0.07200 0.12400 ++ 0.00000 {?} {294.CE} 41.99800 0.78700 0.78700 ? 0.00000 {?} 75.75610 1.19890 0 {?} 0 340 {?} 0.94700 0.06800 0.07400 ? 0.00000 {?} {?} 3.02100 0.12100 0.10200 ++ 0.00000 {?} {?} 42.01200 0.46400 0.46400 ? 0.00000 {?} 12.11820 0.28190 0 {?} 0 341 {307.HG11} 0.80200 0.05400 0.06400 ? 0.00000 {?} {395.HE1} 3.02400 0.10800 0.13400 ++ 0.00000 {?} {395.CE} 41.89000 0.78700 0.78700 ? 0.00000 {?} 30.86660 0.41460 0 {?} 0 342 {306.HD21} 0.80200 0.07600 0.09200 ++ 0.00000 {?} {306.HB1} 1.87100 0.10900 0.13800 ++ 0.00000 {?} {306.CB} 41.90200 0.78700 0.78700 ? 0.00000 {?} 54.58040 0.54620 0 {?} 0 343 {306.HD21} 0.80100 0.06300 0.08400 ++ 0.00000 {?} {306.HB2} 1.36200 0.09900 0.13400 ++ 0.00000 {?} {306.CB} 41.90400 0.78700 0.78700 ? 0.00000 {?} 51.13780 0.61690 0 {?} 0 344 {389.HD21} 0.64500 0.06000 0.07000 ++ 0.00000 {?} {389.HB2} 1.58500 0.13100 0.16000 ? 0.00000 {?} {389.CB} 42.01500 0.78700 0.78700 ? 0.00000 {?} 59.83490 0.61510 0 {?} 0 345 {306.HD11} 0.63100 0.07900 0.07900 ++ 0.00000 {?} {306.HB1} 1.88100 0.12300 0.12300 ++ 0.00000 {?} {306.CB} 41.90900 0.05400 0.05400 ++ 0.00000 {?} 9.74260 0.22190 0 {?} 0 346 {306.HD11} 0.63100 0.07300 0.07300 ? 0.00000 {?} {306.HB2} 1.36800 0.13500 0.13500 ? 0.00000 {?} {306.CB} 41.91300 0.04400 0.04400 ++ 0.00000 {?} 7.67170 0.21070 0 {?} 0 347 {334.HA} 4.36600 0.07000 0.07000 ++ 0.00000 {?} {334.HE1} 2.89800 0.12300 0.12300 ++ 0.00000 {?} {334.CE} 41.37000 0.48000 0.48000 ++ 0.00000 {?} 12.43610 0.11660 0 {?} 0 348 {394.HA} 4.69900 0.03800 0.05800 ++ 0.00000 {?} {394.HB1} 2.62700 0.06000 0.13800 ? 0.00000 {?} {394.CB} 41.28200 0.78700 0.78700 ? 0.00000 {?} 33.93900 0.95590 0 {?} 0 349 {311.HE1} 2.59000 0.05500 0.09400 ++ 0.00000 {?} {311.HE2} 2.14200 0.08500 0.16700 ++ 0.00000 {?} {311.CE} 41.28200 0.78700 0.78700 ? 0.00000 {?} 16.57210 0.21670 0 {?} 0 350 {311.HE2} 2.14200 0.06100 0.09900 ++ 0.00000 {?} {311.HE1} 2.58900 0.08200 0.15600 ++ 0.00000 {?} {311.CE} 41.28000 0.78700 0.78700 ? 0.00000 {?} 26.96840 0.35200 0 {?} 0 351 {329.HB1} 2.10200 0.09300 0.11600 ++ 0.00000 {?} {329.HE1} 3.10800 0.14100 0.16700 ++ 0.00000 {?} {329.CE} 41.47900 0.78700 0.78700 ? 0.00000 {?} 56.90020 0.48730 0 {?} 0 352 {334.HB1} 2.01000 0.08600 0.08600 ++ 0.00000 {?} {334.HE1} 2.88700 0.15200 0.11900 ++ 0.00000 {?} {334.CE} 41.42700 0.78700 0.78700 ? 0.00000 {?} 15.23220 0.15090 0 {?} 0 353 {329.HD1} 1.87400 0.05500 0.12200 ? 0.00000 {?} {329.HE1} 3.10300 0.08000 0.19500 ? 0.00000 {?} {329.CE} 41.47200 0.78700 0.78700 ? 0.00000 {?} 83.02760 1.45300 0 {?} 0 354 {311.HD1} 1.47700 0.09000 0.09000 ++ 0.00000 {?} {311.HE1} 2.58600 0.17200 0.12500 ++ 0.00000 {?} {311.CE} 41.30400 0.45200 0.78700 ? 0.00000 {?} 9.89900 0.17250 0 {?} 0 355 {311.HD1} 1.46700 0.07400 0.07400 ++ 0.00000 {?} {311.HE2} 2.10500 0.14300 0.14300 ++ 0.00000 {?} {311.CE} 41.26700 0.11700 0.78700 ? 0.00000 {?} 1.87910 0.04350 0 {?} 0 356 {311.HG1} 1.24500 0.06300 0.07700 ++ 0.00000 {?} {311.HE1} 2.59100 0.09200 0.12500 ++ 0.00000 {?} {311.CE} 41.29900 0.78700 0.78700 ? 0.00000 {?} 31.84980 0.35100 0 {?} 0 357 {311.HG1} 1.25000 0.09700 0.10500 ++ 0.00000 {?} {311.HE2} 2.14400 0.10600 0.11900 ++ 0.00000 {?} {311.CE} 41.25700 0.78700 0.78700 ? 0.00000 {?} 16.23490 0.09300 0 {?} 0 358 {357.HD11} 0.99500 0.06500 0.09700 ++ 0.00000 {?} {329.HE1} 3.10900 0.09700 0.14400 ++ 0.00000 {?} {329.CE} 41.45100 0.78700 0.78700 ? 0.00000 {?} 63.37360 0.90980 0 {?} 0 359 {280.HD11} 0.95700 0.10000 0.09300 ++ 0.00000 {?} {280.HB1} 1.88100 0.18200 0.17000 ++ 0.00000 {?} {280.CB} 41.27200 0.78700 0.78700 ? 0.00000 {?} 37.13160 0.38430 0 {?} 0 360 {357.HD21} 0.80500 0.09400 0.09400 ++ 0.00000 {?} {329.HE1} 3.10500 0.11900 0.11900 ++ 0.00000 {?} {329.CE} 41.46900 0.43400 0.43400 ? 0.00000 {?} 16.71770 0.34200 0 {?} 0 361 {307.HG11} 0.79200 0.11300 0.12100 ++ 0.00000 {?} {394.HB2} 2.59000 0.21600 0.22600 ++ 0.00000 {?} {394.CB} 41.42200 0.78700 0.78700 ? 0.00000 {?} 56.62100 0.36410 0 {?} 0 362 {340.HG11} 0.43100 0.08100 0.08100 ++ 0.00000 {?} {334.HE2} 2.88700 0.19100 0.19100 ++ 0.00000 {?} {334.CE} 41.34500 0.50600 0.78700 ? 0.00000 {?} 6.05300 0.05410 0 {?} 0 363 {268.HA} 4.70200 0.05600 0.05300 ++ 0.00000 {?} {268.HB1} 2.73800 0.12900 0.14300 ? 0.00000 {?} {268.CB} 41.19300 0.78700 0.78700 ? 0.00000 {?} 43.71410 0.53500 0 {?} 0 364 {362.HA} 4.46800 0.06300 0.06300 ? 0.00000 {?} {322.HB} 1.42200 0.12400 0.12400 ++ 0.00000 {?} {322.CB} 40.87000 0.30700 0.30700 ++ 0.00000 {?} 1.81880 0.05450 0 {?} 0 365 {281.HA} 4.43600 0.07300 0.07300 ++ 0.00000 {?} {281.HB2} 2.86900 0.17700 0.17700 ++ 0.00000 {?} {281.CB} 40.81900 0.78700 0.78700 ? 0.00000 {?} 29.79810 0.27040 0 {?} 0 366 {281.HB1} 3.15400 0.07800 0.07800 ++ 0.00000 {?} {281.HB2} 2.86700 0.16200 0.16100 ++ 0.00000 {?} {281.CB} 40.81400 0.78700 0.78700 ? 0.00000 {?} 59.75540 0.49050 0 {?} 0 367 {281.HB2} 2.86500 0.07200 0.07300 ++ 0.00000 {?} {281.HB1} 3.16700 0.12600 0.12800 ++ 0.00000 {?} {281.CB} 40.84600 0.78700 0.78700 ? 0.00000 {?} 46.45330 0.44210 0 {?} 0 368 {322.HD11} 0.72000 0.08200 0.08200 ++ 0.00000 {?} {322.HB} 1.41600 0.14900 0.14900 ++ 0.00000 {?} {322.CB} 40.91800 0.32200 0.32200 ? 0.00000 {?} 15.35170 0.40900 0 {?} 0 369 {322.HG21} -0.51400 0.11100 0.11100 ++ 0.00000 {?} {322.HB} 1.42300 0.17700 0.17700 ++ 0.00000 {?} {322.CB} 40.90400 0.41600 0.41600 ? 0.00000 {?} 33.67800 0.39330 0 {?} 0 370 {357.HD11} 0.99800 0.06300 0.06500 ++ 0.00000 {?} {357.HB1} 1.76800 0.22600 0.23100 ++ 0.00000 {?} {357.CB} 40.59300 0.78700 0.78700 ? 0.00000 {?} 56.01190 0.49510 0 {?} 0 371 {357.HD21} 0.80500 0.07700 0.07700 ++ 0.00000 {?} {357.HB1} 1.75900 0.23600 0.23600 ++ 0.00000 {?} {357.CB} 40.59100 0.17900 0.17900 ++ 0.00000 {?} 10.57300 0.25880 0 {?} 0 372 {323.HB1} 2.86700 0.11000 0.11000 ++ 0.00000 {?} {323.HB2} 2.10000 0.17800 0.17800 ++ 0.00000 {?} {323.CB} 40.21700 0.44200 0.78700 ? 0.00000 {?} 28.56330 0.25910 0 {?} 0 373 {323.HB2} 2.10500 0.12100 0.12100 ++ 0.00000 {?} {323.HB1} 2.86500 0.17800 0.17800 ++ 0.00000 {?} {323.CB} 40.21500 0.38100 0.78700 ? 0.00000 {?} 13.48350 0.23600 0 {?} 0 374 {336.HA} 4.51400 0.07300 0.07100 ++ 0.00000 {?} {336.HB1} 3.13400 0.15500 0.15300 ++ 0.00000 {?} {336.CB} 39.68900 0.78700 0.78700 ? 0.00000 {?} 20.50700 0.30070 0 {?} 0 375 {336.HA} 4.51600 0.07800 0.07800 ++ 0.00000 {?} {336.HB2} 2.66300 0.15300 0.15400 ++ 0.00000 {?} {336.CB} 39.68900 0.78700 0.78700 ? 0.00000 {?} 31.23200 0.29920 0 {?} 0 376 {336.HB1} 3.12900 0.07500 0.09400 ++ 0.00000 {?} {336.HB2} 2.65700 0.10700 0.13600 ++ 0.00000 {?} {336.CB} 39.73200 0.78700 0.78700 ? 0.00000 {?} 43.29760 0.39250 0 {?} 0 377 {336.HB2} 2.65900 0.06900 0.08300 ++ 0.00000 {?} {336.HB1} 3.12800 0.09800 0.11900 ++ 0.00000 {?} {336.CB} 39.73000 0.78700 0.78700 ? 0.00000 {?} 33.76420 0.37830 0 {?} 0 378 {286.HA} 4.15900 0.07500 0.07500 ++ 0.00000 {?} {286.HB2} 2.92700 0.18600 0.18600 ++ 0.00000 {?} {286.CB} 39.52800 0.14500 0.14500 ? 0.00000 {?} 10.74630 0.26760 0 {?} 0 379 {286.HB1} 3.18400 0.07600 0.08100 ++ 0.00000 {?} {286.HB2} 2.92200 0.10200 0.10900 ++ 0.00000 {?} {286.CB} 39.52900 0.78700 0.78700 ? 0.00000 {?} 44.24820 0.50880 0 {?} 0 380 {286.HB2} 2.92400 0.08800 0.09000 ++ 0.00000 {?} {286.HB1} 3.17800 0.11900 0.12300 ++ 0.00000 {?} {286.CB} 39.52700 0.78700 0.78700 ? 0.00000 {?} 56.40090 0.45740 0 {?} 0 381 {343.HD11} 1.04700 0.06800 0.06800 ++ 0.00000 {?} {354.HB} 1.67300 0.23000 0.18500 ++ 0.00000 {?} {354.CB} 39.52600 0.78700 0.78700 ? 0.00000 {?} 26.13660 0.32960 0 {?} 0 382 {354.HG21} 0.81100 0.09200 0.09200 ++ 0.00000 {?} {354.HB} 1.67000 0.16600 0.16600 ++ 0.00000 {?} {354.CB} 39.54000 0.78700 0.78700 ? 0.00000 {?} 37.46850 0.26810 0 {?} 0 383 {282.HB2} 3.30600 0.10800 0.10800 ++ 0.00000 {?} {282.HB1} 3.45300 0.13800 0.13800 ++ 0.00000 {?} {282.CB} 39.21400 0.25300 0.78700 ? 0.00000 {?} 22.05250 0.36130 0 {?} 0 384 {282.HB1} 3.46900 0.09800 0.09800 ++ 0.00000 {?} {282.HB2} 3.30900 0.13900 0.13900 ++ 0.00000 {?} {282.CB} 39.20900 0.78700 0.78700 ? 0.00000 {?} 52.40020 0.35330 0 {?} 0 385 {295.HB1} 3.33300 0.08200 0.08200 ? 0.00000 {?} {295.HB2} 2.98400 0.15200 0.15200 ? 0.00000 {?} {295.CB} 39.25900 0.02800 0.02800 ? 0.00000 {?} 10.27990 0.19660 0 {?} 0 386 {345.HB2} 3.11800 0.08400 0.08400 ++ 0.00000 {?} {345.HB1} 3.31200 0.12800 0.12800 ++ 0.00000 {?} {345.CB} 39.17900 0.30100 0.78700 ? 0.00000 {?} 3.33850 0.06530 0 {?} 0 387 {295.HB2} 3.00700 0.10100 0.10100 ++ 0.00000 {?} {295.HB1} 3.33100 0.14600 0.14600 ++ 0.00000 {?} {295.CB} 39.30000 0.42700 0.42700 ? 0.00000 {?} 20.92800 0.26210 0 {?} 0 388 {398.HB1} 2.87000 0.04100 0.08600 ++ 0.00000 {?} {398.HB2} 2.72500 0.07900 0.15000 ? 0.00000 {?} {398.CB} 39.33700 0.78700 0.78700 ? 0.00000 {?} 207.44839 4.33530 0 {?} 0 389 {398.HB2} 2.72400 0.04800 0.09600 ++ 0.00000 {?} {398.HB1} 2.86900 0.09000 0.20400 ? 0.00000 {?} {398.CB} 39.33300 0.78700 0.78700 ? 0.00000 {?} 231.82780 4.14250 0 {?} 0 390 {342.HA} 4.58100 0.06800 0.06800 ++ 0.00000 {?} {342.HB2} 3.16000 0.12900 0.12900 ++ 0.00000 {?} {342.CB} 38.22600 0.43600 0.78700 ? 0.00000 {?} 8.78760 0.13220 0 {?} 0 391 {281.HA} 4.43500 0.04100 0.06400 ? 0.00000 {?} {284.HB1} 3.30400 0.12500 0.12800 ++ 0.00000 {?} {284.CB} 38.74400 0.78700 0.78700 ? 0.00000 {?} 27.10960 0.42360 0 {?} 0 392 {284.HA} 4.35400 0.05500 0.10800 ? 0.00000 {?} {284.HB1} 3.30400 0.08600 0.13400 ++ 0.00000 {?} {284.CB} 38.79300 0.78700 0.78700 ? 0.00000 {?} 52.43200 0.76830 0 {?} 0 393 {285.HA} 4.52400 0.06300 0.06700 ++ 0.00000 {?} {285.HB1} 2.77400 0.08200 0.11300 ? 0.00000 {?} {285.CB} 38.26200 0.78700 0.78700 ? 0.00000 {?} 35.13950 0.45480 0 {?} 0 394 {285.HA} 4.52700 0.06800 0.08800 ? 0.00000 {?} {285.HB2} 2.67300 0.12300 0.14600 ? 0.00000 {?} {285.CB} 38.22600 0.78700 0.78700 ? 0.00000 {?} 53.96590 0.56370 0 {?} 0 395 {284.HA} 4.34700 0.07000 0.07000 ++ 0.00000 {?} {287.HB1} 2.81500 0.10400 0.10400 ++ 0.00000 {?} {287.CB} 38.25100 0.26500 0.26500 ++ 0.00000 {?} 6.53820 0.18100 0 {?} 0 396 {313.HB1} 3.37500 0.11800 0.11800 ++ 0.00000 {?} {313.HB2} 2.87100 0.16600 0.16600 ++ 0.00000 {?} {313.CB} 38.26200 0.34800 0.34800 ? 0.00000 {?} 13.21060 0.18600 0 {?} 0 397 {313.HB2} 2.85900 0.10900 0.10900 ++ 0.00000 {?} {313.HB1} 3.36300 0.19500 0.19500 ++ 0.00000 {?} {313.CB} 38.32000 0.24800 0.24800 ? 0.00000 {?} 14.02650 0.16660 0 {?} 0 398 {285.HB1} 2.78600 0.03400 0.10300 ? 0.00000 {?} {285.HB2} 2.68000 0.16000 0.16800 ? 0.00000 {?} {285.CB} 38.23100 0.78700 0.78700 ? 0.00000 {?} 152.83681 1.69800 0 {?} 0 399 {285.HB2} 2.67200 0.05000 0.09900 ? 0.00000 {?} {285.HB1} 2.77800 0.10600 0.19700 ? 0.00000 {?} {285.CB} 38.24100 0.78700 0.78700 ? 0.00000 {?} 121.48680 1.58030 0 {?} 0 400 {314.HA} 4.43700 0.06100 0.09100 ++ 0.00000 {?} {314.HB1} 3.09100 0.08800 0.13100 ++ 0.00000 {?} {314.CB} 37.86800 0.78700 0.78700 ? 0.00000 {?} 36.21730 0.46400 0 {?} 0 401 {314.HA} 4.43700 0.05700 0.08400 ++ 0.00000 {?} {314.HB2} 2.66500 0.08800 0.12800 ++ 0.00000 {?} {314.CB} 37.88500 0.78700 0.78700 ? 0.00000 {?} 22.44640 0.29160 0 {?} 0 402 {314.HB1} 3.09100 0.05500 0.11400 ++ 0.00000 {?} {314.HB2} 2.66300 0.08500 0.23600 ? 0.00000 {?} {314.CB} 37.86300 0.78700 0.78700 ? 0.00000 {?} 99.50310 1.51850 0 {?} 0 403 {314.HB2} 2.66300 0.05600 0.11600 ++ 0.00000 {?} {314.HB1} 3.09600 0.08700 0.21000 ? 0.00000 {?} {314.CB} 37.86800 0.78700 0.78700 ? 0.00000 {?} 124.56790 1.78310 0 {?} 0 404 {346.HB2} 2.91100 0.07500 0.07500 ++ 0.00000 {?} {346.HB1} 3.04900 0.21000 0.14000 ++ 0.00000 {?} {346.CB} 37.17000 0.78700 0.78700 ? 0.00000 {?} 15.62050 0.18150 0 {?} 0 405 {312.HA} 4.60800 0.06200 0.06200 ++ 0.00000 {?} {312.HB1} 3.10400 0.12800 0.12800 ++ 0.00000 {?} {312.CB} 37.39800 0.30600 0.78700 ? 0.00000 {?} 3.46310 0.08470 0 {?} 0 406 {312.HA} 4.60400 0.06000 0.06000 ++ 0.00000 {?} {312.HB2} 2.79100 0.13700 0.13700 ++ 0.00000 {?} {312.CB} 37.44500 0.20500 0.20500 ++ 0.00000 {?} 4.20720 0.12240 0 {?} 0 407 {351.HB1} 3.25000 0.04900 0.10200 ++ 0.00000 {?} {351.HB2} 2.80200 0.08700 0.20700 ++ 0.00000 {?} {351.CB} 37.48500 0.78700 0.78700 ? 0.00000 {?} 143.98250 2.53560 0 {?} 0 408 {351.HB2} 2.80000 0.04900 0.10300 ++ 0.00000 {?} {351.HB1} 3.25200 0.08800 0.23600 ? 0.00000 {?} {351.CB} 37.48400 0.78700 0.78700 ? 0.00000 {?} 147.70959 2.63170 0 {?} 0 409 {312.HB2} 2.79100 0.10100 0.10100 ++ 0.00000 {?} {312.HB1} 3.09600 0.15300 0.15300 ? 0.00000 {?} {312.CB} 37.47700 0.24000 0.24000 ++ 0.00000 {?} 22.12020 0.25500 0 {?} 0 410 {333.HA} 4.73000 0.06600 0.06600 +E 0.00000 {?} {339.HG2} 1.92300 0.12700 0.12200 ++ 0.00000 {?} {339.CG} 36.97700 0.78700 0.78700 ? 0.00000 {?} 10.21990 0.14880 0 {?} 0 411 {331.HB} 3.82500 0.07900 0.07900 ++ 0.00000 {?} {339.HG1} 2.09600 0.12300 0.12300 ++ 0.00000 {?} {339.CG} 36.86000 0.13500 0.13500 ++ 0.00000 {?} 4.86870 0.11890 0 {?} 0 412 {339.HG1} 2.08800 0.05300 0.08600 ++ 0.00000 {?} {339.HG2} 1.92700 0.08200 0.15000 ? 0.00000 {?} {339.CG} 36.87300 0.78700 0.78700 ? 0.00000 {?} 57.33530 1.00020 0 {?} 0 413 {339.HG2} 1.92700 0.05400 0.09200 ++ 0.00000 {?} {339.HG1} 2.09500 0.10400 0.23600 ? 0.00000 {?} {339.CG} 36.86800 0.78700 0.78700 ? 0.00000 {?} 68.00820 1.02030 0 {?} 0 414 {339.HB1} 1.74900 0.07300 0.09800 ++ 0.00000 {?} {339.HG1} 2.08800 0.10200 0.19300 ? 0.00000 {?} {339.CG} 36.85900 0.78700 0.78700 ? 0.00000 {?} 46.36340 0.52380 0 {?} 0 415 {339.HB1} 1.74700 0.06000 0.08600 ++ 0.00000 {?} {339.HG2} 1.92900 0.08300 0.12000 ? 0.00000 {?} {339.CG} 36.84600 0.78700 0.78700 ? 0.00000 {?} 49.74560 0.74210 0 {?} 0 416 {333.HG1} 1.35700 0.08500 0.08500 ++ 0.00000 {?} {339.HG2} 1.93200 0.14100 0.14100 ++ 0.00000 {?} {339.CG} 36.89300 0.15900 0.15900 ++ 0.00000 {?} 4.90180 0.16370 0 {?} 0 417 {333.HG1} 1.36600 0.09400 0.09400 ++ 0.00000 {?} {339.HG1} 2.11100 0.15400 0.15400 ++ 0.00000 {?} {339.CG} 36.86500 0.11300 0.11300 ++ 0.00000 {?} 8.94860 0.10430 0 {?} 0 418 {291.HA} 4.37000 0.05700 0.10500 ++ 0.00000 {?} {291.HG1} 2.33900 0.09100 0.15500 ++ 0.00000 {?} {291.CG} 36.67400 0.78700 0.78700 ? 0.00000 {?} 64.74440 1.05690 0 {?} 0 419 {291.HB1} 2.16000 0.05000 0.11300 ? 0.00000 {?} {291.HG1} 2.33000 0.07000 0.16500 ? 0.00000 {?} {291.CG} 36.52400 0.78700 0.78700 ? 0.00000 {?} 135.18600 2.43380 0 {?} 0 420 {291.HB2} 1.78200 0.03300 0.10900 ? 0.00000 {?} {291.HG1} 2.33200 0.08800 0.15200 ++ 0.00000 {?} {291.CG} 36.64900 0.78700 0.78700 ? 0.00000 {?} 49.48430 1.13320 0 {?} 0 421 {304.HG21} 0.95300 0.07700 0.10500 ++ 0.00000 {?} {304.HB} 1.87300 0.09900 0.15000 ++ 0.00000 {?} {304.CB} 36.60100 0.78700 0.78700 ? 0.00000 {?} 91.13980 1.04760 0 {?} 0 422 {383.HG12} 0.84800 0.07900 0.07900 ++ 0.00000 {?} {383.HB} 1.69700 0.12300 0.12300 ++ 0.00000 {?} {383.CB} 36.59500 0.11600 0.11600 ++ 0.00000 {?} 3.62550 0.11220 0 {?} 0 423 {277.HA} 4.76600 0.07600 0.07600 +E 0.00000 {?} {277.HG1} 2.47700 0.12000 0.14300 ++ 0.00000 {?} {277.CG} 36.41400 0.78700 0.78700 ? 0.00000 {?} 57.67050 0.68860 0 {?} 0 424 {344.HA} 4.16300 0.07200 0.09200 ++ 0.00000 {?} {344.HG1} 2.34300 0.08800 0.15000 ? 0.00000 {?} {344.CG} 36.41900 0.78700 0.78700 ? 0.00000 {?} 41.51430 0.48640 0 {?} 0 425 {344.HA} 4.16200 0.07400 0.08000 ++ 0.00000 {?} {344.HG2} 2.27900 0.06400 0.06400 ? 0.00000 {?} {344.CG} 36.41500 0.78700 0.78700 ? 0.00000 {?} 28.45740 0.44430 0 {?} 0 426 {281.HB1} 3.16300 0.06400 0.06400 ? 0.00000 {?} {277.HG1} 2.48300 0.12800 0.12800 ? 0.00000 {?} {277.CG} 36.48800 0.02000 0.02000 ? 0.00000 {?} 8.56680 0.23070 0 {?} 0 427 {277.HB2} 2.20900 0.06800 0.10800 ? 0.00000 {?} {277.HG1} 2.47700 0.10700 0.18000 ? 0.00000 {?} {277.CG} 36.50000 0.78700 0.78700 ? 0.00000 {?} 90.10820 1.00740 0 {?} 0 428 {348.HG1} 1.55100 0.05800 0.05800 ++ 0.00000 {?} {344.HG1} 2.34600 0.08100 0.08100 ++ 0.00000 {?} {344.CG} 36.45000 0.22700 0.22700 ? 0.00000 {?} 3.37360 0.13380 0 {?} 0 429 {340.HG21} 0.80900 0.07900 0.07400 ++ 0.00000 {?} {344.HG2} 2.25900 0.12100 0.11500 ? 0.00000 {?} {344.CG} 36.41600 0.78700 0.78700 ? 0.00000 {?} 9.14820 0.14740 0 {?} 0 430 {297.HA} 4.03800 0.04300 0.07300 ? 0.00000 {?} {297.HG1} 2.33300 0.12300 0.17600 ? 0.00000 {?} {297.CG} 36.25400 0.78700 0.78700 ? 0.00000 {?} 38.57740 0.50700 0 {?} 0 431 {297.HA} 4.03600 0.07500 0.08800 ? 0.00000 {?} {297.HG2} 2.21600 0.10700 0.10700 ? 0.00000 {?} {297.CG} 36.21500 0.78700 0.78700 ? 0.00000 {?} 42.67190 0.42210 0 {?} 0 432 {292.HA} 3.95600 0.05400 0.05800 ++ 0.00000 {?} {292.HG1} 2.27000 0.07100 0.07400 ++ 0.00000 {?} {292.CG} 35.99700 0.78700 0.78700 ? 0.00000 {?} 24.64870 0.45840 0 {?} 0 433 {292.HB2} 2.04000 0.08500 0.08800 ? 0.00000 {?} {292.HG2} 2.24100 0.11000 0.18800 ? 0.00000 {?} {292.CG} 36.15000 0.78700 0.78700 ? 0.00000 {?} 215.71510 1.62680 0 {?} 0 434 {340.HA} 4.50700 0.06000 0.08500 ++ 0.00000 {?} {340.HB} 1.76100 0.10200 0.14900 ++ 0.00000 {?} {340.CB} 35.75200 0.78700 0.78700 ? 0.00000 {?} 25.70320 0.34010 0 {?} 0 435 {326.HG1} 2.43300 0.09900 0.09600 ++ 0.00000 {?} {326.HG2} 2.14100 0.15400 0.14900 ++ 0.00000 {?} {326.CG} 35.81300 0.78700 0.78700 ? 0.00000 {?} 35.70140 0.36990 0 {?} 0 436 {340.HG21} 0.83700 0.05300 0.07700 ++ 0.00000 {?} {340.HB} 1.74900 0.07800 0.12100 ++ 0.00000 {?} {340.CB} 35.75700 0.78700 0.78700 ? 0.00000 {?} 12.53280 0.18490 0 {?} 0 437 {340.HG11} 0.45300 0.05800 0.08500 ++ 0.00000 {?} {340.HB} 1.75700 0.07400 0.10800 ++ 0.00000 {?} {340.CB} 35.75200 0.78700 0.78700 ? 0.00000 {?} 12.89770 0.17170 0 {?} 0 438 {302.HA} 4.19400 0.08500 0.08500 ++ 0.00000 {?} {302.HG1} 2.31200 0.14800 0.14800 ++ 0.00000 {?} {302.CG} 35.46000 0.31200 0.31200 ? 0.00000 {?} 8.38570 0.21030 0 {?} 0 439 {302.HG1} 2.31300 0.05200 0.08300 ? 0.00000 {?} {302.HG2} 2.08900 0.13400 0.13400 ? 0.00000 {?} {302.CG} 35.56000 0.78700 0.78700 ? 0.00000 {?} 87.82780 0.85240 0 {?} 0 440 {302.HB2} 1.87500 0.07900 0.07900 ++ 0.00000 {?} {302.HG1} 2.31900 0.17100 0.17100 ++ 0.00000 {?} {302.CG} 35.52500 0.78700 0.78700 ? 0.00000 {?} 34.54030 0.27330 0 {?} 0 441 {326.HA} 4.72800 0.06400 0.06400 ++ 0.00000 {?} {326.HG2} 2.13100 0.13200 0.13200 ++ 0.00000 {?} {326.CG} 35.85900 0.78700 0.78700 ? 0.00000 {?} 15.98770 0.17000 0 {?} 0 442 {315.HA} 4.52600 0.07700 0.07700 ++ 0.00000 {?} {315.HB1} 1.57500 0.14300 0.14300 ++ 0.00000 {?} {315.CB} 35.24400 0.18300 0.78700 ? 0.00000 {?} 4.44110 0.10910 0 {?} 0 443 {315.HA} 4.52100 0.08300 0.08300 ++ 0.00000 {?} {315.HB2} 1.38700 0.15600 0.15600 ++ 0.00000 {?} {315.CB} 35.26900 0.41300 0.78700 ? 0.00000 {?} 8.51570 0.12670 0 {?} 0 444 {353.HA} 4.40600 0.05700 0.09100 ++ 0.00000 {?} {353.HG1} 2.12200 0.08300 0.12400 ++ 0.00000 {?} {353.CG} 35.37100 0.78700 0.78700 ? 0.00000 {?} 53.30690 0.85030 0 {?} 0 445 {302.HA} 4.19500 0.08500 0.08500 ++ 0.00000 {?} {302.HG2} 2.12200 0.14200 0.14200 ++ 0.00000 {?} {302.CG} 35.44200 0.10500 0.10500 ? 0.00000 {?} 8.46990 0.16050 0 {?} 0 446 {353.HB1} 1.94200 0.05900 0.12900 ? 0.00000 {?} {353.HG1} 2.12200 0.08600 0.17000 ++ 0.00000 {?} {353.CG} 35.36600 0.78700 0.78700 ? 0.00000 {?} 140.39819 2.19640 0 {?} 0 447 {353.HB2} 1.82700 0.06600 0.12700 ? 0.00000 {?} {353.HG1} 2.12200 0.08300 0.16400 ++ 0.00000 {?} {353.CG} 35.36300 0.78700 0.78700 ? 0.00000 {?} 129.66010 1.87190 0 {?} 0 448 {315.HD1} 1.63800 0.04900 0.04900 ? 0.00000 {?} {315.HB2} 1.38900 0.07500 0.07500 ++ 0.00000 {?} {315.CB} 35.27800 0.47300 0.78700 ? 0.00000 {?} 3.33810 0.10390 0 {?} 0 449 {315.HB1} 1.58800 0.06800 0.07800 ? 0.00000 {?} {315.HB2} 1.38000 0.09400 0.11100 ++ 0.00000 {?} {315.CB} 35.27700 0.78700 0.78700 ? 0.00000 {?} 10.92570 0.13310 0 {?} 0 450 {315.HB2} 1.37800 0.08900 0.09500 ++ 0.00000 {?} {315.HB1} 1.56600 0.10700 0.11600 ++ 0.00000 {?} {315.CB} 35.27400 0.78700 0.78700 ? 0.00000 {?} 12.97730 0.13080 0 {?} 0 451 {315.HG1} 1.29900 0.06700 0.06400 ++ 0.00000 {?} {315.HB2} 1.38200 0.10700 0.10100 ++ 0.00000 {?} {315.CB} 35.29200 0.78700 0.78700 ? 0.00000 {?} 6.80960 0.22630 0 {?} 0 452 {355.HG21} 1.20300 0.06800 0.09500 ++ 0.00000 {?} {353.HG1} 2.12200 0.11100 0.15300 ++ 0.00000 {?} {353.CG} 35.36400 0.78700 0.78700 ? 0.00000 {?} 42.40990 0.56940 0 {?} 0 453 {315.HG2} 1.14200 0.08800 0.08800 ++ 0.00000 {?} {315.HB1} 1.57300 0.12900 0.12900 ++ 0.00000 {?} {315.CB} 35.25000 0.07300 0.07300 ++ 0.00000 {?} 1.95230 0.06150 0 {?} 0 454 {315.HG2} 1.14600 0.07900 0.07900 ++ 0.00000 {?} {315.HB2} 1.38700 0.12300 0.12300 ++ 0.00000 {?} {315.CB} 35.28100 0.39400 0.78700 ? 0.00000 {?} 6.82260 0.15420 0 {?} 0 455 {279.HG11} 0.80900 0.06200 0.06200 ++ 0.00000 {?} {308.HB} 1.97500 0.15000 0.15000 ++ 0.00000 {?} {308.CB} 35.10200 0.78700 0.78700 ? 0.00000 {?} 23.84180 0.22350 0 {?} 0 456 {308.HG11} 0.63600 0.07400 0.07900 ++ 0.00000 {?} {308.HB} 1.98000 0.16900 0.18300 ++ 0.00000 {?} {308.CB} 35.07200 0.78700 0.78700 ? 0.00000 {?} 37.38730 0.35350 0 {?} 0 457 {298.HA} 4.09700 0.09700 0.08700 ++ 0.00000 {?} {298.HG1} 2.63000 0.12800 0.12800 ++ 0.00000 {?} {298.CG} 34.38200 0.78700 0.78700 ? 0.00000 {?} 34.46960 0.33710 0 {?} 0 458 {298.HG1} 2.63100 0.05700 0.09900 ++ 0.00000 {?} {298.HG2} 2.47000 0.10700 0.15000 ? 0.00000 {?} {298.CG} 34.38000 0.78700 0.78700 ? 0.00000 {?} 106.22980 1.41540 0 {?} 0 459 {298.HG2} 2.47600 0.05700 0.09900 ++ 0.00000 {?} {298.HG1} 2.62900 0.11200 0.19800 ? 0.00000 {?} {298.CG} 34.39000 0.78700 0.78700 ? 0.00000 {?} 123.82770 1.45490 0 {?} 0 460 {?} 2.42200 0.08100 0.08100 ++ 0.00000 {?} {?} 2.19400 0.17300 0.15500 ++ 0.00000 {?} {?} 34.60000 0.78700 0.78700 ? 0.00000 {?} 33.43330 0.35580 0 {?} 0 461 {298.HB1} 2.30800 0.08600 0.09600 ? 0.00000 {?} {298.HG1} 2.63700 0.11800 0.15000 ? 0.00000 {?} {298.CG} 34.38000 0.78700 0.78700 ? 0.00000 {?} 53.26730 0.45220 0 {?} 0 462 {298.HB1} 2.30600 0.08800 0.12700 ? 0.00000 {?} {298.HG2} 2.47500 0.11100 0.12800 ? 0.00000 {?} {298.CG} 34.38000 0.78700 0.78700 ? 0.00000 {?} 66.18280 0.52990 0 {?} 0 463 {298.HB2} 2.22400 0.06600 0.06200 ? 0.00000 {?} {298.HG1} 2.62900 0.11100 0.10600 ++ 0.00000 {?} {298.CG} 34.38800 0.78700 0.78700 ? 0.00000 {?} 18.83500 0.38780 0 {?} 0 464 {298.HB2} 2.21600 0.08600 0.08800 ? 0.00000 {?} {298.HG2} 2.46600 0.09900 0.12800 ++ 0.00000 {?} {298.CG} 34.38600 0.78700 0.78700 ? 0.00000 {?} 55.19190 0.50940 0 {?} 0 465 {361.HG11} 0.43300 0.07300 0.07900 ++ 0.00000 {?} {361.HB} 1.45000 0.11200 0.12300 ++ 0.00000 {?} {361.CB} 34.55100 0.78700 0.78700 ? 0.00000 {?} 22.85000 0.20870 0 {?} 0 466 {361.HG21} 0.22300 0.07200 0.08300 ++ 0.00000 {?} {361.HB} 1.45200 0.09300 0.11200 ++ 0.00000 {?} {361.CB} 34.55400 0.78700 0.78700 ? 0.00000 {?} 18.85200 0.20920 0 {?} 0 467 {298.HA} 4.09500 0.07300 0.08100 ++ 0.00000 {?} {298.HG2} 2.47200 0.13600 0.14900 ++ 0.00000 {?} {298.CG} 34.39300 0.78700 0.78700 ? 0.00000 {?} 54.99370 0.49950 0 {?} 0 468 {283.HB1} 3.24700 0.11300 0.11300 ++ 0.00000 {?} {283.HB2} 2.46600 0.16700 0.16700 ++ 0.00000 {?} {283.CB} 33.90900 0.23400 0.78700 ? 0.00000 {?} 18.00560 0.33720 0 {?} 0 469 {321.HB1} 2.69300 0.06300 0.06300 ? 0.00000 {?} {363.HB} 1.66800 0.13600 0.13600 ? 0.00000 {?} {363.CB} 34.05300 0.04900 0.04900 ++ 0.00000 {?} 4.85670 0.13040 0 {?} 0 470 {283.HB2} 2.44500 0.12000 0.12000 ++ 0.00000 {?} {283.HB1} 3.24500 0.18300 0.18300 ++ 0.00000 {?} {283.CB} 33.95300 0.40800 0.78700 ? 0.00000 {?} 24.78230 0.25430 0 {?} 0 471 {321.HB2} 2.24400 0.09500 0.09500 ++ 0.00000 {?} {363.HB} 1.65600 0.15400 0.15400 ++ 0.00000 {?} {363.CB} 34.05300 0.20100 0.20100 ++ 0.00000 {?} 6.36380 0.16050 0 {?} 0 472 {363.HG21} 0.88400 0.06800 0.06400 ++ 0.00000 {?} {363.HB} 1.66400 0.18000 0.16500 ++ 0.00000 {?} {363.CB} 34.04400 0.78700 0.78700 ? 0.00000 {?} 15.16580 0.22300 0 {?} 0 473 {363.HG11} 0.77100 0.07000 0.07300 ++ 0.00000 {?} {363.HB} 1.66400 0.14600 0.15200 ++ 0.00000 {?} {363.CB} 34.04900 0.78700 0.78700 ? 0.00000 {?} 21.54200 0.21160 0 {?} 0 474 {358.HA} 4.60700 0.06400 0.06500 ++ 0.00000 {?} {358.HB1} 2.04100 0.09800 0.15000 ? 0.00000 {?} {358.CB} 33.76500 0.78700 0.78700 ? 0.00000 {?} 35.75720 0.43690 0 {?} 0 475 {358.HA} 4.60700 0.07400 0.07400 ++ 0.00000 {?} {358.HB2} 1.95500 0.06400 0.06400 ? 0.00000 {?} {358.CB} 33.71300 0.78700 0.78700 ? 0.00000 {?} 24.61240 0.42050 0 {?} 0 476 {358.HB1} 2.03700 0.04800 0.09000 ? 0.00000 {?} {358.HB2} 1.94300 0.06300 0.10200 ? 0.00000 {?} {358.CB} 33.72400 0.78700 0.78700 ? 0.00000 {?} 50.94770 1.14450 0 {?} 0 477 {358.HG2} 1.43900 0.07700 0.07100 ? 0.00000 {?} {358.HB1} 2.02100 0.07600 0.16300 ? 0.00000 {?} {358.CB} 33.75900 0.78700 0.78700 ? 0.00000 {?} 22.37070 0.36000 0 {?} 0 478 {333.HG1} 1.35900 0.05300 0.08200 ++ 0.00000 {?} {333.HB1} 1.68300 0.08300 0.13200 ? 0.00000 {?} {333.CB} 33.70800 0.78700 0.78700 ? 0.00000 {?} 49.20870 0.77050 0 {?} 0 479 {334.HA} 4.37200 0.08100 0.08100 +E 0.00000 {?} {334.HB2} 1.89900 0.12300 0.12300 ++ 0.00000 {?} {334.CB} 33.58100 0.21200 0.21200 ? 0.00000 {?} 14.08810 0.14410 0 {?} 0 480 {333.HA} 4.73000 0.07100 0.07100 +E 0.00000 {?} {333.HB1} 1.68600 0.14200 0.19400 ++ 0.00000 {?} {333.CB} 33.60000 0.78700 0.78700 ? 0.00000 {?} 50.38230 0.48240 0 {?} 0 481 {289.HA} 4.36100 0.05400 0.07500 ++ 0.00000 {?} {289.HG1} 2.26800 0.08500 0.11300 ++ 0.00000 {?} {289.CG} 33.43300 0.78700 0.78700 ? 0.00000 {?} 39.43510 0.65420 0 {?} 0 482 {334.HA} 4.37400 0.07100 0.07100 ++ 0.00000 {?} {334.HB1} 2.00100 0.06100 0.09000 ? 0.00000 {?} {334.CB} 33.61000 0.47000 0.47000 ? 0.00000 {?} 5.17190 0.14030 0 {?} 0 483 {286.HA} 4.15900 0.08500 0.08500 ++ 0.00000 {?} {289.HG1} 2.27700 0.13900 0.13900 ++ 0.00000 {?} {289.CG} 33.45300 0.36600 0.78700 ? 0.00000 {?} 8.58980 0.24040 0 {?} 0 484 {352.HG1} 2.37200 0.08800 0.08100 ++ 0.00000 {?} {352.HG2} 1.95700 0.11600 0.11600 ++ 0.00000 {?} {352.CG} 33.57700 0.78700 0.78700 ? 0.00000 {?} 22.97680 0.26830 0 {?} 0 485 {289.HB1} 2.10900 0.05400 0.12700 ? 0.00000 {?} {289.HG1} 2.27400 0.08800 0.16800 ? 0.00000 {?} {289.CG} 33.43200 0.78700 0.78700 ? 0.00000 {?} 79.09710 1.22960 0 {?} 0 486 {289.HB2} 1.93200 0.06400 0.12200 ++ 0.00000 {?} {289.HG1} 2.26600 0.10700 0.17700 ? 0.00000 {?} {289.CG} 33.42300 0.78700 0.78700 ? 0.00000 {?} 87.06130 1.05740 0 {?} 0 487 {334.HG1} 1.29700 0.04600 0.04600 ++ 0.00000 {?} {334.HB1} 1.98900 0.06400 0.10100 ? 0.00000 {?} {334.CB} 33.60100 0.23600 0.23600 ? 0.00000 {?} 4.95360 0.30450 0 {?} 0 488 {294.HA} 4.44700 0.07300 0.07300 ++ 0.00000 {?} {294.HB2} 1.70000 0.11500 0.11500 ++ 0.00000 {?} {294.CB} 33.04600 0.22500 0.78700 ? 0.00000 {?} 11.42440 0.29700 0 {?} 0 489 {311.HG1} 1.25200 0.08100 0.08000 ++ 0.00000 {?} {311.HB2} 1.72100 0.10800 0.10800 ? 0.00000 {?} {311.CB} 33.33600 0.78700 0.78700 ? 0.00000 {?} 30.30850 0.37160 0 {?} 0 490 {294.HA} 4.44900 0.05300 0.05500 ++ 0.00000 {?} {294.HB1} 1.93200 0.12100 0.12400 ? 0.00000 {?} {294.CB} 33.04400 0.78700 0.78700 ? 0.00000 {?} 37.84740 0.44410 0 {?} 0 491 {395.HA} 4.32300 0.03800 0.07300 ++ 0.00000 {?} {395.HB1} 1.87900 0.06500 0.13300 ? 0.00000 {?} {395.CB} 32.98900 0.78700 0.78700 ? 0.00000 {?} 65.23790 1.70810 0 {?} 0 492 {348.HA} 4.05300 0.06200 0.09400 ++ 0.00000 {?} {348.HB2} 1.80300 0.10700 0.10700 ? 0.00000 {?} {348.CB} 32.90600 0.78700 0.78700 ? 0.00000 {?} 53.86230 0.61430 0 {?} 0 493 {395.HE1} 3.00700 0.04700 0.04700 ++ 0.00000 {?} {395.HB1} 1.88400 0.09000 0.09700 ? 0.00000 {?} {395.CB} 32.88300 0.16500 0.78700 ? 0.00000 {?} 7.08660 0.27010 0 {?} 0 494 {395.HE1} 3.01200 0.05600 0.05600 ++ 0.00000 {?} {395.HB2} 1.80000 0.10200 0.10200 ? 0.00000 {?} {395.CB} 32.90800 0.48900 0.78700 ? 0.00000 {?} 16.25500 0.32230 0 {?} 0 495 {395.HB1} 1.90500 0.03200 0.08400 ? 0.00000 {?} {395.HB2} 1.78000 0.07800 0.17300 ? 0.00000 {?} {395.CB} 32.93100 0.78700 0.78700 ? 0.00000 {?} 260.54800 5.86850 0 {?} 0 496 {?} 1.81500 0.11400 0.11400 ++ 0.00000 {?} {?} 2.40300 0.13500 0.13500 ++ 0.00000 {?} {?} 32.92400 0.20100 0.20100 ++ 0.00000 {?} 11.60050 0.18860 0 {?} 0 497 {395.HG1} 1.47300 0.05400 0.08100 ? 0.00000 {?} {395.HB1} 1.89600 0.07100 0.14000 ? 0.00000 {?} {395.CB} 32.95600 0.78700 0.78700 ? 0.00000 {?} 82.51410 1.36850 0 {?} 0 498 {395.HG1} 1.46300 0.04000 0.08400 ? 0.00000 {?} {395.HB2} 1.77600 0.11000 0.14400 ? 0.00000 {?} {395.CB} 32.94200 0.78700 0.78700 ? 0.00000 {?} 107.40600 1.60110 0 {?} 0 499 {294.HG1} 1.15500 0.07200 0.06900 ++ 0.00000 {?} {294.HB1} 1.93400 0.10400 0.09200 ++ 0.00000 {?} {294.CB} 33.09300 0.51400 0.51400 ? 0.00000 {?} 14.79180 0.41730 0 {?} 0 500 {294.HG1} 1.15500 0.06800 0.06800 ++ 0.00000 {?} {294.HB2} 1.69100 0.06700 0.06700 ++ 0.00000 {?} {294.CB} 33.06500 0.78700 0.78700 ? 0.00000 {?} 22.27960 0.36090 0 {?} 0 501 {273.HG11} 0.93100 0.01900 0.07000 ? 0.00000 {?} {272.HB1} 1.78700 0.12900 0.11000 ++ 0.00000 {?} {272.CB} 32.91700 0.78700 0.78700 ? 0.00000 {?} 6.69750 0.23040 0 {?} 0 502 {365.HA} 4.73500 0.07800 0.07800 ++ 0.00000 {?} {365.HG1} 2.39200 0.16100 0.16100 ++ 0.00000 {?} {365.CG} 32.74700 0.13700 0.13700 ++ 0.00000 {?} 6.93140 0.15950 0 {?} 0 503 {379.HA} 4.56700 0.07200 0.07200 ++ 0.00000 {?} {379.HB2} 1.78600 0.11100 0.10300 ++ 0.00000 {?} {379.CB} 32.58800 0.78700 0.78700 ? 0.00000 {?} 25.15940 0.32710 0 {?} 0 504 {396.HA} 4.45100 0.04400 0.07100 ++ 0.00000 {?} {396.HG1} 2.11600 0.12400 0.23600 ? 0.00000 {?} {396.CG} 32.64900 0.78700 0.78700 ? 0.00000 {?} 76.88710 1.01210 0 {?} 0 505 {381.HG1} 2.71200 0.05300 0.08100 ++ 0.00000 {?} {381.HG2} 2.41200 0.10500 0.16100 ++ 0.00000 {?} {381.CG} 32.74700 0.78700 0.78700 ? 0.00000 {?} 30.94320 0.40490 0 {?} 0 506 {396.HB1} 2.63800 0.04700 0.04700 ++ 0.00000 {?} {396.HG1} 2.12900 0.06400 0.12500 ? 0.00000 {?} {396.CG} 32.69100 0.78700 0.78700 ? 0.00000 {?} 21.68340 0.56450 0 {?} 0 507 {396.HB1} 2.63200 0.04900 0.05000 ++ 0.00000 {?} {396.HG2} 2.06000 0.06400 0.06400 ? 0.00000 {?} {396.CG} 32.68400 0.78700 0.78700 ? 0.00000 {?} 23.12610 0.59170 0 {?} 0 508 {396.HB2} 2.55800 0.04000 0.04000 ++ 0.00000 {?} {396.HG1} 2.11200 0.11000 0.11000 ++ 0.00000 {?} {396.CG} 32.63400 0.78700 0.78700 ? 0.00000 {?} 35.85960 0.60040 0 {?} 0 509 {381.HG2} 2.41300 0.05800 0.09200 ++ 0.00000 {?} {381.HG1} 2.70800 0.11100 0.23600 ? 0.00000 {?} {381.CG} 32.73200 0.78700 0.78700 ? 0.00000 {?} 38.18570 0.42080 0 {?} 0 510 {365.HB1} 2.14700 0.05600 0.11600 ? 0.00000 {?} {365.HG1} 2.40600 0.08300 0.16300 ? 0.00000 {?} {365.CG} 32.76800 0.78700 0.78700 ? 0.00000 {?} 46.70960 0.58460 0 {?} 0 511 {381.HB1} 1.95800 0.08600 0.08600 ++ 0.00000 {?} {381.HG1} 2.69600 0.17200 0.17200 ++ 0.00000 {?} {381.CG} 32.74200 0.50400 0.50400 ? 0.00000 {?} 13.86150 0.14990 0 {?} 0 512 {397.HB2} 1.78700 0.02900 0.09400 ? 0.00000 {?} {396.HG2} 2.11500 0.08000 0.17600 ? 0.00000 {?} {396.CG} 32.64500 0.78700 0.78700 ? 0.00000 {?} 17.29330 0.42860 0 {?} 0 513 {348.HG1} 1.53800 0.03900 0.07300 ? 0.00000 {?} {348.HB2} 1.81200 0.09400 0.13400 ? 0.00000 {?} {348.CB} 32.78400 0.78700 0.78700 ? 0.00000 {?} 52.70390 0.87280 0 {?} 0 514 {273.HG11} 0.93700 0.05500 0.12100 ++ 0.00000 {?} {273.HB} 2.05800 0.08800 0.19300 ? 0.00000 {?} {273.CB} 32.69500 0.78700 0.78700 ? 0.00000 {?} 128.72231 1.88280 0 {?} 0 515 {?} 0.89400 0.07800 0.10800 ? 0.00000 {?} {?} 1.77600 0.10800 0.11300 ++ 0.00000 {?} {?} 32.67700 0.78700 0.78700 ? 0.00000 {?} 35.43330 0.29040 0 {?} 0 516 {366.HA} 4.55200 0.02500 0.06900 ? 0.00000 {?} {366.HB1} 2.35600 0.08600 0.20300 ? 0.00000 {?} {366.CB} 32.43400 0.78700 0.78700 ? 0.00000 {?} 28.91080 0.78330 0 {?} 0 517 {377.HA} 4.56200 0.02900 0.07100 ? 0.00000 {?} {377.HB2} 2.04800 0.11800 0.14600 ? 0.00000 {?} {377.CB} 32.44200 0.78700 0.78700 ? 0.00000 {?} 31.03050 0.51130 0 {?} 0 518 {269.HA} 4.19900 0.04500 0.06400 ++ 0.00000 {?} {269.HB} 2.18400 0.11800 0.16100 ++ 0.00000 {?} {269.CB} 32.41400 0.78700 0.78700 ? 0.00000 {?} 36.98160 0.67210 0 {?} 0 519 {331.HB} 3.82300 0.05700 0.07500 ? 0.00000 {?} {339.HB1} 1.74400 0.12800 0.12800 ++ 0.00000 {?} {339.CB} 32.38000 0.78700 0.78700 ? 0.00000 {?} 24.89210 0.25540 0 {?} 0 520 {349.HA} 3.77700 0.07700 0.07700 ? 0.00000 {?} {349.HG2} 1.00600 0.13600 0.13600 ++ 0.00000 {?} {349.CG} 32.24300 0.08100 0.08100 ++ 0.00000 {?} 7.29460 0.17550 0 {?} 0 521 {339.HG1} 2.07700 0.07900 0.18600 ? 0.00000 {?} {339.HB1} 1.77300 0.10400 0.19300 ? 0.00000 {?} {339.CB} 32.44400 0.78700 0.78700 ? 0.00000 {?} 125.65030 1.00130 0 {?} 0 522 {377.HB2} 2.03400 0.02800 0.11100 ? 0.00000 {?} {377.HB1} 2.36000 0.08700 0.19000 ? 0.00000 {?} {377.CB} 32.42500 0.78700 0.78700 ? 0.00000 {?} 77.35590 1.63090 0 {?} 0 523 {365.HB2} 1.94600 0.07100 0.08800 ? 0.00000 {?} {366.HB1} 2.35100 0.12900 0.23600 ? 0.00000 {?} {366.CB} 32.42900 0.78700 0.78700 ? 0.00000 {?} 147.17751 1.02900 0 {?} 0 524 {296.HG1} 1.68300 0.12500 0.12500 ++ 0.00000 {?} {296.HG2} 0.20400 0.18000 0.18000 ++ 0.00000 {?} {296.CG} 32.55700 0.78700 0.78700 ? 0.00000 {?} 50.18610 0.31200 0 {?} 0 525 {331.HG21} 0.98900 0.06700 0.07400 ++ 0.00000 {?} {339.HB1} 1.75800 0.10100 0.15000 ? 0.00000 {?} {339.CB} 32.42000 0.78700 0.78700 ? 0.00000 {?} 27.55430 0.23450 0 {?} 0 526 {269.HG21} 0.93400 0.04600 0.08200 ++ 0.00000 {?} {269.HB} 2.16200 0.08000 0.16400 ? 0.00000 {?} {269.CB} 32.43200 0.78700 0.78700 ? 0.00000 {?} 72.16410 1.13010 0 {?} 0 527 {296.HG2} 0.20400 0.11300 0.10800 ++ 0.00000 {?} {296.HG1} 1.68200 0.18400 0.17600 ++ 0.00000 {?} {296.CG} 32.55000 0.78700 0.78700 ? 0.00000 {?} 36.48220 0.34430 0 {?} 0 528 {379.HA} 4.55400 0.05700 0.06700 ++ 0.00000 {?} {379.HB1} 1.95600 0.10700 0.10700 ? 0.00000 {?} {379.CB} 32.31800 0.78700 0.78700 ? 0.00000 {?} 41.40970 0.46700 0 {?} 0 529 {396.HA} 4.45400 0.05000 0.05500 ++ 0.00000 {?} {396.HB2} 2.57100 0.21700 0.23000 ++ 0.00000 {?} {396.CB} 32.17400 0.78700 0.78700 ? 0.00000 {?} 51.04890 0.49310 0 {?} 0 530 {301.HA} 4.06000 0.05700 0.12000 ? 0.00000 {?} {301.HB1} 1.99600 0.10500 0.23600 ? 0.00000 {?} {301.CB} 32.24600 0.78700 0.78700 ? 0.00000 {?} 126.63250 1.60720 0 {?} 0 531 {349.HA} 3.78500 0.08500 0.08500 ++ 0.00000 {?} {349.HG1} 1.65800 0.12000 0.12000 ++ 0.00000 {?} {349.CG} 32.19000 0.16700 0.16700 ++ 0.00000 {?} 7.82860 0.15080 0 {?} 0 532 {396.HG1} 2.13100 0.05600 0.08800 ? 0.00000 {?} {396.HB2} 2.56800 0.10400 0.10700 ? 0.00000 {?} {396.CB} 32.20300 0.78700 0.78700 ? 0.00000 {?} 53.40690 0.68360 0 {?} 0 533 {396.HG1} 2.13800 0.06800 0.09000 ? 0.00000 {?} {396.HB1} 2.62900 0.10500 0.13100 ? 0.00000 {?} {396.CB} 32.20300 0.78700 0.78700 ? 0.00000 {?} 59.87830 0.66570 0 {?} 0 534 {396.HG2} 2.06000 0.04200 0.05800 ? 0.00000 {?} {396.HB1} 2.63200 0.07100 0.09600 ? 0.00000 {?} {396.CB} 32.22700 0.78700 0.78700 ? 0.00000 {?} 28.02140 0.60730 0 {?} 0 535 {396.HG2} 2.05900 0.04700 0.06300 ? 0.00000 {?} {396.HB2} 2.55700 0.06900 0.09600 ? 0.00000 {?} {396.CB} 32.23000 0.78700 0.78700 ? 0.00000 {?} 25.73800 0.54210 0 {?} 0 536 {301.HG1} 1.64800 0.04800 0.09500 ? 0.00000 {?} {301.HB1} 1.99000 0.09600 0.18800 ? 0.00000 {?} {301.CB} 32.24200 0.78700 0.78700 ? 0.00000 {?} 57.50570 0.80680 0 {?} 0 537 {385.HB2} 1.65600 0.12400 0.12400 ++ 0.00000 {?} {385.HB1} 2.68200 0.16500 0.16500 ++ 0.00000 {?} {385.CB} 32.11300 0.07800 0.07800 ++ 0.00000 {?} 12.48350 0.21720 0 {?} 0 538 {349.HG1} 1.65400 0.05700 0.09200 ++ 0.00000 {?} {349.HG2} 1.01600 0.08400 0.13400 ++ 0.00000 {?} {349.CG} 32.25900 0.78700 0.78700 ? 0.00000 {?} 44.52870 0.66790 0 {?} 0 539 {301.HG2} 1.55500 0.04700 0.07000 ? 0.00000 {?} {301.HB1} 1.99000 0.10100 0.19400 ? 0.00000 {?} {301.CB} 32.23800 0.78700 0.78700 ? 0.00000 {?} 55.07220 0.82290 0 {?} 0 540 {349.HB1} 1.15900 0.07400 0.07400 ++ 0.00000 {?} {349.HG1} 1.66100 0.13700 0.13700 ++ 0.00000 {?} {349.CG} 32.27300 0.78700 0.78700 ? 0.00000 {?} 30.90080 0.27010 0 {?} 0 541 {349.HB1} 1.14700 0.06400 0.06500 ++ 0.00000 {?} {349.HG2} 1.00300 0.09200 0.09200 ++ 0.00000 {?} {349.CG} 32.23000 0.78700 0.78700 ? 0.00000 {?} 17.17400 0.27920 0 {?} 0 542 {349.HG2} 1.00500 0.05100 0.08500 ++ 0.00000 {?} {349.HG1} 1.65200 0.09600 0.17400 ++ 0.00000 {?} {349.CG} 32.24700 0.78700 0.78700 ? 0.00000 {?} 51.50160 0.75740 0 {?} 0 543 {280.HD11} 0.96300 0.09100 0.09100 ++ 0.00000 {?} {385.HB1} 2.68600 0.18300 0.18300 ++ 0.00000 {?} {385.CB} 32.14600 0.43500 0.78700 ? 0.00000 {?} 20.19480 0.23610 0 {?} 0 544 {307.HG21} 0.80200 0.04900 0.09000 ++ 0.00000 {?} {307.HB} 1.80200 0.11000 0.23600 ? 0.00000 {?} {307.CB} 32.06700 0.78700 0.78700 ? 0.00000 {?} 67.65230 0.93000 0 {?} 0 545 {349.HB2} 0.68800 0.08500 0.09500 ++ 0.00000 {?} {349.HG1} 1.65200 0.13000 0.14400 ++ 0.00000 {?} {349.CG} 32.24200 0.78700 0.78700 ? 0.00000 {?} 34.16640 0.30780 0 {?} 0 546 {349.HB2} 0.68200 0.11000 0.10000 ++ 0.00000 {?} {349.HG2} 1.00600 0.21100 0.19200 ++ 0.00000 {?} {349.CG} 32.25700 0.78700 0.78700 ? 0.00000 {?} 23.54960 0.26460 0 {?} 0 547 {277.HA} 4.76200 0.05200 0.05200 +E 0.00000 {?} {277.HB1} 2.29700 0.16200 0.13000 ++ 0.00000 {?} {277.CB} 31.80500 0.78700 0.78700 ? 0.00000 {?} 28.77640 0.39370 0 {?} 0 548 {372.HA} 4.46900 0.05200 0.09100 ? 0.00000 {?} {372.HB1} 2.33900 0.08200 0.16000 ++ 0.00000 {?} {372.CB} 31.90100 0.78700 0.78700 ? 0.00000 {?} 71.30990 1.31810 0 {?} 0 549 {372.HA} 4.47400 0.05200 0.07700 ? 0.00000 {?} {372.HB2} 2.01200 0.11700 0.17000 ? 0.00000 {?} {372.CB} 31.89300 0.78700 0.78700 ? 0.00000 {?} 64.58020 0.79420 0 {?} 0 550 {372.HD1} 3.66800 0.07300 0.07400 ++ 0.00000 {?} {372.HB1} 2.34100 0.12700 0.13000 ++ 0.00000 {?} {372.CB} 31.99600 0.78700 0.78700 ? 0.00000 {?} 33.23560 0.39080 0 {?} 0 551 {372.HD1} 3.68100 0.05300 0.06000 ++ 0.00000 {?} {372.HB2} 2.00500 0.08300 0.09500 ++ 0.00000 {?} {372.CB} 31.96900 0.78700 0.78700 ? 0.00000 {?} 25.80680 0.45940 0 {?} 0 552 {277.HG1} 2.47500 0.05900 0.09300 ++ 0.00000 {?} {277.HB1} 2.30000 0.10700 0.19000 ? 0.00000 {?} {277.CB} 31.89800 0.78700 0.78700 ? 0.00000 {?} 91.16390 1.03980 0 {?} 0 553 {277.HG1} 2.47200 0.04900 0.07300 ++ 0.00000 {?} {277.HB2} 2.21300 0.09100 0.09100 ? 0.00000 {?} {277.CB} 31.88100 0.78700 0.78700 ? 0.00000 {?} 60.89680 0.88890 0 {?} 0 554 {372.HB1} 2.33500 0.05200 0.12900 ++ 0.00000 {?} {372.HB2} 1.99900 0.07900 0.20900 ? 0.00000 {?} {372.CB} 31.96100 0.78700 0.78700 ? 0.00000 {?} 190.58960 3.23450 0 {?} 0 555 {372.HB2} 2.00000 0.03200 0.10700 ? 0.00000 {?} {372.HB1} 2.33900 0.06700 0.18700 ? 0.00000 {?} {372.CB} 31.97100 0.78700 0.78700 ? 0.00000 {?} 86.37160 2.78800 0 {?} 0 556 {329.HG1} 1.69400 0.07700 0.11400 ++ 0.00000 {?} {329.HB1} 2.09300 0.11100 0.19600 ? 0.00000 {?} {329.CB} 31.65900 0.78700 0.78700 ? 0.00000 {?} 54.13330 0.40800 0 {?} 0 557 {376.HA} 4.69500 0.07200 0.07200 ? 0.00000 {?} {397.HB1} 1.83000 0.16100 0.16100 ++ 0.00000 {?} {397.CB} 31.10200 0.06800 0.06800 ++ 0.00000 {?} 5.48720 0.09960 0 {?} 0 558 {275.HD1} 3.22000 0.05900 0.10800 ++ 0.00000 {?} {275.HB1} 1.83700 0.13400 0.23600 ? 0.00000 {?} {275.CB} 31.03800 0.78700 0.78700 ? 0.00000 {?} 286.55731 2.63300 0 {?} 0 559 {328.HG2} 1.91300 0.10600 0.10600 ++ 0.00000 {?} {328.HB1} 2.44700 0.17900 0.17900 ++ 0.00000 {?} {328.CB} 31.15200 0.38700 0.38700 ++ 0.00000 {?} 18.14400 0.18750 0 {?} 0 560 {275.HG1} 1.64200 0.04000 0.09100 ? 0.00000 {?} {275.HB1} 1.82800 0.09200 0.15800 ? 0.00000 {?} {275.CB} 31.03700 0.78700 0.78700 ? 0.00000 {?} 373.73080 6.41920 0 {?} 0 561 {376.HD11} 0.92600 0.07900 0.07900 ++ 0.00000 {?} {397.HB2} 1.83100 0.13900 0.13900 ++ 0.00000 {?} {397.CB} 31.06300 0.22900 0.78700 ? 0.00000 {?} 9.48110 0.19290 0 {?} 0 562 {299.HG21} 0.82300 0.04900 0.05600 ++ 0.00000 {?} {299.HB} 1.74700 0.11900 0.13800 ++ 0.00000 {?} {299.CB} 31.09000 0.78700 0.78700 ? 0.00000 {?} 38.08770 0.50540 0 {?} 0 563 {299.HG11} 0.68200 0.05000 0.05700 ++ 0.00000 {?} {299.HB} 1.74600 0.10500 0.11900 ++ 0.00000 {?} {299.CB} 31.04300 0.78700 0.78700 ? 0.00000 {?} 31.12250 0.48660 0 {?} 0 564 {291.HA} 4.37300 0.06300 0.07300 ++ 0.00000 {?} {291.HB1} 2.15500 0.10900 0.14200 ++ 0.00000 {?} {291.CB} 30.85400 0.78700 0.78700 ? 0.00000 {?} 39.52720 0.50200 0 {?} 0 565 {397.HA} 4.37100 0.07200 0.14500 ? 0.00000 {?} {397.HB1} 1.90100 0.03800 0.08400 ? 0.00000 {?} {397.CB} 30.99100 0.78700 0.78700 ? 0.00000 {?} 116.75290 2.68080 0 {?} 0 566 {275.HA} 4.37200 0.05300 0.10500 ++ 0.00000 {?} {275.HB1} 1.82700 0.02900 0.10600 ? 0.00000 {?} {275.CB} 30.97500 0.78700 0.78700 ? 0.00000 {?} 57.31230 3.05770 0 {?} 0 567 {347.HA} 4.16000 0.05500 0.07600 ++ 0.00000 {?} {347.HB1} 2.11800 0.12000 0.15700 ? 0.00000 {?} {347.CB} 30.83200 0.78700 0.78700 ? 0.00000 {?} 47.35670 0.52640 0 {?} 0 568 {347.HA} 4.15900 0.05600 0.07300 ++ 0.00000 {?} {347.HB2} 2.00400 0.10900 0.13800 ? 0.00000 {?} {347.CB} 30.85100 0.78700 0.78700 ? 0.00000 {?} 44.86970 0.51160 0 {?} 0 569 {347.HD1} 3.22700 0.07900 0.07900 ++ 0.00000 {?} {347.HB1} 2.16100 0.17800 0.17800 ? 0.00000 {?} {347.CB} 30.85100 0.78700 0.78700 ? 0.00000 {?} 33.90170 0.29270 0 {?} 0 570 {291.HG1} 2.33400 0.05200 0.07800 ++ 0.00000 {?} {291.HB1} 2.15100 0.07800 0.12200 ++ 0.00000 {?} {291.CB} 30.82400 0.78700 0.78700 ? 0.00000 {?} 59.90040 1.00460 0 {?} 0 571 {291.HG1} 2.33400 0.05100 0.06900 ++ 0.00000 {?} {291.HB2} 1.78300 0.10200 0.14700 ++ 0.00000 {?} {291.CB} 30.84800 0.78700 0.78700 ? 0.00000 {?} 63.40250 0.89410 0 {?} 0 572 {347.HB2} 1.98700 0.06500 0.10800 ? 0.00000 {?} {347.HB1} 2.11800 0.13300 0.23600 ? 0.00000 {?} {347.CB} 30.83700 0.78700 0.78700 ? 0.00000 {?} 106.81200 0.82320 0 {?} 0 573 {291.HB2} 1.78100 0.07800 0.18600 ? 0.00000 {?} {291.HB1} 2.14700 0.12000 0.23600 ? 0.00000 {?} {291.CB} 30.85600 0.78700 0.78700 ? 0.00000 {?} 148.52200 1.41120 0 {?} 0 574 {347.HG2} 1.62900 0.05800 0.05800 ? 0.00000 {?} {347.HB1} 2.11800 0.10700 0.11700 ? 0.00000 {?} {347.CB} 30.89000 0.78700 0.78700 ? 0.00000 {?} 26.60680 0.31600 0 {?} 0 575 {376.HD11} 0.94500 0.06900 0.06900 ++ 0.00000 {?} {397.HB2} 1.82700 0.14300 0.14300 ++ 0.00000 {?} {397.CB} 30.99800 0.23500 0.23500 ? 0.00000 {?} 7.85490 0.15630 0 {?} 0 576 {319.HG11} 0.82400 0.05300 0.08800 ? 0.00000 {?} {319.HB} 2.48000 0.11700 0.15300 ++ 0.00000 {?} {319.CB} 30.98900 0.78700 0.78700 ? 0.00000 {?} 47.18500 0.57520 0 {?} 0 577 {319.HG21} 0.74700 0.06000 0.08000 ? 0.00000 {?} {319.HB} 2.48900 0.11500 0.14900 ++ 0.00000 {?} {319.CB} 30.98900 0.78700 0.78700 ? 0.00000 {?} 53.14910 0.58070 0 {?} 0 578 {387.HB1} 2.77200 0.11300 0.11300 ++ 0.00000 {?} {387.HB2} 2.20900 0.18600 0.18600 ++ 0.00000 {?} {387.CB} 30.57100 0.50900 0.78700 ? 0.00000 {?} 34.43270 0.29470 0 {?} 0 579 {387.HB2} 2.20900 0.10600 0.10600 ++ 0.00000 {?} {387.HB1} 2.77000 0.16400 0.16400 ++ 0.00000 {?} {387.CB} 30.51600 0.18400 0.78700 ? 0.00000 {?} 14.46880 0.25940 0 {?} 0 580 {353.HG1} 2.12300 0.04600 0.08400 ++ 0.00000 {?} {353.HB1} 1.95400 0.09900 0.15600 ? 0.00000 {?} {353.CB} 30.67800 0.78700 0.78700 ? 0.00000 {?} 162.55679 2.37290 0 {?} 0 581 {353.HG1} 2.12300 0.05200 0.09600 ++ 0.00000 {?} {353.HB2} 1.82200 0.07900 0.14500 ? 0.00000 {?} {353.CB} 30.66800 0.78700 0.78700 ? 0.00000 {?} 130.88589 2.04730 0 {?} 0 582 {279.HG21} 0.98800 0.07700 0.07200 ++ 0.00000 {?} {279.HB} 2.19600 0.18700 0.17700 ++ 0.00000 {?} {279.CB} 30.67000 0.78700 0.78700 ? 0.00000 {?} 29.73790 0.42340 0 {?} 0 583 {279.HG11} 0.79600 0.07500 0.07500 ? 0.00000 {?} {387.HB1} 2.77600 0.14600 0.14600 ++ 0.00000 {?} {387.CB} 30.53600 0.05000 0.05000 ++ 0.00000 {?} 8.04190 0.20370 0 {?} 0 584 {279.HG11} 0.80000 0.05100 0.06300 ++ 0.00000 {?} {279.HB} 2.20100 0.12400 0.15700 ++ 0.00000 {?} {279.CB} 30.61500 0.78700 0.78700 ? 0.00000 {?} 44.35640 0.57840 0 {?} 0 585 {308.HG11} 0.63500 0.06100 0.06100 ? 0.00000 {?} {387.HB2} 2.21500 0.15700 0.15700 ? 0.00000 {?} {387.CB} 30.58000 0.01500 0.01500 ? 0.00000 {?} 8.11510 0.20870 0 {?} 0 586 {271.HA} 4.71100 0.04300 0.05600 ++ 0.00000 {?} {271.HB2} 3.14400 0.09200 0.12000 ? 0.00000 {?} {271.CB} 29.64000 0.78700 0.78700 ? 0.00000 {?} 30.13020 0.62700 0 {?} 0 587 {302.HA} 4.19400 0.07400 0.07400 ++ 0.00000 {?} {302.HB2} 1.88200 0.13500 0.13500 ++ 0.00000 {?} {302.CB} 29.93300 0.14100 0.14100 ? 0.00000 {?} 11.80930 0.24810 0 {?} 0 588 {344.HA} 4.16900 0.07300 0.09900 ++ 0.00000 {?} {344.HB1} 2.17400 0.11000 0.15200 ? 0.00000 {?} {344.CB} 29.79500 0.78700 0.78700 ? 0.00000 {?} 79.12600 0.65740 0 {?} 0 589 {344.HA} 4.16700 0.06700 0.12700 ? 0.00000 {?} {344.HB2} 2.08700 0.10700 0.10700 ? 0.00000 {?} {344.CB} 29.75200 0.78700 0.78700 ? 0.00000 {?} 63.28920 0.61370 0 {?} 0 590 {297.HA} 4.03800 0.04000 0.08100 ? 0.00000 {?} {297.HB1} 2.09300 0.07800 0.13300 ? 0.00000 {?} {297.CB} 29.74800 0.78700 0.78700 ? 0.00000 {?} 48.96130 0.91280 0 {?} 0 591 {292.HA} 3.96000 0.05400 0.07200 ? 0.00000 {?} {292.HB1} 2.10900 0.10000 0.15000 ? 0.00000 {?} {292.CB} 29.71700 0.78700 0.78700 ? 0.00000 {?} 48.75230 0.66640 0 {?} 0 592 {292.HA} 3.95800 0.05400 0.06700 ? 0.00000 {?} {292.HB2} 2.02100 0.10700 0.10700 ? 0.00000 {?} {292.CB} 29.70900 0.78700 0.78700 ? 0.00000 {?} 41.77640 0.54490 0 {?} 0 593 {311.HE1} 2.60100 0.09100 0.09100 ++ 0.00000 {?} {311.HD1} 1.49200 0.15400 0.15400 ++ 0.00000 {?} {311.CD} 29.71100 0.19100 0.78700 ? 0.00000 {?} 4.73030 0.10950 0 {?} 0 594 {297.HG1} 2.33100 0.04900 0.09700 ? 0.00000 {?} {297.HB1} 2.12200 0.20100 0.23600 ? 0.00000 {?} {297.CB} 29.75000 0.78700 0.78700 ? 0.00000 {?} 193.77879 1.37640 0 {?} 0 595 {302.HB1} 2.20200 0.04700 0.10600 ? 0.00000 {?} {302.HB2} 1.89800 0.15600 0.15600 ? 0.00000 {?} {302.CB} 29.85700 0.78700 0.78700 ? 0.00000 {?} 94.83680 0.65600 0 {?} 0 596 {311.HE2} 2.12200 0.05100 0.05100 ++ 0.00000 {?} {311.HD2} 1.27600 0.09100 0.09100 ++ 0.00000 {?} {311.CD} 29.73100 0.08300 0.78700 ? 0.00000 {?} 2.03000 0.07200 0 {?} 0 597 {302.HB2} 1.88000 0.09300 0.10600 ? 0.00000 {?} {302.HB1} 2.19900 0.08700 0.19200 ? 0.00000 {?} {302.CB} 29.90300 0.78700 0.78700 ? 0.00000 {?} 56.82630 0.50490 0 {?} 0 598 {304.HG11} 1.77100 0.08300 0.08300 ++ 0.00000 {?} {304.HG12} 0.78800 0.14200 0.14200 ++ 0.00000 {?} {304.CG1} 29.80600 0.09700 0.09700 ++ 0.00000 {?} 3.59660 0.12810 0 {?} 0 599 {311.HD1} 1.48900 0.06100 0.09000 ++ 0.00000 {?} {311.HD2} 1.26700 0.11000 0.17400 ++ 0.00000 {?} {311.CD} 29.71300 0.78700 0.78700 ? 0.00000 {?} 28.83560 0.33220 0 {?} 0 600 {311.HD2} 1.25800 0.06900 0.10900 ++ 0.00000 {?} {311.HD1} 1.48100 0.10400 0.23600 ? 0.00000 {?} {311.CD} 29.70400 0.78700 0.78700 ? 0.00000 {?} 54.71660 0.57340 0 {?} 0 601 {304.HD11} 0.95800 0.08200 0.09300 ++ 0.00000 {?} {304.HG11} 1.77200 0.12600 0.14600 ++ 0.00000 {?} {304.CG1} 29.76300 0.78700 0.78700 ? 0.00000 {?} 53.89690 0.60160 0 {?} 0 602 {340.HG21} 0.81200 0.04400 0.04500 ++ 0.00000 {?} {344.HB2} 2.08000 0.10700 0.10700 ? 0.00000 {?} {344.CB} 29.75400 0.78700 0.78700 ? 0.00000 {?} 13.21280 0.17990 0 {?} 0 603 {340.HG21} 0.81000 0.05400 0.05400 ++ 0.00000 {?} {344.HB1} 2.19000 0.10200 0.15000 ? 0.00000 {?} {344.CB} 29.79500 0.78700 0.78700 ? 0.00000 {?} 19.71790 0.22570 0 {?} 0 604 {304.HG12} 0.80200 0.07200 0.07200 ++ 0.00000 {?} {304.HG11} 1.77200 0.13900 0.13900 ++ 0.00000 {?} {304.CG1} 29.78000 0.78700 0.78700 ? 0.00000 {?} 30.42530 0.27770 0 {?} 0 605 {271.HA} 4.71000 0.03900 0.05600 ++ 0.00000 {?} {271.HB1} 3.27100 0.10700 0.15000 ? 0.00000 {?} {271.CB} 29.64700 0.78700 0.78700 ? 0.00000 {?} 42.27350 0.79470 0 {?} 0 606 {271.HB1} 3.27100 0.03000 0.07100 ++ 0.00000 {?} {271.HB2} 3.14800 0.05700 0.16400 ? 0.00000 {?} {271.CB} 29.66600 0.78700 0.78700 ? 0.00000 {?} 104.70610 3.59220 0 {?} 0 607 {271.HB2} 3.14300 0.03800 0.06800 ++ 0.00000 {?} {271.HB1} 3.27700 0.07300 0.16000 ? 0.00000 {?} {271.CB} 29.67500 0.78700 0.78700 ? 0.00000 {?} 141.75720 3.51090 0 {?} 0 608 {289.HG1} 2.26000 0.06200 0.08600 ? 0.00000 {?} {289.HB1} 2.11300 0.10800 0.14300 ? 0.00000 {?} {289.CB} 29.33100 0.78700 0.78700 ? 0.00000 {?} 222.42480 2.12280 0 {?} 0 609 {289.HA} 4.35500 0.05600 0.06600 ++ 0.00000 {?} {289.HB1} 2.11100 0.11100 0.12500 ++ 0.00000 {?} {289.CB} 29.28600 0.78700 0.78700 ? 0.00000 {?} 42.65420 0.54020 0 {?} 0 610 {289.HA} 4.36000 0.06600 0.06100 ++ 0.00000 {?} {289.HB2} 1.93900 0.14000 0.13000 ++ 0.00000 {?} {289.CB} 29.31400 0.78700 0.78700 ? 0.00000 {?} 21.49860 0.40740 0 {?} 0 611 {289.HG1} 2.26900 0.03600 0.09200 ? 0.00000 {?} {289.HB2} 1.94100 0.13900 0.17800 ? 0.00000 {?} {289.CB} 29.36200 0.78700 0.78700 ? 0.00000 {?} 84.51160 1.01840 0 {?} 0 612 {289.HB1} 2.10800 0.03600 0.11600 ? 0.00000 {?} {289.HB2} 1.93600 0.09700 0.17700 ? 0.00000 {?} {289.CB} 29.28000 0.78700 0.78700 ? 0.00000 {?} 141.85480 2.32540 0 {?} 0 613 {289.HB2} 1.93300 0.06900 0.10800 ? 0.00000 {?} {289.HB1} 2.11100 0.11700 0.23600 ? 0.00000 {?} {289.CB} 29.33000 0.78700 0.78700 ? 0.00000 {?} 152.17540 1.51930 0 {?} 0 614 {333.HA} 4.72400 0.07900 0.07900 +E 0.00000 {?} {333.HD1} 1.64000 0.14000 0.14000 ++ 0.00000 {?} {333.CD} 29.15400 0.24400 0.24400 ++ 0.00000 {?} 8.72520 0.22240 0 {?} 0 615 {329.HA} 4.49700 0.08800 0.08800 ++ 0.00000 {?} {329.HD1} 1.88600 0.16300 0.16300 ++ 0.00000 {?} {329.CD} 29.06300 0.78700 0.78700 ? 0.00000 {?} 48.11260 0.36720 0 {?} 0 616 {294.HA} 4.45200 0.02900 0.08800 ? 0.00000 {?} {294.HD1} 1.66100 0.12100 0.12000 ++ 0.00000 {?} {294.CD} 28.96700 0.78700 0.78700 ? 0.00000 {?} 17.39290 0.41170 0 {?} 0 617 {288.HA} 4.45400 0.06300 0.06300 ? 0.00000 {?} {288.HB1} 3.30700 0.12300 0.12200 ++ 0.00000 {?} {288.CB} 29.04300 0.78700 0.78700 ? 0.00000 {?} 32.52040 0.42420 0 {?} 0 618 {288.HA} 4.44700 0.06600 0.06600 ++ 0.00000 {?} {288.HB2} 3.06400 0.14200 0.14200 ++ 0.00000 {?} {288.CB} 29.04100 0.46900 0.46900 ? 0.00000 {?} 22.20450 0.30010 0 {?} 0 619 {302.HA} 4.20000 0.08700 0.08700 ++ 0.00000 {?} {301.HD1} 1.72200 0.12200 0.12200 ++ 0.00000 {?} {301.CD} 28.96000 0.78700 0.78700 ? 0.00000 {?} 31.99220 0.23200 0 {?} 0 620 {329.HE1} 3.10100 0.06000 0.08800 ++ 0.00000 {?} {329.HD1} 1.87500 0.07900 0.12800 ++ 0.00000 {?} {329.CD} 29.04300 0.78700 0.78700 ? 0.00000 {?} 60.67330 0.92830 0 {?} 0 621 {288.HB2} 3.07300 0.08000 0.10000 ? 0.00000 {?} {288.HB1} 3.30700 0.08300 0.17400 ? 0.00000 {?} {288.CB} 29.03200 0.78700 0.78700 ? 0.00000 {?} 81.41880 0.88560 0 {?} 0 622 {358.HB1} 1.99100 0.04200 0.08400 ? 0.00000 {?} {358.HD1} 1.74800 0.06400 0.14900 ? 0.00000 {?} {358.CD} 29.11400 0.78700 0.78700 ? 0.00000 {?} 90.16040 1.96900 0 {?} 0 623 {329.HG2} 1.55900 0.07800 0.10800 ? 0.00000 {?} {329.HD1} 1.86700 0.06400 0.17100 ? 0.00000 {?} {329.CD} 29.04500 0.78700 0.78700 ? 0.00000 {?} 62.86240 1.04980 0 {?} 0 624 {315.HB2} 1.36100 0.03500 0.09100 ? 0.00000 {?} {315.HD1} 1.63600 0.07800 0.17600 ? 0.00000 {?} {315.CD} 29.05900 0.78700 0.78700 ? 0.00000 {?} 99.24180 2.14080 0 {?} 0 625 {357.HD11} 0.99800 0.05600 0.09700 ++ 0.00000 {?} {329.HD1} 1.87600 0.07600 0.12200 ++ 0.00000 {?} {329.CD} 29.04300 0.78700 0.78700 ? 0.00000 {?} 50.24730 0.89250 0 {?} 0 626 {354.HG21} 0.80600 0.07800 0.11600 ? 0.00000 {?} {354.HG11} 1.70900 0.14000 0.17900 ++ 0.00000 {?} {354.CG1} 28.54100 0.78700 0.78700 ? 0.00000 {?} 38.13450 0.33510 0 {?} 0 627 {357.HD21} 0.80500 0.09400 0.08800 ++ 0.00000 {?} {329.HD1} 1.87600 0.12900 0.12300 ++ 0.00000 {?} {329.CD} 29.04300 0.78700 0.78700 ? 0.00000 {?} 21.45300 0.34460 0 {?} 0 628 {340.HG11} 0.44800 0.08100 0.08800 ++ 0.00000 {?} {334.HD1} 1.62100 0.09300 0.10400 ++ 0.00000 {?} {334.CD} 29.09700 0.78700 0.78700 ? 0.00000 {?} 5.92540 0.07810 0 {?} 0 629 {365.HA} 4.75700 0.05000 0.05000 ++ 0.00000 {?} {365.HB2} 1.96900 0.09500 0.09500 ++ 0.00000 {?} {365.CB} 28.77400 0.27300 0.27300 ++ 0.00000 {?} 2.59590 0.10220 0 {?} 0 630 {358.HA} 4.60800 0.04200 0.08300 ? 0.00000 {?} {358.HD1} 1.74500 0.13700 0.13900 ++ 0.00000 {?} {358.CD} 28.83300 0.78700 0.78700 ? 0.00000 {?} 33.68340 0.49120 0 {?} 0 631 {315.HA} 4.52000 0.03000 0.10400 ? 0.00000 {?} {315.HD1} 1.66200 0.12500 0.16300 ++ 0.00000 {?} {315.CD} 28.84900 0.78700 0.78700 ? 0.00000 {?} 31.91410 0.54580 0 {?} 0 632 {293.HA} 4.50600 0.02700 0.05900 ? 0.00000 {?} {293.HB1} 3.34300 0.12700 0.16000 ? 0.00000 {?} {293.CB} 28.78600 0.78700 0.78700 ? 0.00000 {?} 23.32480 0.47220 0 {?} 0 633 {293.HA} 4.50600 0.05300 0.06300 ++ 0.00000 {?} {293.HB2} 3.21300 0.12000 0.13700 ? 0.00000 {?} {293.CB} 28.78800 0.78700 0.78700 ? 0.00000 {?} 41.18130 0.47810 0 {?} 0 634 {395.HA} 4.31600 0.05900 0.11400 ? 0.00000 {?} {395.HD1} 1.71300 0.09100 0.15900 ++ 0.00000 {?} {395.CD} 28.88100 0.78700 0.78700 ? 0.00000 {?} 83.41580 1.32330 0 {?} 0 635 {298.HA} 4.09600 0.05800 0.05600 ++ 0.00000 {?} {298.HB2} 2.22400 0.09100 0.08900 ++ 0.00000 {?} {298.CB} 28.76000 0.78700 0.78700 ? 0.00000 {?} 14.36200 0.39130 0 {?} 0 636 {301.HA} 4.05400 0.06500 0.10400 ++ 0.00000 {?} {301.HD1} 1.71100 0.12100 0.16500 ++ 0.00000 {?} {301.CD} 28.86400 0.78700 0.78700 ? 0.00000 {?} 73.65210 0.75760 0 {?} 0 637 {324.HB1} 3.64000 0.11600 0.11600 ++ 0.00000 {?} {324.HB2} 3.03100 0.16800 0.16800 ++ 0.00000 {?} {324.CB} 28.67400 0.29500 0.78700 ? 0.00000 {?} 22.25080 0.39320 0 {?} 0 638 {293.HB1} 3.34400 0.04800 0.08500 ++ 0.00000 {?} {293.HB2} 3.22200 0.08600 0.15500 ? 0.00000 {?} {293.CB} 28.81200 0.78700 0.78700 ? 0.00000 {?} 76.92570 1.16850 0 {?} 0 639 {293.HB2} 3.21200 0.05300 0.09300 ++ 0.00000 {?} {293.HB1} 3.35400 0.09300 0.12400 ++ 0.00000 {?} {293.CB} 28.80300 0.78700 0.78700 ? 0.00000 {?} 66.38750 1.01040 0 {?} 0 640 {324.HB2} 3.02000 0.09800 0.09800 ++ 0.00000 {?} {324.HB1} 3.64700 0.18800 0.18800 ++ 0.00000 {?} {324.CB} 28.69300 0.35500 0.78700 ? 0.00000 {?} 13.84700 0.23870 0 {?} 0 641 {395.HE1} 3.01700 0.04400 0.16900 ? 0.00000 {?} {395.HD1} 1.72400 0.09900 0.22800 ? 0.00000 {?} {395.CD} 28.87500 0.78700 0.78700 ? 0.00000 {?} 309.81799 4.82450 0 {?} 0 642 {298.HG1} 2.63100 0.06500 0.05300 ++ 0.00000 {?} {298.HB1} 2.32500 0.09600 0.09600 ++ 0.00000 {?} {298.CB} 28.75200 0.78700 0.78700 ? 0.00000 {?} 15.99960 0.31650 0 {?} 0 643 {298.HG2} 2.47700 0.05700 0.06300 ++ 0.00000 {?} {298.HB2} 2.21400 0.08200 0.09100 ++ 0.00000 {?} {298.CB} 28.74700 0.78700 0.78700 ? 0.00000 {?} 33.93740 0.45770 0 {?} 0 644 {365.HG1} 2.39500 0.07200 0.10800 ? 0.00000 {?} {365.HB1} 2.16200 0.15600 0.18000 ++ 0.00000 {?} {365.CB} 28.74600 0.78700 0.78700 ? 0.00000 {?} 58.15900 0.38380 0 {?} 0 645 {365.HG1} 2.39700 0.06900 0.06500 ++ 0.00000 {?} {365.HB2} 1.94000 0.12000 0.11200 ++ 0.00000 {?} {365.CB} 28.71900 0.78700 0.78700 ? 0.00000 {?} 21.30340 0.36410 0 {?} 0 646 {344.HG1} 2.34400 0.05200 0.05200 ++ 0.00000 {?} {348.HD1} 1.69900 0.10400 0.10400 ++ 0.00000 {?} {348.CD} 28.78500 0.10100 0.10100 ++ 0.00000 {?} 15.44650 0.53740 0 {?} 0 647 {298.HB1} 2.30600 0.02700 0.05600 ? 0.00000 {?} {298.HB2} 2.22400 0.05900 0.11000 ? 0.00000 {?} {298.CB} 28.77300 0.78700 0.78700 ? 0.00000 {?} 20.92370 0.84770 0 {?} 0 648 {298.HB2} 2.22500 0.04900 0.06600 ? 0.00000 {?} {298.HB1} 2.30600 0.08600 0.10600 ? 0.00000 {?} {298.CB} 28.80300 0.78700 0.78700 ? 0.00000 {?} 52.03410 0.84540 0 {?} 0 649 {395.HB1} 1.90800 0.04600 0.08200 ++ 0.00000 {?} {395.HD1} 1.70600 0.09100 0.17900 ? 0.00000 {?} {395.CD} 28.85000 0.78700 0.78700 ? 0.00000 {?} 163.61211 2.32160 0 {?} 0 650 {301.HG2} 1.53800 0.07000 0.07000 ? 0.00000 {?} {301.HD1} 1.71100 0.10900 0.22900 ? 0.00000 {?} {301.CD} 28.83000 0.78700 0.78700 ? 0.00000 {?} 423.12411 4.56560 0 {?} 0 651 {395.HG1} 1.46500 0.02700 0.09600 ? 0.00000 {?} {395.HD1} 1.70300 0.09300 0.21900 ? 0.00000 {?} {395.CD} 28.86500 0.78700 0.78700 ? 0.00000 {?} 178.19160 4.75500 0 {?} 0 652 {315.HG2} 1.15200 0.07100 0.14700 ? 0.00000 {?} {315.HD1} 1.64500 0.09700 0.18800 ? 0.00000 {?} {315.CD} 28.84500 0.78700 0.78700 ? 0.00000 {?} 116.06170 1.36670 0 {?} 0 653 {354.HD11} 0.92900 0.05500 0.08500 ? 0.00000 {?} {354.HG11} 1.72300 0.16400 0.15600 ++ 0.00000 {?} {354.CG1} 28.58300 0.51500 0.51500 ? 0.00000 {?} 18.95430 0.31350 0 {?} 0 654 {354.HG12} 0.59600 0.07300 0.07300 ++ 0.00000 {?} {354.HG11} 1.72800 0.11700 0.11700 ++ 0.00000 {?} {354.CG1} 28.53900 0.23700 0.23700 ++ 0.00000 {?} 4.88090 0.14430 0 {?} 0 655 {349.HA} 3.78200 0.08200 0.08200 ++ 0.00000 {?} {349.HB1} 1.16100 0.18500 0.18100 ++ 0.00000 {?} {349.CB} 28.30300 0.78700 0.78700 ? 0.00000 {?} 31.16890 0.30310 0 {?} 0 656 {349.HA} 3.78300 0.11000 0.09100 ++ 0.00000 {?} {349.HB2} 0.67200 0.16300 0.16300 ++ 0.00000 {?} {349.CB} 28.30300 0.78700 0.78700 ? 0.00000 {?} 33.70810 0.28950 0 {?} 0 657 {349.HG1} 1.65700 0.09500 0.08200 ++ 0.00000 {?} {349.HB1} 1.15700 0.17500 0.15300 ++ 0.00000 {?} {349.CB} 28.29900 0.78700 0.78700 ? 0.00000 {?} 21.23460 0.24420 0 {?} 0 658 {347.HG2} 1.65400 0.06600 0.05800 ++ 0.00000 {?} {349.HB2} 0.67300 0.13600 0.12100 ++ 0.00000 {?} {349.CB} 28.31000 0.78700 0.78700 ? 0.00000 {?} 14.75250 0.26810 0 {?} 0 659 {349.HB1} 1.15200 0.06200 0.08800 ++ 0.00000 {?} {349.HB2} 0.67700 0.09300 0.12900 ++ 0.00000 {?} {349.CB} 28.30600 0.78700 0.78700 ? 0.00000 {?} 38.80050 0.54920 0 {?} 0 660 {349.HG2} 1.00300 0.07500 0.07500 ++ 0.00000 {?} {349.HB1} 1.16000 0.16500 0.14200 ++ 0.00000 {?} {349.CB} 28.30800 0.78700 0.78700 ? 0.00000 {?} 17.94530 0.27240 0 {?} 0 661 {349.HG2} 1.01200 0.05700 0.05500 ++ 0.00000 {?} {349.HB2} 0.67500 0.10400 0.10400 ++ 0.00000 {?} {349.CB} 28.29700 0.78700 0.78700 ? 0.00000 {?} 11.69880 0.23970 0 {?} 0 662 {349.HB2} 0.67800 0.06400 0.08300 ++ 0.00000 {?} {349.HB1} 1.16400 0.10800 0.14300 ++ 0.00000 {?} {349.CB} 28.30300 0.78700 0.78700 ? 0.00000 {?} 46.19390 0.52170 0 {?} 0 663 {279.HG11} 0.79500 0.03400 0.07700 ? 0.00000 {?} {389.HG} 1.48500 0.09600 0.16500 ? 0.00000 {?} {389.CG} 27.62300 0.78700 0.78700 ? 0.00000 {?} 26.93300 0.49280 0 {?} 0 664 {389.HD11} 0.64500 0.06500 0.12700 ? 0.00000 {?} {389.HG} 1.49100 0.09600 0.17600 ++ 0.00000 {?} {389.CG} 27.72000 0.78700 0.78700 ? 0.00000 {?} 98.84470 1.25320 0 {?} 0 665 {376.HA} 4.71600 0.07700 0.07700 ? 0.00000 {?} {376.HG} 2.04100 0.11800 0.13200 ++ 0.00000 {?} {376.CG} 27.51200 0.78700 0.78700 ? 0.00000 {?} 26.81460 0.25530 0 {?} 0 666 {377.HA} 4.55900 0.05500 0.10800 ? 0.00000 {?} {377.HG1} 2.04900 0.09800 0.15500 ++ 0.00000 {?} {377.CG} 27.41000 0.78700 0.78700 ? 0.00000 {?} 52.19040 0.73250 0 {?} 0 667 {377.HD1} 3.94100 0.06700 0.10800 ? 0.00000 {?} {377.HG1} 2.04400 0.09300 0.14300 ++ 0.00000 {?} {377.CG} 27.43500 0.78700 0.78700 ? 0.00000 {?} 52.75290 0.57440 0 {?} 0 668 {379.HD1} 3.86600 0.07200 0.08800 ? 0.00000 {?} {379.HG1} 2.05900 0.11700 0.16100 ++ 0.00000 {?} {379.CG} 27.47500 0.78700 0.78700 ? 0.00000 {?} 68.84130 0.58900 0 {?} 0 669 {366.HD2} 3.80500 0.03400 0.07500 ? 0.00000 {?} {366.HG1} 2.05500 0.12700 0.16500 ++ 0.00000 {?} {366.CG} 27.47600 0.78700 0.78700 ? 0.00000 {?} 30.39850 0.47000 0 {?} 0 670 {377.HB1} 2.33900 0.06300 0.10900 ++ 0.00000 {?} {377.HB2} 2.06800 0.10700 0.23600 ? 0.00000 {?} {377.CG} 27.39000 0.78700 0.78700 ? 0.00000 {?} 150.17720 1.77040 0 {?} 0 671 {386.HD21} 0.83900 0.05200 0.04700 ++ 0.00000 {?} {386.HG} 1.21500 0.11600 0.11600 ++ 0.00000 {?} {386.CG} 27.53200 0.78700 0.78700 ? 0.00000 {?} 19.24670 0.37460 0 {?} 0 672 {309.HD11} 0.75000 0.04400 0.07400 ++ 0.00000 {?} {309.HG} 1.34500 0.06700 0.10700 ? 0.00000 {?} {309.CG} 27.45900 0.78700 0.78700 ? 0.00000 {?} 40.16220 0.78440 0 {?} 0 673 {386.HD11} 0.27800 0.07400 0.07400 ++ 0.00000 {?} {386.HG} 1.21100 0.14500 0.14500 ++ 0.00000 {?} {386.CG} 27.57400 0.20300 0.20300 ? 0.00000 {?} 8.80030 0.27400 0 {?} 0 674 {376.HA} 4.70900 0.06200 0.06200 ? 0.00000 {?} {397.HG1} 1.65500 0.16000 0.15000 ++ 0.00000 {?} {397.CG} 27.12000 0.78700 0.78700 ? 0.00000 {?} 20.75580 0.24580 0 {?} 0 675 {392.HA} 4.59300 0.06200 0.07600 ++ 0.00000 {?} {392.HG} 1.59000 0.10900 0.12400 ++ 0.00000 {?} {392.CG} 27.11400 0.78700 0.78700 ? 0.00000 {?} 52.71330 0.57800 0 {?} 0 676 {372.HA} 4.47500 0.05500 0.06300 ? 0.00000 {?} {372.HG1} 2.07100 0.14500 0.16000 ++ 0.00000 {?} {372.CG} 27.29800 0.78700 0.78700 ? 0.00000 {?} 41.79560 0.49450 0 {?} 0 677 {397.HA} 4.37100 0.01900 0.07000 ? 0.00000 {?} {397.HG1} 1.64200 0.09500 0.18300 ? 0.00000 {?} {397.CG} 27.21400 0.78700 0.78700 ? 0.00000 {?} 71.81060 2.38070 0 {?} 0 678 {390.HB} 4.26000 0.04800 0.06200 ? 0.00000 {?} {392.HG} 1.59500 0.13100 0.11100 ? 0.00000 {?} {392.CG} 27.14300 0.78700 0.78700 ? 0.00000 {?} 16.65810 0.25910 0 {?} 0 679 {371.HA1} 4.22900 0.08700 0.08700 ++ 0.00000 {?} {372.HG1} 2.07600 0.13000 0.13000 ++ 0.00000 {?} {372.CG} 27.26500 0.24600 0.24600 ? 0.00000 {?} 9.95510 0.21280 0 {?} 0 680 {274.HA} 4.42000 0.06100 0.06100 ++ 0.00000 {?} {274.HG} 1.63800 0.21700 0.21700 ++ 0.00000 {?} {274.CG} 27.27600 0.13400 0.13400 ++ 0.00000 {?} 95.23860 1.70710 0 {?} 0 681 {374.HA2} 3.96100 0.07300 0.07300 ++ 0.00000 {?} {397.HG1} 1.67900 0.11000 0.11000 ++ 0.00000 {?} {397.CG} 27.14900 0.31400 0.78700 ? 0.00000 {?} 6.08940 0.16540 0 {?} 0 682 {372.HD1} 3.67100 0.06600 0.16000 ? 0.00000 {?} {372.HG1} 2.07400 0.12000 0.23600 ? 0.00000 {?} {372.CG} 27.30900 0.78700 0.78700 ? 0.00000 {?} 229.79120 2.46290 0 {?} 0 683 {275.HD1} 3.22600 0.05900 0.12500 ++ 0.00000 {?} {275.HG1} 1.64400 0.12600 0.23600 ? 0.00000 {?} {275.CG} 27.19500 0.78700 0.78700 ? 0.00000 {?} 561.30951 6.09120 0 {?} 0 684 {397.HB1} 1.87700 0.02900 0.06900 ? 0.00000 {?} {397.HG1} 1.65100 0.11000 0.22200 ? 0.00000 {?} {397.CG} 27.24300 0.78700 0.78700 ? 0.00000 {?} 311.80801 6.50880 0 {?} 0 685 {347.HG1} 1.80400 0.03900 0.07000 ? 0.00000 {?} {347.HG2} 1.65400 0.11600 0.22200 ? 0.00000 {?} {347.CG} 27.19400 0.78700 0.78700 ? 0.00000 {?} 631.56653 9.07430 0 {?} 0 686 {376.HB1} 1.66100 0.08100 0.09000 ? 0.00000 {?} {376.HG} 2.03000 0.10200 0.14200 ? 0.00000 {?} {376.CG} 27.26700 0.78700 0.78700 ? 0.00000 {?} 35.43760 0.30120 0 {?} 0 687 {322.HG11} 1.27100 0.08800 0.09500 ++ 0.00000 {?} {322.HG12} 0.61600 0.12300 0.13500 ++ 0.00000 {?} {322.CG1} 27.23700 0.78700 0.78700 ? 0.00000 {?} 45.52840 0.47600 0 {?} 0 688 {383.HG11} 1.21100 0.10000 0.10000 ? 0.00000 {?} {343.HG} 1.57700 0.14500 0.14600 ++ 0.00000 {?} {343.CG} 27.19900 0.78700 0.78700 ? 0.00000 {?} 17.08110 0.17760 0 {?} 0 689 {357.HD11} 0.99900 0.05700 0.10000 ++ 0.00000 {?} {357.HG} 1.79600 0.10100 0.19300 ? 0.00000 {?} {357.CG} 27.18100 0.78700 0.78700 ? 0.00000 {?} 72.30160 1.05260 0 {?} 0 690 {363.HG21} 0.89100 0.07100 0.07100 ++ 0.00000 {?} {379.HG1} 2.03200 0.20800 0.20800 ++ 0.00000 {?} {379.CG} 27.29100 0.20200 0.78700 ? 0.00000 {?} 8.80820 0.17770 0 {?} 0 691 {303.HD11} 0.74800 0.03200 0.08800 ? 0.00000 {?} {303.HG} 1.72900 0.09900 0.15600 ? 0.00000 {?} {303.CG} 27.12800 0.78700 0.78700 ? 0.00000 {?} 38.13900 0.76070 0 {?} 0 692 {322.HD11} 0.72300 0.06600 0.06600 ++ 0.00000 {?} {322.HG12} 0.61400 0.10100 0.10100 ++ 0.00000 {?} {322.CG1} 27.16700 0.78700 0.78700 ? 0.00000 {?} 12.77030 0.35290 0 {?} 0 693 {303.HD21} 0.61500 0.05900 0.07500 ? 0.00000 {?} {303.HG} 1.72700 0.12000 0.14900 ++ 0.00000 {?} {303.CG} 27.16000 0.78700 0.78700 ? 0.00000 {?} 40.58280 0.51440 0 {?} 0 694 {322.HG12} 0.61700 0.03400 0.06000 ? 0.00000 {?} {322.HG11} 1.27200 0.08700 0.10700 ++ 0.00000 {?} {322.CG1} 27.25600 0.78700 0.78700 ? 0.00000 {?} 25.61550 0.56090 0 {?} 0 695 {362.HD21} 0.54500 0.05800 0.05800 ? 0.00000 {?} {322.HG11} 1.27200 0.12700 0.12700 ++ 0.00000 {?} {322.CG1} 27.23900 0.13400 0.13400 ++ 0.00000 {?} 9.04870 0.24260 0 {?} 0 696 {362.HD21} 0.54200 0.05900 0.05900 ++ 0.00000 {?} {322.HG12} 0.62900 0.13500 0.13500 ++ 0.00000 {?} {322.CG1} 27.23300 0.19800 0.19800 ++ 0.00000 {?} 5.50890 0.19650 0 {?} 0 697 {343.HA} 4.17100 0.03700 0.07400 ? 0.00000 {?} {343.HG} 1.64900 0.13000 0.16100 ? 0.00000 {?} {343.CG} 26.95300 0.78700 0.78700 ? 0.00000 {?} 33.06470 0.47650 0 {?} 0 698 {347.HA} 4.16300 0.06500 0.07400 ++ 0.00000 {?} {347.HG1} 1.79000 0.13600 0.15300 ? 0.00000 {?} {347.CG} 26.95600 0.78700 0.78700 ? 0.00000 {?} 42.24060 0.41060 0 {?} 0 699 {347.HB1} 2.12100 0.04600 0.07200 ? 0.00000 {?} {347.HG1} 1.79000 0.12800 0.13000 ++ 0.00000 {?} {347.CG} 26.95300 0.78700 0.78700 ? 0.00000 {?} 40.70750 0.51860 0 {?} 0 700 {347.HB1} 2.11900 0.08800 0.08800 ++ 0.00000 {?} {347.HG2} 1.64100 0.10900 0.10900 ++ 0.00000 {?} {347.CG} 26.85300 0.51900 0.78700 ? 0.00000 {?} 68.36730 0.69800 0 {?} 0 701 {347.HB2} 2.00000 0.09300 0.09800 ? 0.00000 {?} {347.HG1} 1.78700 0.14400 0.14900 ? 0.00000 {?} {347.CG} 26.96500 0.78700 0.78700 ? 0.00000 {?} 94.25610 0.54800 0 {?} 0 702 {347.HB2} 2.00100 0.06700 0.06700 ++ 0.00000 {?} {347.HG2} 1.64000 0.09300 0.09300 ++ 0.00000 {?} {347.CG} 26.87600 0.24800 0.78700 ? 0.00000 {?} 30.62490 0.80520 0 {?} 0 703 {?} 1.79300 0.08400 0.12700 ? 0.00000 {?} {?} 2.03600 0.14800 0.23600 ? 0.00000 {?} {?} 27.06100 0.78700 0.78700 ? 0.00000 {?} 63.97070 0.43240 0 {?} 0 704 {343.HD11} 1.04500 0.04200 0.06100 ? 0.00000 {?} {343.HG} 1.65700 0.11000 0.17100 ? 0.00000 {?} {343.CG} 26.93000 0.78700 0.78700 ? 0.00000 {?} 40.06150 0.65070 0 {?} 0 705 {274.HD11} 0.93100 0.04300 0.10300 ? 0.00000 {?} {274.HG} 1.62400 0.16100 0.21200 ? 0.00000 {?} {274.CG} 27.03200 0.78700 0.78700 ? 0.00000 {?} 269.77469 2.69370 0 {?} 0 706 {296.HB2} 0.77200 0.06200 0.08000 ++ 0.00000 {?} {296.HB1} 1.48700 0.09000 0.14100 ? 0.00000 {?} {296.CB} 26.95400 0.78700 0.78700 ? 0.00000 {?} 54.88210 0.56340 0 {?} 0 707 {303.HA} 4.25900 0.07400 0.07900 ? 0.00000 {?} {306.HG} 1.82300 0.18100 0.18100 ++ 0.00000 {?} {306.CG} 26.72800 0.39900 0.39900 ? 0.00000 {?} 18.33800 0.24570 0 {?} 0 708 {296.HB1} 1.48500 0.06900 0.07400 ++ 0.00000 {?} {296.HB2} 0.77300 0.11300 0.12200 ++ 0.00000 {?} {296.CB} 26.73600 0.78700 0.78700 ? 0.00000 {?} 45.61810 0.49980 0 {?} 0 709 {311.HA} 4.07300 0.06600 0.06600 ++ 0.00000 {?} {311.HG1} 1.24000 0.11500 0.11500 ++ 0.00000 {?} {311.CG} 26.15300 0.41900 0.78700 ? 0.00000 {?} 7.62210 0.14190 0 {?} 0 710 {311.HE1} 2.59500 0.06300 0.06300 ? 0.00000 {?} {311.HG1} 1.24500 0.12900 0.12900 ++ 0.00000 {?} {311.CG} 26.21200 0.06900 0.78700 ? 0.00000 {?} 4.52440 0.13060 0 {?} 0 711 {380.HB1} 1.26800 0.07000 0.07000 ++ 0.00000 {?} {382.HG} 0.96200 0.13800 0.11800 ++ 0.00000 {?} {382.CG} 26.42300 0.78700 0.78700 ? 0.00000 {?} 14.03950 0.18690 0 {?} 0 712 {362.HD11} 0.70500 0.06300 0.06300 ++ 0.00000 {?} {362.HG} 1.41100 0.14900 0.14900 ++ 0.00000 {?} {362.CG} 26.49100 0.46600 0.46600 ? 0.00000 {?} 26.95560 0.34260 0 {?} 0 713 {362.HD21} 0.53700 0.06900 0.06900 ++ 0.00000 {?} {362.HG} 1.40900 0.17200 0.17200 ++ 0.00000 {?} {362.CG} 26.42700 0.21200 0.21200 ++ 0.00000 {?} 8.20030 0.23180 0 {?} 0 714 {382.HD21} 0.08600 0.10000 0.12000 ++ 0.00000 {?} {382.HG} 0.95600 0.12400 0.16100 ++ 0.00000 {?} {382.CG} 26.40800 0.78700 0.78700 ? 0.00000 {?} 66.36090 0.48940 0 {?} 0 715 {389.HA} 4.41000 0.08200 0.08200 ++ 0.00000 {?} {309.HD11} 0.77800 0.09800 0.09800 ++ 0.00000 {?} {309.CD1} 26.23200 0.49500 0.49500 ? 0.00000 {?} 25.67840 0.37270 0 {?} 0 716 {303.HA} 4.25800 0.02500 0.08300 ? 0.00000 {?} {303.HD11} 0.77400 0.09100 0.13700 ++ 0.00000 {?} {303.CD1} 26.22900 0.78700 0.78700 ? 0.00000 {?} 26.84390 0.79730 0 {?} 0 717 {311.HA} 4.07200 0.05800 0.05800 ? 0.00000 {?} {311.HG2} 0.78000 0.10800 0.10800 ++ 0.00000 {?} {311.CG} 26.15700 0.26300 0.26300 ++ 0.00000 {?} 4.71680 0.17200 0 {?} 0 718 {311.HE1} 2.58700 0.07200 0.07200 ? 0.00000 {?} {311.HG2} 0.77600 0.10800 0.10800 ? 0.00000 {?} {311.CG} 26.21600 0.01500 0.01500 ? 0.00000 {?} 5.57440 0.18890 0 {?} 0 719 {311.HB1} 1.84600 0.03800 0.10900 ? 0.00000 {?} {311.HG2} 0.77600 0.08000 0.14700 ++ 0.00000 {?} {311.CG} 26.24500 0.78700 0.78700 ? 0.00000 {?} 59.22720 1.24530 0 {?} 0 720 {311.HB2} 1.71600 0.10000 0.08100 ++ 0.00000 {?} {311.HG1} 1.23600 0.18100 0.14100 ++ 0.00000 {?} {311.CG} 26.15500 0.78700 0.78700 ? 0.00000 {?} 28.61050 0.31660 0 {?} 0 721 {311.HB2} 1.70800 0.07800 0.13900 ? 0.00000 {?} {311.HG2} 0.76300 0.06500 0.18400 ? 0.00000 {?} {311.CG} 26.16300 0.78700 0.78700 ? 0.00000 {?} 113.68100 1.58310 0 {?} 0 722 {311.HD1} 1.47900 0.08500 0.07500 ++ 0.00000 {?} {311.HG1} 1.24900 0.14800 0.13100 ++ 0.00000 {?} {311.CG} 26.15400 0.78700 0.78700 ? 0.00000 {?} 21.53890 0.25290 0 {?} 0 723 {309.HG} 1.34400 0.03100 0.07800 ? 0.00000 {?} {309.HD11} 0.78100 0.06700 0.14900 ++ 0.00000 {?} {309.CD1} 26.19900 0.78700 0.78700 ? 0.00000 {?} 60.97250 1.98620 0 {?} 0 724 {390.HG21} 1.22000 0.05800 0.09200 ? 0.00000 {?} {309.HD11} 0.77800 0.08000 0.15000 ? 0.00000 {?} {309.CD1} 26.17700 0.78700 0.78700 ? 0.00000 {?} 75.80570 1.10830 0 {?} 0 725 {279.HG21} 0.98000 0.07100 0.11600 ++ 0.00000 {?} {303.HD11} 0.75200 0.10400 0.15000 ? 0.00000 {?} {303.CD1} 26.05800 0.78700 0.78700 ? 0.00000 {?} 102.65500 1.04050 0 {?} 0 726 {311.HG2} 0.73600 0.07400 0.07400 ++ 0.00000 {?} {311.HG1} 1.24000 0.14800 0.14800 ++ 0.00000 {?} {311.CG} 26.19200 0.78700 0.78700 ? 0.00000 {?} 22.83950 0.12360 0 {?} 0 727 {303.HD21} 0.61900 0.02000 0.07700 ? 0.00000 {?} {303.HD11} 0.76300 0.07300 0.17000 ? 0.00000 {?} {303.CD1} 26.14200 0.78700 0.78700 ? 0.00000 {?} 74.31660 2.85160 0 {?} 0 728 {386.HA} 4.58200 0.08900 0.08900 ++ 0.00000 {?} {386.HD11} 0.28100 0.16700 0.12600 ++ 0.00000 {?} {386.CD1} 25.86600 0.78700 0.78700 ? 0.00000 {?} 20.22700 0.22990 0 {?} 0 729 {329.HA} 4.48600 0.05700 0.05700 ++ 0.00000 {?} {329.HG1} 1.68500 0.13200 0.13200 ++ 0.00000 {?} {329.CG} 25.99000 0.21500 0.21500 ? 0.00000 {?} 8.79560 0.24910 0 {?} 0 730 {329.HA} 4.49000 0.05200 0.05200 ++ 0.00000 {?} {329.HG2} 1.56400 0.14400 0.14400 ++ 0.00000 {?} {329.CG} 25.98400 0.51700 0.51700 ? 0.00000 {?} 25.68460 0.35360 0 {?} 0 731 {385.HB1} 2.67900 0.07500 0.07500 ++ 0.00000 {?} {280.HD11} 0.95200 0.13000 0.13000 ++ 0.00000 {?} {280.CD1} 25.63600 0.11400 0.11400 ++ 0.00000 {?} 9.18330 0.29020 0 {?} 0 732 {385.HG2} 2.38300 0.09700 0.11200 ++ 0.00000 {?} {280.HD11} 0.95400 0.13900 0.17300 ++ 0.00000 {?} {280.CD1} 25.67800 0.78700 0.78700 ? 0.00000 {?} 82.00280 0.59870 0 {?} 0 733 {329.HB1} 2.10100 0.08600 0.09200 ++ 0.00000 {?} {329.HG1} 1.68300 0.10800 0.15000 ? 0.00000 {?} {329.CG} 25.94000 0.78700 0.78700 ? 0.00000 {?} 54.50750 0.45090 0 {?} 0 734 {329.HB1} 2.10100 0.09100 0.10200 ++ 0.00000 {?} {329.HG2} 1.55700 0.11700 0.13100 ? 0.00000 {?} {329.CG} 25.95000 0.78700 0.78700 ? 0.00000 {?} 77.72130 0.54000 0 {?} 0 735 {386.HB2} 1.97900 0.06800 0.07400 ? 0.00000 {?} {386.HD11} 0.28100 0.10400 0.11300 ++ 0.00000 {?} {386.CD1} 25.82900 0.78700 0.78700 ? 0.00000 {?} 38.59040 0.41510 0 {?} 0 736 {329.HD1} 1.87200 0.05600 0.07400 ++ 0.00000 {?} {329.HG1} 1.67700 0.05600 0.09600 ? 0.00000 {?} {329.CG} 26.01100 0.78700 0.78700 ? 0.00000 {?} 42.00240 0.79560 0 {?} 0 737 {329.HD1} 1.87700 0.05700 0.10600 ? 0.00000 {?} {329.HG2} 1.56400 0.07300 0.12100 ? 0.00000 {?} {329.CG} 25.93100 0.78700 0.78700 ? 0.00000 {?} 62.16300 0.88140 0 {?} 0 738 {352.HB2} 1.70500 0.10100 0.12600 ++ 0.00000 {?} {386.HD11} 0.28200 0.10700 0.13200 ++ 0.00000 {?} {386.CD1} 25.81900 0.78700 0.78700 ? 0.00000 {?} 52.49700 0.48110 0 {?} 0 739 {386.HG} 1.21400 0.08700 0.10100 ++ 0.00000 {?} {386.HD11} 0.28200 0.11400 0.13400 ++ 0.00000 {?} {386.CD1} 25.83200 0.78700 0.78700 ? 0.00000 {?} 47.41580 0.45390 0 {?} 0 740 {386.HD21} 0.84000 0.05800 0.12100 ++ 0.00000 {?} {386.HD11} 0.28000 0.07700 0.14500 ++ 0.00000 {?} {386.CD1} 25.82100 0.78700 0.78700 ? 0.00000 {?} 58.68640 0.96570 0 {?} 0 741 {315.HA} 4.51900 0.07300 0.07500 ++ 0.00000 {?} {315.HG1} 1.31900 0.07900 0.11900 ? 0.00000 {?} {315.CG} 25.54400 0.78700 0.78700 ? 0.00000 {?} 26.42270 0.33960 0 {?} 0 742 {315.HA} 4.52500 0.06200 0.07300 ++ 0.00000 {?} {315.HG2} 1.15200 0.15000 0.19300 ? 0.00000 {?} {315.CG} 25.55900 0.78700 0.78700 ? 0.00000 {?} 47.05480 0.39440 0 {?} 0 743 {329.HA} 4.48800 0.07000 0.11000 ? 0.00000 {?} {357.HD11} 1.01400 0.11800 0.13900 ? 0.00000 {?} {357.CD1} 25.56000 0.78700 0.78700 ? 0.00000 {?} 54.42840 0.47820 0 {?} 0 744 {389.HA} 4.42300 0.08600 0.08600 ++ 0.00000 {?} {389.HD11} 0.66200 0.09300 0.09300 ++ 0.00000 {?} {389.CD1} 25.27100 0.49600 0.78700 ? 0.00000 {?} 20.91420 0.30110 0 {?} 0 745 {343.HA} 4.20400 0.08200 0.12700 ? 0.00000 {?} {343.HD11} 1.02900 0.10600 0.15900 ++ 0.00000 {?} {343.CD1} 25.50900 0.78700 0.78700 ? 0.00000 {?} 97.27160 0.96170 0 {?} 0 746 {282.HB2} 3.29600 0.07800 0.07800 ++ 0.00000 {?} {389.HD11} 0.65100 0.10400 0.10400 ++ 0.00000 {?} {389.CD1} 25.28100 0.26400 0.78700 ? 0.00000 {?} 9.87520 0.26700 0 {?} 0 747 {329.HE1} 3.10300 0.06600 0.08300 ++ 0.00000 {?} {357.HD11} 0.99800 0.09200 0.12500 ++ 0.00000 {?} {357.CD1} 25.51000 0.78700 0.78700 ? 0.00000 {?} 53.77890 0.66820 0 {?} 0 748 {277.HG1} 2.47000 0.06200 0.06200 ? 0.00000 {?} {389.HD11} 0.65500 0.13600 0.13600 ? 0.00000 {?} {389.CD1} 25.27000 0.03200 0.78700 ? 0.00000 {?} 6.86990 0.20040 0 {?} 0 749 {329.HB1} 2.11400 0.11400 0.11400 ++ 0.00000 {?} {357.HD11} 1.00800 0.16400 0.13900 ++ 0.00000 {?} {357.CD1} 25.45600 0.78700 0.78700 ? 0.00000 {?} 66.82940 0.50510 0 {?} 0 750 {389.HB2} 1.57800 0.07700 0.10500 ? 0.00000 {?} {389.HD11} 0.65900 0.07400 0.09400 ++ 0.00000 {?} {389.CD1} 25.55600 0.78700 0.78700 ? 0.00000 {?} 42.09910 0.50180 0 {?} 0 751 {389.HG} 1.48400 0.03400 0.06500 ? 0.00000 {?} {389.HD11} 0.66200 0.05000 0.10000 ++ 0.00000 {?} {389.CD1} 25.50300 0.78700 0.78700 ? 0.00000 {?} 25.68730 0.83440 0 {?} 0 752 {315.HG1} 1.31200 0.06200 0.08900 ++ 0.00000 {?} {315.HG2} 1.15800 0.14800 0.14800 ? 0.00000 {?} {315.CG} 25.56200 0.78700 0.78700 ? 0.00000 {?} 141.07739 1.16810 0 {?} 0 753 {315.HG2} 1.15100 0.05200 0.10300 ++ 0.00000 {?} {315.HG1} 1.31800 0.08200 0.16800 ? 0.00000 {?} {315.CG} 25.54500 0.78700 0.78700 ? 0.00000 {?} 56.53040 0.93830 0 {?} 0 754 {383.HG12} 0.84700 0.08500 0.08500 ++ 0.00000 {?} {383.HG11} 1.23600 0.14900 0.14900 ++ 0.00000 {?} {383.CG1} 25.69100 0.29600 0.29600 ? 0.00000 {?} 7.16630 0.13410 0 {?} 0 755 {357.HA} 4.28600 0.08800 0.12700 ? 0.00000 {?} {357.HD11} 1.00800 0.11000 0.12900 ++ 0.00000 {?} {357.CD1} 25.45500 0.78700 0.78700 ? 0.00000 {?} 71.97260 0.53410 0 {?} 0 756 {348.HA} 4.05400 0.05500 0.07400 ++ 0.00000 {?} {348.HG2} 1.45700 0.09800 0.09800 ? 0.00000 {?} {348.CG} 25.35100 0.78700 0.78700 ? 0.00000 {?} 47.01380 0.59090 0 {?} 0 757 {279.HA} 3.60900 0.09900 0.09900 ++ 0.00000 {?} {389.HD11} 0.65700 0.13300 0.13300 ++ 0.00000 {?} {389.CD1} 25.27300 0.26600 0.26600 ? 0.00000 {?} 9.70860 0.28360 0 {?} 0 758 {387.HB2} 2.20500 0.07700 0.07700 ++ 0.00000 {?} {362.HD11} 0.68800 0.09600 0.09600 ++ 0.00000 {?} {362.CD1} 25.17200 0.37200 0.78700 ? 0.00000 {?} 12.13970 0.33360 0 {?} 0 759 {357.HG} 1.80400 0.03600 0.08100 ? 0.00000 {?} {357.HD11} 1.00100 0.05900 0.15300 ? 0.00000 {?} {357.CD1} 25.44700 0.78700 0.78700 ? 0.00000 {?} 125.25340 3.46280 0 {?} 0 760 {357.HD21} 0.80500 0.02500 0.12200 ? 0.00000 {?} {357.HD11} 1.00800 0.09500 0.19100 ? 0.00000 {?} {357.CD1} 25.48000 0.78700 0.78700 ? 0.00000 {?} 165.64079 4.70290 0 {?} 0 761 {362.HD21} 0.54000 0.08900 0.09500 ? 0.00000 {?} {362.HD11} 0.68800 0.07200 0.15700 ? 0.00000 {?} {362.CD1} 25.14500 0.78700 0.78700 ? 0.00000 {?} 99.10360 1.14600 0 {?} 0 762 {333.HA} 4.72600 0.07600 0.07600 ? 0.00000 {?} {333.HG1} 1.36800 0.13400 0.12100 ++ 0.00000 {?} {333.CG} 25.06900 0.78700 0.78700 ? 0.00000 {?} 34.74510 0.41300 0 {?} 0 763 {376.HA} 4.70500 0.06100 0.07600 ? 0.00000 {?} {376.HD11} 0.94600 0.09500 0.12100 ++ 0.00000 {?} {376.CD1} 25.09500 0.78700 0.78700 ? 0.00000 {?} 22.48540 0.32450 0 {?} 0 764 {358.HA} 4.60600 0.06100 0.08300 ++ 0.00000 {?} {358.HG2} 1.45300 0.07500 0.13600 ? 0.00000 {?} {358.CG} 25.16900 0.78700 0.78700 ? 0.00000 {?} 43.63890 0.66370 0 {?} 0 765 {382.HA} 4.61400 0.09200 0.09200 ? 0.00000 {?} {382.HD11} 0.10700 0.16600 0.16600 ++ 0.00000 {?} {382.CD1} 25.14200 0.24800 0.24800 ++ 0.00000 {?} 9.06530 0.19370 0 {?} 0 766 {392.HA} 4.59100 0.06400 0.09400 ++ 0.00000 {?} {392.HD11} 0.93300 0.09800 0.13300 ++ 0.00000 {?} {392.CD1} 25.09200 0.78700 0.78700 ? 0.00000 {?} 53.11750 0.64830 0 {?} 0 767 {390.HB} 4.25700 0.02900 0.06600 ? 0.00000 {?} {392.HD11} 0.93300 0.11800 0.12600 ++ 0.00000 {?} {392.CD1} 25.12200 0.78700 0.78700 ? 0.00000 {?} 23.68380 0.40320 0 {?} 0 768 {393.HB} 4.22400 0.07900 0.07900 ++ 0.00000 {?} {395.HG1} 1.48000 0.26500 0.20500 ++ 0.00000 {?} {395.CG} 25.03700 0.78700 0.78700 ? 0.00000 {?} 31.72080 0.26370 0 {?} 0 769 {301.HA} 4.05600 0.04700 0.07300 ++ 0.00000 {?} {301.HG2} 1.55100 0.12800 0.12800 ? 0.00000 {?} {301.CG} 25.22800 0.78700 0.78700 ? 0.00000 {?} 69.02120 0.85830 0 {?} 0 770 {377.HD1} 3.98400 0.10400 0.08800 ++ 0.00000 {?} {376.HD11} 0.95000 0.16600 0.14700 ++ 0.00000 {?} {376.CD1} 25.20600 0.78700 0.78700 ? 0.00000 {?} 13.53000 0.13650 0 {?} 0 771 {384.HA} 3.80600 0.09600 0.09200 ++ 0.00000 {?} {362.HD11} 0.69700 0.11900 0.11900 ++ 0.00000 {?} {362.CD1} 25.21400 0.21900 0.21900 ? 0.00000 {?} 9.90990 0.27780 0 {?} 0 772 {364.HB1} 3.65900 0.07500 0.07500 ++ 0.00000 {?} {382.HD11} 0.10200 0.14100 0.14100 ++ 0.00000 {?} {382.CD1} 25.10400 0.13300 0.13300 ++ 0.00000 {?} 6.91050 0.19370 0 {?} 0 773 {377.HD2} 3.64800 0.06400 0.05600 ++ 0.00000 {?} {376.HD11} 0.95700 0.12600 0.11100 ++ 0.00000 {?} {376.CD1} 25.11400 0.78700 0.78700 ? 0.00000 {?} 5.02900 0.12300 0 {?} 0 774 {364.HB2} 3.44700 0.08500 0.08500 ++ 0.00000 {?} {382.HD11} 0.10400 0.13900 0.13900 ++ 0.00000 {?} {382.CD1} 25.09800 0.20800 0.20800 ++ 0.00000 {?} 6.13700 0.15640 0 {?} 0 775 {301.HE1} 3.04400 0.06000 0.07200 ++ 0.00000 {?} {301.HG1} 1.64200 0.10800 0.12800 ? 0.00000 {?} {301.CG} 25.08700 0.78700 0.78700 ? 0.00000 {?} 43.87570 0.53420 0 {?} 0 776 {395.HE1} 3.01600 0.06000 0.11600 ++ 0.00000 {?} {395.HG1} 1.47400 0.15000 0.23600 ? 0.00000 {?} {395.CG} 24.99200 0.78700 0.78700 ? 0.00000 {?} 184.63251 1.57890 0 {?} 0 777 {333.HE1} 2.96900 0.05300 0.07800 ++ 0.00000 {?} {333.HG1} 1.36700 0.12200 0.23600 ? 0.00000 {?} {333.CG} 25.05700 0.78700 0.78700 ? 0.00000 {?} 66.22060 0.74340 0 {?} 0 778 {317.HB1} 2.93100 0.07000 0.07000 ++ 0.00000 {?} {382.HD11} 0.10300 0.11600 0.11600 ? 0.00000 {?} {382.CD1} 25.10900 0.07900 0.07900 ++ 0.00000 {?} 4.74800 0.13010 0 {?} 0 779 {317.HB2} 2.23700 0.08200 0.08200 ++ 0.00000 {?} {382.HD11} 0.10300 0.14400 0.14400 ++ 0.00000 {?} {382.CD1} 25.11800 0.37500 0.37500 ++ 0.00000 {?} 7.46430 0.18800 0 {?} 0 780 {339.HG1} 2.07600 0.07100 0.07100 ? 0.00000 {?} {333.HG1} 1.37400 0.13100 0.13100 ? 0.00000 {?} {333.CG} 25.11500 0.01400 0.01400 ? 0.00000 {?} 24.52080 0.38050 0 {?} 0 781 {301.HB1} 2.00000 0.06100 0.10500 ++ 0.00000 {?} {301.HG1} 1.64700 0.10700 0.17000 ? 0.00000 {?} {301.CG} 25.11300 0.78700 0.78700 ? 0.00000 {?} 101.10630 1.05770 0 {?} 0 782 {301.HB1} 1.98700 0.04100 0.09600 ? 0.00000 {?} {301.HG2} 1.53100 0.09000 0.14200 ? 0.00000 {?} {301.CG} 25.15300 0.78700 0.78700 ? 0.00000 {?} 80.91850 1.39450 0 {?} 0 783 {395.HB1} 1.92100 0.03000 0.06900 ? 0.00000 {?} {395.HG1} 1.47500 0.09600 0.19000 ? 0.00000 {?} {395.CG} 25.10500 0.78700 0.78700 ? 0.00000 {?} 100.36150 1.88910 0 {?} 0 784 {358.HD1} 1.74700 0.02500 0.08200 ? 0.00000 {?} {358.HG1} 1.50400 0.09300 0.14300 ? 0.00000 {?} {358.CG} 24.98400 0.78700 0.78700 ? 0.00000 {?} 182.69859 4.65650 0 {?} 0 785 {376.HB1} 1.66500 0.06700 0.10400 ? 0.00000 {?} {376.HD11} 0.96500 0.07500 0.16000 ? 0.00000 {?} {376.CD1} 25.20000 0.78700 0.78700 ? 0.00000 {?} 344.87881 3.69370 0 {?} 0 786 {392.HG} 1.57900 0.07800 0.07800 ? 0.00000 {?} {392.HD11} 0.93300 0.05600 0.14100 ? 0.00000 {?} {392.CD1} 25.08100 0.78700 0.78700 ? 0.00000 {?} 221.53371 3.38920 0 {?} 0 787 {362.HG} 1.40100 0.08200 0.08200 ? 0.00000 {?} {362.HD11} 0.69200 0.09300 0.09800 ++ 0.00000 {?} {362.CD1} 25.21100 0.78700 0.78700 ? 0.00000 {?} 61.89810 0.60610 0 {?} 0 788 {322.HG11} 1.27400 0.07200 0.07200 ++ 0.00000 {?} {362.HD11} 0.68600 0.12200 0.12200 ++ 0.00000 {?} {362.CD1} 25.17400 0.33300 0.33300 ? 0.00000 {?} 13.08860 0.28640 0 {?} 0 789 {380.HB1} 1.26900 0.03900 0.06600 ++ 0.00000 {?} {382.HD11} 0.10400 0.08900 0.14400 ++ 0.00000 {?} {382.CD1} 25.11800 0.78700 0.78700 ? 0.00000 {?} 26.08190 0.51310 0 {?} 0 790 {390.HG21} 1.21500 0.07600 0.07600 ++ 0.00000 {?} {392.HD11} 0.92800 0.13300 0.13300 ++ 0.00000 {?} {392.CD1} 25.12900 0.15700 0.15700 ++ 0.00000 {?} 28.90400 0.67850 0 {?} 0 791 {393.HG21} 1.21100 0.05300 0.05300 ? 0.00000 {?} {395.HG1} 1.49100 0.04300 0.09800 ? 0.00000 {?} {395.CG} 25.04700 0.78700 0.78700 ? 0.00000 {?} 2.89980 0.07770 0 {?} 0 792 {362.HB2} 1.19200 0.07300 0.07300 ++ 0.00000 {?} {362.HD11} 0.69000 0.15300 0.09800 ++ 0.00000 {?} {362.CD1} 25.17700 0.27500 0.27500 ? 0.00000 {?} 11.21610 0.37690 0 {?} 0 793 {382.HB2} 1.01000 0.02200 0.07400 ? 0.00000 {?} {382.HD11} 0.10400 0.11000 0.11600 ++ 0.00000 {?} {382.CD1} 25.12000 0.78700 0.78700 ? 0.00000 {?} 14.58700 0.42200 0 {?} 0 794 {279.HG21} 0.97800 0.04800 0.08200 ++ 0.00000 {?} {362.HD11} 0.68400 0.08800 0.13900 ? 0.00000 {?} {362.CD1} 25.20300 0.78700 0.78700 ? 0.00000 {?} 102.37420 1.34170 0 {?} 0 795 {357.HD11} 0.97500 0.06200 0.06200 ++ 0.00000 {?} {358.HG1} 1.50800 0.08500 0.10600 ? 0.00000 {?} {358.CG} 25.00100 0.78700 0.78700 ? 0.00000 {?} 11.11910 0.11200 0 {?} 0 796 {382.HG} 0.95500 0.05000 0.07600 ? 0.00000 {?} {382.HD11} 0.10300 0.08500 0.13200 ++ 0.00000 {?} {382.CD1} 25.12000 0.78700 0.78700 ? 0.00000 {?} 40.36930 0.63900 0 {?} 0 797 {319.HG11} 0.78800 0.07600 0.07600 ? 0.00000 {?} {362.HD11} 0.68400 0.14500 0.14500 ? 0.00000 {?} {362.CD1} 25.18100 0.78700 0.78700 ? 0.00000 {?} 396.12451 1.90150 0 {?} 0 798 {357.HD21} 0.80400 0.07000 0.07000 ++ 0.00000 {?} {358.HG1} 1.50600 0.13300 0.13300 ++ 0.00000 {?} {358.CG} 25.03700 0.47500 0.78700 ? 0.00000 {?} 15.89350 0.18140 0 {?} 0 799 {308.HG21} 0.71600 0.04900 0.05500 ++ 0.00000 {?} {382.HD11} 0.10200 0.11600 0.14300 ++ 0.00000 {?} {382.CD1} 25.12000 0.78700 0.78700 ? 0.00000 {?} 29.67120 0.37000 0 {?} 0 800 {389.HD21} 0.63600 0.08500 0.08500 ? 0.00000 {?} {392.HD11} 0.92900 0.10100 0.16600 ? 0.00000 {?} {392.CD1} 25.16600 0.78700 0.78700 ? 0.00000 {?} 40.86450 0.37040 0 {?} 0 801 {382.HD11} 0.09700 0.10800 0.10800 ++ 0.00000 {?} {362.HD11} 0.69000 0.12200 0.12200 ++ 0.00000 {?} {362.CD1} 25.17600 0.20100 0.20100 ? 0.00000 {?} 7.81900 0.20540 0 {?} 0 802 {294.HA} 4.44500 0.06500 0.08100 ++ 0.00000 {?} {294.HG1} 1.15200 0.10200 0.12400 ++ 0.00000 {?} {294.CG} 24.78600 0.78700 0.78700 ? 0.00000 {?} 46.50560 0.59660 0 {?} 0 803 {274.HA} 4.41600 0.02000 0.08100 ? 0.00000 {?} {274.HD11} 0.93700 0.09700 0.14300 ++ 0.00000 {?} {274.CD1} 24.96600 0.78700 0.78700 ? 0.00000 {?} 17.96850 0.65550 0 {?} 0 804 {395.HA} 4.31900 0.05200 0.10400 ++ 0.00000 {?} {395.HG1} 1.47100 0.12000 0.23600 ? 0.00000 {?} {395.CG} 24.92800 0.78700 0.78700 ? 0.00000 {?} 130.88989 1.68930 0 {?} 0 805 {303.HA} 4.25600 0.07300 0.09900 ++ 0.00000 {?} {303.HD21} 0.61600 0.09800 0.14200 ++ 0.00000 {?} {303.CD2} 24.77700 0.78700 0.78700 ? 0.00000 {?} 56.96130 0.70710 0 {?} 0 806 {294.HE1} 2.96300 0.06800 0.07900 ++ 0.00000 {?} {294.HG1} 1.15000 0.11000 0.13500 ++ 0.00000 {?} {294.CG} 24.84300 0.78700 0.78700 ? 0.00000 {?} 45.58360 0.59240 0 {?} 0 807 {328.HD2} 3.56300 0.06100 0.06100 ++ 0.00000 {?} {328.HG1} 1.99900 0.06700 0.10400 ? 0.00000 {?} {328.CG} 24.74000 0.19400 0.78700 ? 0.00000 {?} 4.04870 0.15420 0 {?} 0 808 {328.HD1} 3.56000 0.06100 0.06100 ++ 0.00000 {?} {328.HG2} 1.95200 0.09900 0.09900 ? 0.00000 {?} {328.CG} 24.73200 0.37800 0.78700 ? 0.00000 {?} 4.74350 0.14100 0 {?} 0 809 {294.HB1} 1.93200 0.06000 0.06800 ++ 0.00000 {?} {294.HG1} 1.15700 0.10900 0.12500 ++ 0.00000 {?} {294.CG} 24.76700 0.78700 0.78700 ? 0.00000 {?} 50.94290 0.64010 0 {?} 0 810 {294.HB2} 1.67400 0.05500 0.09000 ++ 0.00000 {?} {294.HG1} 1.15100 0.07200 0.14200 ? 0.00000 {?} {294.CG} 24.85200 0.78700 0.78700 ? 0.00000 {?} 70.72170 1.05550 0 {?} 0 811 {303.HB2} 1.31700 0.09000 0.09100 ++ 0.00000 {?} {303.HD21} 0.61700 0.13700 0.13700 ++ 0.00000 {?} {303.CD2} 24.80300 0.78700 0.78700 ? 0.00000 {?} 65.34470 0.48480 0 {?} 0 812 {279.HG21} 0.98000 0.04600 0.06900 ++ 0.00000 {?} {303.HD21} 0.62500 0.10700 0.10700 ? 0.00000 {?} {303.CD2} 24.81800 0.78700 0.78700 ? 0.00000 {?} 93.12070 1.16630 0 {?} 0 813 {303.HD11} 0.74800 0.03500 0.10800 ? 0.00000 {?} {303.HD21} 0.62400 0.06000 0.12000 ? 0.00000 {?} {303.CD2} 24.72800 0.78700 0.78700 ? 0.00000 {?} 121.47230 2.90260 0 {?} 0 814 {279.HA} 3.60500 0.08700 0.09700 ++ 0.00000 {?} {279.HG11} 0.80100 0.13300 0.15000 ++ 0.00000 {?} {279.CG1} 24.66100 0.78700 0.78700 ? 0.00000 {?} 44.40110 0.49690 0 {?} 0 815 {387.HB1} 2.77000 0.11600 0.11600 ++ 0.00000 {?} {279.HG11} 0.80900 0.15700 0.12400 ++ 0.00000 {?} {279.CG1} 24.66600 0.48400 0.48400 ? 0.00000 {?} 22.30300 0.32970 0 {?} 0 816 {279.HB} 2.20800 0.07100 0.09800 ++ 0.00000 {?} {279.HG11} 0.80800 0.07900 0.12000 ++ 0.00000 {?} {279.CG1} 24.65700 0.78700 0.78700 ? 0.00000 {?} 60.86660 0.82350 0 {?} 0 817 {308.HB} 1.95000 0.09100 0.09100 ? 0.00000 {?} {279.HG11} 0.81100 0.11400 0.11400 ? 0.00000 {?} {279.CG1} 24.68500 0.02000 0.02000 ? 0.00000 {?} 10.62060 0.24500 0 {?} 0 818 {389.HG} 1.48500 0.09100 0.08100 ++ 0.00000 {?} {279.HG11} 0.80100 0.13100 0.13100 ++ 0.00000 {?} {279.CG1} 24.65100 0.51800 0.51800 ? 0.00000 {?} 29.43950 0.38260 0 {?} 0 819 {389.HD21} 0.63300 0.03700 0.09400 ? 0.00000 {?} {279.HG11} 0.80500 0.05400 0.11800 ? 0.00000 {?} {279.CG1} 24.66400 0.78700 0.78700 ? 0.00000 {?} 72.30020 1.95960 0 {?} 0 820 {279.HA} 3.61000 0.08100 0.08100 ? 0.00000 {?} {389.HD21} 0.62800 0.11300 0.11300 ++ 0.00000 {?} {389.CD2} 24.26700 0.08800 0.08800 ++ 0.00000 {?} 5.67810 0.21620 0 {?} 0 821 {306.HB1} 1.86000 0.07400 0.10100 ? 0.00000 {?} {306.HD11} 0.63500 0.15900 0.15900 ++ 0.00000 {?} {306.CD1} 24.25300 0.78700 0.78700 ? 0.00000 {?} 61.14650 0.40070 0 {?} 0 822 {299.HB} 1.73500 0.04400 0.08500 ? 0.00000 {?} {299.HG11} 0.65000 0.06000 0.11600 ? 0.00000 {?} {299.CG1} 24.19300 0.78700 0.78700 ? 0.00000 {?} 59.81700 1.29700 0 {?} 0 823 {359.HA} 4.54100 0.08000 0.08000 ? 0.00000 {?} {280.HD21} 0.94000 0.07400 0.10900 ++ 0.00000 {?} {280.CD2} 24.09400 0.78700 0.78700 ? 0.00000 {?} 16.94840 0.16490 0 {?} 0 824 {389.HA} 4.42300 0.07100 0.11300 ++ 0.00000 {?} {389.HD21} 0.63200 0.08800 0.13900 ? 0.00000 {?} {389.CD2} 24.16400 0.78700 0.78700 ? 0.00000 {?} 80.66760 1.05690 0 {?} 0 825 {283.HA} 3.97400 0.09000 0.09000 ++ 0.00000 {?} {299.HG11} 0.67500 0.13500 0.13500 ++ 0.00000 {?} {299.CG1} 24.12300 0.50500 0.50500 ? 0.00000 {?} 27.86890 0.36120 0 {?} 0 826 {377.HD1} 3.96600 0.09500 0.09500 ++ 0.00000 {?} {376.HD21} 0.90700 0.11200 0.10500 ++ 0.00000 {?} {376.CD2} 24.00000 0.78700 0.78700 ? 0.00000 {?} 12.70660 0.12750 0 {?} 0 827 {377.HD2} 3.65200 0.07800 0.07800 ++ 0.00000 {?} {376.HD21} 0.90700 0.12800 0.10500 ++ 0.00000 {?} {376.CD2} 24.07800 0.78700 0.78700 ? 0.00000 {?} 9.44870 0.12730 0 {?} 0 828 {299.HA} 3.19300 0.06700 0.11100 ++ 0.00000 {?} {299.HG11} 0.67300 0.09500 0.15700 ++ 0.00000 {?} {299.CG1} 24.12600 0.78700 0.78700 ? 0.00000 {?} 80.07160 1.04710 0 {?} 0 829 {283.HB2} 2.45400 0.09700 0.09700 ++ 0.00000 {?} {299.HG11} 0.66800 0.18700 0.12600 ++ 0.00000 {?} {299.CG1} 24.13300 0.48900 0.33700 ? 0.00000 {?} 11.94640 0.31740 0 {?} 0 830 {376.HG} 2.02500 0.07400 0.07400 ++ 0.00000 {?} {376.HD21} 0.92500 0.08500 0.08500 ++ 0.00000 {?} {376.CD2} 23.94500 0.51600 0.78700 ? 0.00000 {?} 8.13550 0.14700 0 {?} 0 831 {274.HG} 1.60400 0.03100 0.07400 ? 0.00000 {?} {274.HD21} 0.88900 0.08100 0.14800 ++ 0.00000 {?} {274.CD2} 23.79300 0.78700 0.78700 ? 0.00000 {?} 93.27460 1.69520 0 {?} 0 832 {389.HB2} 1.57900 0.08200 0.09600 ? 0.00000 {?} {389.HD21} 0.63500 0.08800 0.09900 ++ 0.00000 {?} {389.CD2} 24.18000 0.51000 0.78700 ? 0.00000 {?} 39.08010 0.60860 0 {?} 0 833 {389.HG} 1.48400 0.05600 0.08200 ? 0.00000 {?} {389.HD21} 0.63400 0.08600 0.12100 ++ 0.00000 {?} {389.CD2} 24.17900 0.78700 0.78700 ? 0.00000 {?} 62.63660 0.97340 0 {?} 0 834 {389.HA} 4.43100 0.06000 0.09100 ++ 0.00000 {?} {309.HD21} 0.74300 0.05300 0.12100 ? 0.00000 {?} {309.CD2} 23.79100 0.78700 0.78700 ? 0.00000 {?} 30.46870 0.54500 0 {?} 0 835 {280.HA} 4.13000 0.06500 0.10500 ++ 0.00000 {?} {280.HD11} 0.95100 0.09200 0.13800 ++ 0.00000 {?} {280.CD1} 23.77200 0.78700 0.78700 ? 0.00000 {?} 51.10110 0.71840 0 {?} 0 836 {311.HA} 4.07200 0.06100 0.06100 ++ 0.00000 {?} {309.HD21} 0.73900 0.08300 0.08300 ++ 0.00000 {?} {309.CD2} 23.74700 0.14200 0.14200 ++ 0.00000 {?} 2.74010 0.08860 0 {?} 0 837 {388.HB1} 3.09300 0.07400 0.07400 ++ 0.00000 {?} {309.HD21} 0.74900 0.13800 0.13800 ++ 0.00000 {?} {309.CD2} 23.75900 0.27600 0.27600 ++ 0.00000 {?} 9.43700 0.26130 0 {?} 0 838 {280.HB1} 1.92200 0.08200 0.10400 ? 0.00000 {?} {280.HD11} 0.96700 0.08800 0.11900 ++ 0.00000 {?} {280.CD1} 23.81200 0.78700 0.78700 ? 0.00000 {?} 56.84970 0.51820 0 {?} 0 839 {274.HB1} 1.65600 0.03400 0.06700 ? 0.00000 {?} {274.HD21} 0.88800 0.05800 0.13600 ? 0.00000 {?} {274.CD2} 23.80300 0.78700 0.78700 ? 0.00000 {?} 70.82150 2.21620 0 {?} 0 840 {309.HG} 1.34000 0.04300 0.10100 ? 0.00000 {?} {309.HD21} 0.74500 0.06700 0.11800 ++ 0.00000 {?} {309.CD2} 23.79600 0.78700 0.78700 ? 0.00000 {?} 56.83020 1.19140 0 {?} 0 841 {390.HG21} 1.21600 0.08500 0.10500 ? 0.00000 {?} {309.HD21} 0.74300 0.10100 0.12900 ++ 0.00000 {?} {309.CD2} 23.79700 0.78700 0.78700 ? 0.00000 {?} 55.56000 0.53760 0 {?} 0 842 {274.HA} 4.42100 0.05200 0.11700 ++ 0.00000 {?} {274.HD21} 0.88100 0.08500 0.19300 ? 0.00000 {?} {274.CD2} 23.65200 0.78700 0.78700 ? 0.00000 {?} 95.35760 1.65180 0 {?} 0 843 {384.HB1} 2.43400 0.08900 0.09100 ++ 0.00000 {?} {279.HG21} 0.98000 0.09900 0.10100 ++ 0.00000 {?} {279.CG2} 23.27000 0.78700 0.78700 ? 0.00000 {?} 44.26320 0.41100 0 {?} 0 844 {384.HB2} 1.93100 0.03400 0.09900 ? 0.00000 {?} {279.HG21} 0.98100 0.11700 0.14100 ++ 0.00000 {?} {279.CG2} 23.30000 0.78700 0.78700 ? 0.00000 {?} 36.24640 0.63600 0 {?} 0 845 {392.HA} 4.58900 0.04500 0.11000 ++ 0.00000 {?} {392.HD21} 0.89700 0.06100 0.17100 ? 0.00000 {?} {392.CD2} 23.25000 0.78700 0.78700 ? 0.00000 {?} 77.40440 1.98630 0 {?} 0 846 {357.HA} 4.29100 0.07500 0.14700 ? 0.00000 {?} {357.HD21} 0.80900 0.07900 0.15900 ++ 0.00000 {?} {357.CD2} 23.14200 0.78700 0.78700 ? 0.00000 {?} 70.66320 0.89920 0 {?} 0 847 {384.HA} 3.80500 0.07200 0.07200 ++ 0.00000 {?} {279.HG21} 0.98500 0.15600 0.15600 ++ 0.00000 {?} {279.CG2} 23.27800 0.34500 0.34500 ++ 0.00000 {?} 8.47080 0.26260 0 {?} 0 848 {279.HA} 3.60500 0.09200 0.10100 ++ 0.00000 {?} {279.HG21} 0.98600 0.11500 0.12700 ++ 0.00000 {?} {279.CG2} 23.27100 0.78700 0.78700 ? 0.00000 {?} 41.79370 0.45160 0 {?} 0 849 {310.HB} 3.39200 0.07500 0.11900 ++ 0.00000 {?} {310.HG21} 1.25900 0.11900 0.20100 ++ 0.00000 {?} {310.CG2} 23.22500 0.78700 0.78700 ? 0.00000 {?} 74.94820 0.78000 0 {?} 0 850 {279.HB} 2.20500 0.06600 0.08500 ++ 0.00000 {?} {279.HG21} 0.98100 0.08600 0.11500 ++ 0.00000 {?} {279.CG2} 23.31100 0.78700 0.78700 ? 0.00000 {?} 52.42430 0.68130 0 {?} 0 851 {392.HG} 1.57700 0.05200 0.11200 ? 0.00000 {?} {392.HD21} 0.89300 0.05100 0.14600 ? 0.00000 {?} {392.CD2} 23.27000 0.78700 0.78700 ? 0.00000 {?} 124.09140 2.80600 0 {?} 0 852 {343.HD21} 0.99700 0.03400 0.10800 ? 0.00000 {?} {357.HD21} 0.81100 0.04500 0.14000 ? 0.00000 {?} {357.CD2} 23.17600 0.78700 0.78700 ? 0.00000 {?} 103.76980 3.46420 0 {?} 0 853 {308.HG21} 0.76000 0.08200 0.08200 ++ 0.00000 {?} {310.HG21} 1.26800 0.11000 0.11000 ++ 0.00000 {?} {310.CG2} 23.14300 0.21100 0.78700 ? 0.00000 {?} 5.38700 0.14350 0 {?} 0 854 {362.HD11} 0.70700 0.04200 0.09300 ? 0.00000 {?} {279.HG21} 0.97800 0.07500 0.16700 ? 0.00000 {?} {279.CG2} 23.28900 0.78700 0.78700 ? 0.00000 {?} 61.21360 1.16200 0 {?} 0 855 {303.HD21} 0.62200 0.04400 0.08200 ? 0.00000 {?} {279.HG21} 0.98300 0.06100 0.15600 ? 0.00000 {?} {279.CG2} 23.28700 0.78700 0.78700 ? 0.00000 {?} 42.93590 1.01050 0 {?} 0 856 {362.HD21} 0.53700 0.07200 0.08500 ? 0.00000 {?} {279.HG21} 0.98500 0.04900 0.13300 ? 0.00000 {?} {279.CG2} 23.27300 0.78700 0.78700 ? 0.00000 {?} 23.85980 0.44910 0 {?} 0 857 {382.HD21} 0.07000 0.08500 0.11400 ++ 0.00000 {?} {310.HG21} 1.26300 0.09600 0.13700 ++ 0.00000 {?} {310.CG2} 23.23600 0.78700 0.78700 ? 0.00000 {?} 44.36470 0.46790 0 {?} 0 858 {362.HA} 4.46400 0.08000 0.10300 ++ 0.00000 {?} {362.HD21} 0.53500 0.11300 0.14400 ++ 0.00000 {?} {362.CD2} 23.00000 0.78700 0.78700 ? 0.00000 {?} 56.35640 0.60660 0 {?} 0 859 {322.HA} 4.14800 0.13000 0.13000 ++ 0.00000 {?} {362.HD21} 0.53600 0.16900 0.15400 ++ 0.00000 {?} {362.CD2} 23.00000 0.78700 0.78700 ? 0.00000 {?} 41.06760 0.29640 0 {?} 0 860 {283.HE1} 1.92400 0.07300 0.07300 ++ 0.00000 {?} {362.HD21} 0.53600 0.14100 0.14100 ++ 0.00000 {?} {362.CD2} 23.00000 0.06400 0.06400 ++ 0.00000 {?} 11.07050 0.29270 0 {?} 0 861 {357.HG} 1.79400 0.07100 0.12000 ? 0.00000 {?} {357.HD21} 0.80800 0.05300 0.16000 ? 0.00000 {?} {357.CD2} 23.27200 0.78700 0.78700 ? 0.00000 {?} 109.67700 1.85990 0 {?} 0 862 {362.HB1} 1.69100 0.10300 0.10300 ++ 0.00000 {?} {362.HD21} 0.54300 0.12400 0.12400 ++ 0.00000 {?} {362.CD2} 23.00000 0.20400 0.20400 ? 0.00000 {?} 13.57420 0.28860 0 {?} 0 863 {362.HG} 1.40700 0.10600 0.12400 ++ 0.00000 {?} {362.HD21} 0.53600 0.12400 0.14400 ++ 0.00000 {?} {362.CD2} 23.00000 0.78700 0.78700 ? 0.00000 {?} 74.29720 0.59000 0 {?} 0 864 {322.HG11} 1.30100 0.10800 0.10800 ++ 0.00000 {?} {362.HD21} 0.54100 0.11500 0.11500 ++ 0.00000 {?} {362.CD2} 23.00000 0.78700 0.78700 ? 0.00000 {?} 49.39040 0.48870 0 {?} 0 865 {362.HB2} 1.18800 0.07000 0.07000 ++ 0.00000 {?} {362.HD21} 0.53600 0.09600 0.09600 ++ 0.00000 {?} {362.CD2} 23.00000 0.15400 0.15400 ++ 0.00000 {?} 9.74080 0.28760 0 {?} 0 866 {279.HG21} 0.98000 0.10600 0.11000 ++ 0.00000 {?} {362.HD21} 0.53400 0.13000 0.13900 ++ 0.00000 {?} {362.CD2} 23.00000 0.78700 0.78700 ? 0.00000 {?} 78.28910 0.58830 0 {?} 0 867 {362.HD11} 0.71300 0.01500 0.05700 ? 0.00000 {?} {362.HD21} 0.53600 0.07800 0.16300 ++ 0.00000 {?} {362.CD2} 23.00000 0.78700 0.78700 ? 0.00000 {?} 37.35110 1.86160 0 {?} 0 868 {322.HG21} -0.51600 0.11000 0.11000 ++ 0.00000 {?} {362.HD21} 0.53500 0.20900 0.17500 ++ 0.00000 {?} {362.CD2} 23.00000 0.35500 0.35500 ? 0.00000 {?} 15.92240 0.37470 0 {?} 0 869 {306.HA} 4.39500 0.03600 0.11600 ? 0.00000 {?} {306.HD21} 0.81200 0.08200 0.16700 ++ 0.00000 {?} {306.CD2} 22.66900 0.78700 0.78700 ? 0.00000 {?} 62.76380 1.37190 0 {?} 0 870 {303.HA} 4.28300 0.10000 0.10000 ? 0.00000 {?} {306.HD21} 0.81200 0.13700 0.17400 ++ 0.00000 {?} {306.CD2} 22.73100 0.78700 0.78700 ? 0.00000 {?} 107.56280 0.71560 0 {?} 0 871 {306.HG} 1.83100 0.03800 0.09600 ? 0.00000 {?} {306.HD21} 0.81200 0.05700 0.13700 ++ 0.00000 {?} {306.CD2} 22.77700 0.78700 0.78700 ? 0.00000 {?} 83.20080 2.05870 0 {?} 0 872 {306.HB2} 1.36700 0.04400 0.11700 ? 0.00000 {?} {306.HD21} 0.80600 0.12200 0.15900 ++ 0.00000 {?} {306.CD2} 22.62300 0.48700 0.78700 ? 0.00000 {?} 47.49170 0.74930 0 {?} 0 873 {319.HA} 3.63500 0.04200 0.06900 ++ 0.00000 {?} {319.HG11} 0.82400 0.05600 0.08300 ? 0.00000 {?} {319.CG1} 22.52800 0.78700 0.78700 ? 0.00000 {?} 29.29670 0.74480 0 {?} 0 874 {319.HA} 3.63600 0.04600 0.07100 ++ 0.00000 {?} {319.HG21} 0.74500 0.07500 0.07500 ? 0.00000 {?} {319.CG2} 22.52900 0.78700 0.78700 ? 0.00000 {?} 39.47760 0.76120 0 {?} 0 875 {319.HB} 2.48400 0.06700 0.10400 ++ 0.00000 {?} {319.HG11} 0.82400 0.05600 0.08700 ? 0.00000 {?} {319.CG1} 22.50900 0.78700 0.78700 ? 0.00000 {?} 53.61330 0.98310 0 {?} 0 876 {319.HB} 2.48100 0.06700 0.10000 ++ 0.00000 {?} {319.HG21} 0.73700 0.07300 0.07300 ? 0.00000 {?} {319.CG2} 22.52200 0.78700 0.78700 ? 0.00000 {?} 62.18660 0.92010 0 {?} 0 877 {393.HG21} 1.20700 0.05300 0.08400 ? 0.00000 {?} {306.HD21} 0.81900 0.10800 0.17700 ++ 0.00000 {?} {306.CD2} 22.47200 0.78700 0.78700 ? 0.00000 {?} 89.33200 1.08090 0 {?} 0 878 {306.HD11} 0.63300 0.04000 0.08600 ? 0.00000 {?} {306.HD21} 0.81400 0.06200 0.14200 ? 0.00000 {?} {306.CD2} 22.56700 0.78700 0.78700 ? 0.00000 {?} 72.64780 1.90770 0 {?} 0 879 {362.HD21} 0.53800 0.06400 0.08400 ? 0.00000 {?} {319.HG21} 0.74400 0.04400 0.09600 ? 0.00000 {?} {319.CG2} 22.56800 0.78700 0.78700 ? 0.00000 {?} 32.52900 0.69910 0 {?} 0 880 {362.HD21} 0.53800 0.07400 0.07400 ++ 0.00000 {?} {319.HG11} 0.82300 0.07100 0.07100 ++ 0.00000 {?} {319.CG1} 22.59100 0.11800 0.11800 ? 0.00000 {?} 19.97860 0.62250 0 {?} 0 881 {382.HA} 4.60500 0.05600 0.09900 ++ 0.00000 {?} {382.HD21} 0.06300 0.09700 0.15800 ++ 0.00000 {?} {382.CD2} 22.13600 0.78700 0.78700 ? 0.00000 {?} 37.39980 0.50300 0 {?} 0 882 {386.HA} 4.58600 0.06900 0.11400 ++ 0.00000 {?} {386.HD21} 0.83600 0.08900 0.14500 ++ 0.00000 {?} {386.CD2} 22.10000 0.78700 0.78700 ? 0.00000 {?} 83.78320 0.99260 0 {?} 0 883 {352.HG1} 2.39000 0.10400 0.10400 ? 0.00000 {?} {386.HD21} 0.84600 0.16300 0.11500 ++ 0.00000 {?} {386.CD2} 22.12400 0.27500 0.78700 ? 0.00000 {?} 11.50960 0.24480 0 {?} 0 884 {380.HB1} 1.25800 0.04300 0.09500 ++ 0.00000 {?} {382.HD21} 0.06300 0.06700 0.14400 ++ 0.00000 {?} {382.CD2} 22.16500 0.78700 0.78700 ? 0.00000 {?} 35.52380 0.77660 0 {?} 0 885 {382.HG} 0.95900 0.04000 0.06400 ++ 0.00000 {?} {382.HD21} 0.06100 0.08400 0.13600 ++ 0.00000 {?} {382.CD2} 22.17200 0.78700 0.78700 ? 0.00000 {?} 25.57900 0.47610 0 {?} 0 886 {316.HB} 3.89300 0.05800 0.11300 ++ 0.00000 {?} {316.HG21} 1.04000 0.08300 0.16700 ++ 0.00000 {?} {316.CG2} 22.02100 0.78700 0.78700 ? 0.00000 {?} 82.02980 1.29890 0 {?} 0 887 {386.HB2} 1.94300 0.07000 0.13300 ? 0.00000 {?} {386.HD21} 0.83900 0.10400 0.14200 ++ 0.00000 {?} {386.CD2} 21.99600 0.78700 0.78700 ? 0.00000 {?} 76.67210 0.70520 0 {?} 0 888 {309.HB1} 1.69200 0.08700 0.08700 ++ 0.00000 {?} {316.HG21} 1.03700 0.13300 0.13300 ++ 0.00000 {?} {316.CG2} 21.97700 0.17100 0.17100 ++ 0.00000 {?} 11.98290 0.27790 0 {?} 0 889 {309.HB2} 1.34100 0.07100 0.08100 ++ 0.00000 {?} {316.HG21} 1.03800 0.10300 0.11800 ++ 0.00000 {?} {316.CG2} 22.02600 0.78700 0.78700 ? 0.00000 {?} 63.66140 0.70670 0 {?} 0 890 {319.HG11} 0.81100 0.07900 0.07900 ++ 0.00000 {?} {382.HD21} 0.06100 0.12700 0.12700 ++ 0.00000 {?} {382.CD2} 22.17000 0.24700 0.24700 ++ 0.00000 {?} 5.95150 0.13020 0 {?} 0 891 {307.HG21} 0.80800 0.01100 0.06900 ? 0.00000 {?} {316.HG21} 1.03700 0.06600 0.12900 ? 0.00000 {?} {316.CG2} 22.01200 0.78700 0.78700 ? 0.00000 {?} 11.88220 1.22710 0 {?} 0 892 {309.HD21} 0.74900 0.06200 0.06300 ? 0.00000 {?} {316.HG21} 1.03700 0.04700 0.11800 ? 0.00000 {?} {316.CG2} 22.02600 0.78700 0.78700 ? 0.00000 {?} 83.49280 1.81320 0 {?} 0 893 {386.HD11} 0.27900 0.04600 0.08400 ++ 0.00000 {?} {386.HD21} 0.84000 0.10900 0.20100 ++ 0.00000 {?} {386.CD2} 22.08900 0.78700 0.78700 ? 0.00000 {?} 61.43630 1.02880 0 {?} 0 894 {390.HA} 4.60800 0.03700 0.10000 ? 0.00000 {?} {390.HG21} 1.21100 0.08500 0.19400 ++ 0.00000 {?} {390.CG2} 21.60300 0.78700 0.78700 ? 0.00000 {?} 107.81600 2.28910 0 {?} 0 895 {389.HA} 4.42300 0.11000 0.11000 ++ 0.00000 {?} {308.HG11} 0.64300 0.17900 0.14900 ++ 0.00000 {?} {308.CG1} 21.67300 0.78700 0.78700 ? 0.00000 {?} 33.25420 0.36500 0 {?} 0 896 {375.HA} 4.36700 0.04500 0.09700 ? 0.00000 {?} {375.HG21} 1.23100 0.07400 0.15600 ++ 0.00000 {?} {375.CG2} 21.73300 0.78700 0.78700 ? 0.00000 {?} 93.19540 1.95330 0 {?} 0 897 {375.HB} 4.18700 0.02700 0.08600 ? 0.00000 {?} {375.HG21} 1.21800 0.07500 0.17400 ? 0.00000 {?} {375.CG2} 21.61900 0.78700 0.78700 ? 0.00000 {?} 138.53239 4.08870 0 {?} 0 898 {374.HA2} 3.97800 0.05900 0.07700 ? 0.00000 {?} {375.HG21} 1.24800 0.26600 0.15600 ++ 0.00000 {?} {375.CG2} 21.70400 0.46400 0.46400 ++ 0.00000 {?} 7.83410 0.11750 0 {?} 0 899 {299.HA} 3.20800 0.08600 0.07700 ++ 0.00000 {?} {299.HG21} 0.82300 0.14700 0.13100 ++ 0.00000 {?} {299.CG2} 21.66800 0.78700 0.78700 ? 0.00000 {?} 29.14730 0.45720 0 {?} 0 900 {296.HA} 3.02400 0.08900 0.08600 ++ 0.00000 {?} {299.HG21} 0.82400 0.14900 0.14400 ++ 0.00000 {?} {299.CG2} 21.66300 0.78700 0.78700 ? 0.00000 {?} 23.21850 0.35730 0 {?} 0 901 {387.HB2} 2.21300 0.12400 0.12400 ++ 0.00000 {?} {308.HG11} 0.63200 0.21300 0.13000 ++ 0.00000 {?} {308.CG1} 21.65100 0.37500 0.78700 ? 0.00000 {?} 10.65270 0.27540 0 {?} 0 902 {308.HB} 1.96900 0.07200 0.09200 ++ 0.00000 {?} {308.HG11} 0.63300 0.07800 0.10700 ++ 0.00000 {?} {308.CG1} 21.66300 0.78700 0.78700 ? 0.00000 {?} 43.85750 0.57690 0 {?} 0 903 {353.HB2} 1.82000 0.09500 0.09500 ++ 0.00000 {?} {355.HG21} 1.21200 0.15800 0.15800 ? 0.00000 {?} {355.CG2} 21.40000 0.05700 0.05700 ++ 0.00000 {?} 33.02930 0.66830 0 {?} 0 904 {309.HB1} 1.68500 0.08100 0.09300 ++ 0.00000 {?} {390.HG21} 1.21500 0.11900 0.13900 ++ 0.00000 {?} {390.CG2} 21.67300 0.78700 0.78700 ? 0.00000 {?} 87.69820 0.72570 0 {?} 0 905 {361.HB} 1.44700 0.06600 0.11600 ++ 0.00000 {?} {361.HG11} 0.43500 0.08000 0.14200 ++ 0.00000 {?} {361.CG1} 21.75600 0.78700 0.78700 ? 0.00000 {?} 23.21760 0.30070 0 {?} 0 906 {319.HG11} 0.80500 0.03200 0.07700 ? 0.00000 {?} {308.HG11} 0.63900 0.05000 0.13900 ? 0.00000 {?} {308.CG1} 21.65600 0.78700 0.78700 ? 0.00000 {?} 80.18710 2.56910 0 {?} 0 907 {306.HD21} 0.79300 0.02800 0.08200 ? 0.00000 {?} {393.HG21} 1.20800 0.05700 0.16100 ? 0.00000 {?} {393.CG2} 21.61500 0.78700 0.78700 ? 0.00000 {?} 52.06540 1.93900 0 {?} 0 908 {299.HG11} 0.69400 0.02200 0.10700 ? 0.00000 {?} {299.HG21} 0.82800 0.04900 0.14900 ? 0.00000 {?} {299.CG2} 21.71300 0.78700 0.78700 ? 0.00000 {?} 55.24890 2.20360 0 {?} 0 909 {306.HD11} 0.63400 0.06400 0.07900 ? 0.00000 {?} {393.HG21} 1.20900 0.08900 0.12200 ++ 0.00000 {?} {393.CG2} 21.65400 0.78700 0.78700 ? 0.00000 {?} 19.87190 0.30920 0 {?} 0 910 {361.HG11} 0.43000 0.05900 0.10900 ++ 0.00000 {?} {361.HG21} 0.23600 0.05800 0.12000 ? 0.00000 {?} {361.CG2} 21.73200 0.78700 0.78700 ? 0.00000 {?} 23.37780 0.40520 0 {?} 0 911 {361.HG21} 0.22800 0.06000 0.12400 ++ 0.00000 {?} {361.HG11} 0.43400 0.07500 0.16700 ? 0.00000 {?} {361.CG1} 21.75400 0.78700 0.78700 ? 0.00000 {?} 30.60880 0.41410 0 {?} 0 912 {355.HA} 4.47400 0.05000 0.10700 ? 0.00000 {?} {355.HG21} 1.20600 0.07700 0.19100 ? 0.00000 {?} {355.CG2} 21.47200 0.78700 0.78700 ? 0.00000 {?} 113.23710 1.97320 0 {?} 0 913 {316.HB} 3.88600 0.07000 0.07000 ? 0.00000 {?} {390.HG21} 1.19700 0.11600 0.11600 ++ 0.00000 {?} {390.CG2} 21.54900 0.78700 0.78700 ? 0.00000 {?} 5.87760 0.08010 0 {?} 0 914 {316.HB} 3.89100 0.05300 0.08800 ++ 0.00000 {?} {307.HG21} 0.80300 0.08000 0.14500 ? 0.00000 {?} {307.CG2} 21.36300 0.78700 0.78700 ? 0.00000 {?} 50.71380 0.90080 0 {?} 0 915 {354.HA} 3.77600 0.07700 0.07700 ++ 0.00000 {?} {355.HG21} 1.19100 0.10300 0.10300 ++ 0.00000 {?} {355.CG2} 21.43300 0.38200 0.38200 ++ 0.00000 {?} 1.55930 0.09480 0 {?} 0 916 {356.HB1} 3.01700 0.06300 0.06300 ? 0.00000 {?} {355.HG21} 1.21000 0.10800 0.10800 ++ 0.00000 {?} {355.CG2} 21.37300 0.07500 0.07500 ++ 0.00000 {?} 3.67650 0.19720 0 {?} 0 917 {353.HG1} 2.12200 0.08400 0.10100 ++ 0.00000 {?} {355.HG21} 1.20000 0.13400 0.17400 ++ 0.00000 {?} {355.CG2} 21.48700 0.78700 0.78700 ? 0.00000 {?} 80.00590 0.89080 0 {?} 0 918 {299.HB} 1.74200 0.01900 0.09200 ? 0.00000 {?} {299.HG21} 0.82400 0.09600 0.16700 ? 0.00000 {?} {299.CG2} 21.55200 0.78700 0.78700 ? 0.00000 {?} 42.49120 1.30850 0 {?} 0 919 {390.HG21} 1.21500 0.07300 0.09900 ++ 0.00000 {?} {307.HG21} 0.80700 0.07300 0.10500 ++ 0.00000 {?} {307.CG2} 21.47400 0.78700 0.78700 ? 0.00000 {?} 94.15270 1.15930 0 {?} 0 920 {316.HG21} 1.03400 0.03900 0.08800 ? 0.00000 {?} {307.HG21} 0.80700 0.07800 0.11600 ++ 0.00000 {?} {307.CG2} 21.37300 0.78700 0.78700 ? 0.00000 {?} 55.63620 1.02900 0 {?} 0 921 {392.HD11} 0.92700 0.05400 0.09000 ? 0.00000 {?} {390.HG21} 1.21900 0.07500 0.15900 ? 0.00000 {?} {390.CG2} 21.61500 0.78700 0.78700 ? 0.00000 {?} 59.79240 1.00240 0 {?} 0 922 {394.HA} 4.69300 0.04900 0.06300 ? 0.00000 {?} {307.HG21} 0.80600 0.08500 0.08500 ? 0.00000 {?} {307.CG2} 21.24500 0.37700 0.37700 ? 0.00000 {?} 6.53260 0.26010 0 {?} 0 923 {363.HA} 4.59400 0.04700 0.09600 ? 0.00000 {?} {363.HG21} 0.89300 0.09900 0.16300 ? 0.00000 {?} {363.CG2} 21.19100 0.78700 0.78700 ? 0.00000 {?} 55.09570 0.70190 0 {?} 0 924 {340.HA} 4.52100 0.08000 0.08000 ? 0.00000 {?} {331.HG21} 0.96100 0.03300 0.10400 ? 0.00000 {?} {331.CG2} 21.22400 0.78700 0.78700 ? 0.00000 {?} 8.86660 0.26750 0 {?} 0 925 {270.HA} 4.41000 0.03500 0.07800 ? 0.00000 {?} {269.HG11} 0.94100 0.09500 0.13300 ++ 0.00000 {?} {269.CG1} 21.13800 0.78700 0.78700 ? 0.00000 {?} 27.54100 0.56900 0 {?} 0 926 {272.HA} 4.33000 0.06800 0.06800 ? 0.00000 {?} {273.HG11} 0.94200 0.14800 0.13300 ++ 0.00000 {?} {273.CG1} 21.08300 0.78700 0.78700 ? 0.00000 {?} 25.90000 0.29390 0 {?} 0 927 {269.HA} 4.20000 0.04100 0.07000 ++ 0.00000 {?} {269.HG11} 0.93500 0.07000 0.11300 ++ 0.00000 {?} {269.CG1} 21.14500 0.78700 0.78700 ? 0.00000 {?} 30.03450 0.82490 0 {?} 0 928 {273.HA} 4.10200 0.04200 0.09400 ++ 0.00000 {?} {273.HG11} 0.94200 0.09100 0.18300 ++ 0.00000 {?} {273.CG1} 21.04200 0.78700 0.78700 ? 0.00000 {?} 87.80570 1.78860 0 {?} 0 929 {341.HB2} 3.94800 0.07300 0.08400 ? 0.00000 {?} {331.HG21} 0.96800 0.11600 0.13000 ++ 0.00000 {?} {331.CG2} 21.21400 0.78700 0.78700 ? 0.00000 {?} 41.10430 0.32040 0 {?} 0 930 {331.HB} 3.82400 0.05700 0.10400 ? 0.00000 {?} {331.HG21} 0.96900 0.07700 0.15500 ++ 0.00000 {?} {331.CG2} 21.22700 0.78700 0.78700 ? 0.00000 {?} 46.00040 0.73210 0 {?} 0 931 {394.HB2} 2.56800 0.07500 0.07500 ++ 0.00000 {?} {307.HG21} 0.79900 0.11000 0.11000 ++ 0.00000 {?} {307.CG2} 21.25900 0.17300 0.17300 ? 0.00000 {?} 8.27130 0.25920 0 {?} 0 932 {321.HB2} 2.26000 0.08400 0.08400 ++ 0.00000 {?} {363.HG21} 0.90000 0.11500 0.11500 ++ 0.00000 {?} {363.CG2} 21.17500 0.31500 0.31500 ? 0.00000 {?} 13.29490 0.29000 0 {?} 0 933 {269.HB} 2.18100 0.05000 0.10800 ? 0.00000 {?} {269.HG11} 0.93600 0.07400 0.12100 ++ 0.00000 {?} {269.CG1} 21.12100 0.78700 0.78700 ? 0.00000 {?} 60.32460 1.19990 0 {?} 0 934 {273.HB} 2.06200 0.05400 0.11100 ? 0.00000 {?} {273.HG11} 0.94000 0.09100 0.23600 ? 0.00000 {?} {273.CG1} 21.05000 0.78700 0.78700 ? 0.00000 {?} 206.12610 3.16100 0 {?} 0 935 {307.HB} 1.80200 0.03600 0.10500 ? 0.00000 {?} {307.HG21} 0.80700 0.07400 0.14700 ? 0.00000 {?} {307.CG2} 21.28600 0.78700 0.78700 ? 0.00000 {?} 84.28600 2.03010 0 {?} 0 936 {339.HB1} 1.75400 0.06900 0.07400 ++ 0.00000 {?} {331.HG21} 0.96300 0.06400 0.12300 ? 0.00000 {?} {331.CG2} 21.23900 0.78700 0.78700 ? 0.00000 {?} 44.19930 0.62810 0 {?} 0 937 {363.HB} 1.67000 0.07400 0.10500 ? 0.00000 {?} {363.HG21} 0.89700 0.03700 0.10900 ? 0.00000 {?} {363.CG2} 21.25000 0.78700 0.78700 ? 0.00000 {?} 45.66610 0.98210 0 {?} 0 938 {392.HB2} 1.56500 0.08300 0.08300 ? 0.00000 {?} {307.HG21} 0.80500 0.10100 0.11100 ++ 0.00000 {?} {307.CG2} 21.26600 0.78700 0.78700 ? 0.00000 {?} 46.14530 0.48160 0 {?} 0 939 {306.HB2} 1.35700 0.09000 0.09000 ++ 0.00000 {?} {307.HG11} 0.80900 0.09000 0.09000 ? 0.00000 {?} {307.CG1} 21.23600 0.04400 0.04400 ++ 0.00000 {?} 13.11770 0.30550 0 {?} 0 940 {278.HB} 4.67600 0.03300 0.09800 ? 0.00000 {?} {278.HG21} 0.95100 0.04700 0.13400 ? 0.00000 {?} {278.CG2} 20.92000 0.78700 0.78700 ? 0.00000 {?} 18.62000 0.61140 0 {?} 0 941 {340.HA} 4.50800 0.08900 0.11100 ++ 0.00000 {?} {340.HG11} 0.45300 0.14600 0.17600 ++ 0.00000 {?} {340.CG1} 20.55000 0.78700 0.78700 ? 0.00000 {?} 22.06080 0.17430 0 {?} 0 942 {290.HB} 3.97800 0.06200 0.10600 ++ 0.00000 {?} {290.HG21} 1.22700 0.09800 0.18000 ++ 0.00000 {?} {290.CG2} 20.75900 0.78700 0.78700 ? 0.00000 {?} 91.84220 1.29420 0 {?} 0 943 {340.HB} 1.75900 0.06200 0.10800 ++ 0.00000 {?} {340.HG11} 0.44700 0.09300 0.16700 ++ 0.00000 {?} {340.CG1} 20.54000 0.78700 0.78700 ? 0.00000 {?} 21.05490 0.28510 0 {?} 0 944 {340.HG21} 0.81300 0.05600 0.10200 ++ 0.00000 {?} {340.HG11} 0.44900 0.06200 0.19100 ? 0.00000 {?} {340.CG1} 20.55100 0.78700 0.78700 ? 0.00000 {?} 22.80050 0.38470 0 {?} 0 945 {340.HA} 4.50700 0.06000 0.10100 ++ 0.00000 {?} {340.HG21} 0.80600 0.08800 0.14100 ++ 0.00000 {?} {340.CG2} 20.48900 0.78700 0.78700 ? 0.00000 {?} 32.53080 0.43500 0 {?} 0 946 {340.HG11} 0.44400 0.04000 0.09900 ++ 0.00000 {?} {340.HG21} 0.81200 0.05800 0.14200 ? 0.00000 {?} {340.CG2} 20.50400 0.78700 0.78700 ? 0.00000 {?} 18.36780 0.47070 0 {?} 0 947 {363.HA} 4.58400 0.04100 0.10000 ? 0.00000 {?} {363.HG11} 0.77300 0.10300 0.13300 ++ 0.00000 {?} {363.CG1} 20.07300 0.78700 0.78700 ? 0.00000 {?} 25.48320 0.42870 0 {?} 0 948 {380.HA} 4.45000 0.05900 0.11500 ++ 0.00000 {?} {380.HB1} 1.25100 0.07400 0.15700 ++ 0.00000 {?} {380.CB} 19.86000 0.78700 0.78700 ? 0.00000 {?} 51.22860 0.75410 0 {?} 0 949 {364.HB1} 3.66200 0.08600 0.08600 ++ 0.00000 {?} {380.HB1} 1.25000 0.14700 0.13600 ++ 0.00000 {?} {380.CB} 19.86000 0.78700 0.78700 ? 0.00000 {?} 24.25020 0.26790 0 {?} 0 950 {364.HB2} 3.44900 0.07300 0.07300 ++ 0.00000 {?} {380.HB1} 1.24400 0.23500 0.14100 ++ 0.00000 {?} {380.CB} 19.86900 0.38000 0.78700 ? 0.00000 {?} 5.84650 0.18700 0 {?} 0 951 {323.HB1} 2.87200 0.11200 0.11200 ++ 0.00000 {?} {363.HG11} 0.77300 0.14500 0.14500 ++ 0.00000 {?} {363.CG1} 20.05200 0.14600 0.14600 ++ 0.00000 {?} 10.03340 0.21070 0 {?} 0 952 {321.HB1} 2.69900 0.09700 0.09700 ++ 0.00000 {?} {363.HG11} 0.77300 0.12600 0.11000 ++ 0.00000 {?} {363.CG1} 20.04300 0.32300 0.78700 ? 0.00000 {?} 7.27280 0.21380 0 {?} 0 953 {321.HB2} 2.25400 0.12300 0.12300 ++ 0.00000 {?} {363.HG11} 0.78400 0.14700 0.14700 ++ 0.00000 {?} {363.CG1} 20.09900 0.78700 0.78700 ? 0.00000 {?} 53.24070 0.39190 0 {?} 0 954 {269.HB} 2.17900 0.05300 0.07100 ++ 0.00000 {?} {269.HG21} 0.94000 0.05800 0.14900 ? 0.00000 {?} {269.CG2} 19.99600 0.78700 0.78700 ? 0.00000 {?} 36.02980 0.79000 0 {?} 0 955 {323.HB2} 2.12900 0.04000 0.08800 ? 0.00000 {?} {363.HG11} 0.77600 0.13200 0.13200 ++ 0.00000 {?} {363.CG1} 20.07800 0.78700 0.78700 ? 0.00000 {?} 25.65520 0.35850 0 {?} 0 956 {363.HB} 1.66200 0.06500 0.09600 ++ 0.00000 {?} {363.HG11} 0.77800 0.11100 0.15800 ++ 0.00000 {?} {363.CG1} 20.08400 0.78700 0.78700 ? 0.00000 {?} 62.96930 0.70920 0 {?} 0 957 {382.HG} 0.95900 0.07800 0.08300 ++ 0.00000 {?} {380.HB1} 1.25000 0.09700 0.10300 ++ 0.00000 {?} {380.CB} 19.89000 0.78700 0.78700 ? 0.00000 {?} 10.50300 0.12680 0 {?} 0 958 {382.HD21} 0.07200 0.08100 0.12100 ++ 0.00000 {?} {380.HB1} 1.24500 0.12000 0.19400 ++ 0.00000 {?} {380.CB} 19.86000 0.78700 0.78700 ? 0.00000 {?} 52.00800 0.48780 0 {?} 0 959 {269.HA} 4.19700 0.06600 0.06600 ++ 0.00000 {?} {269.HG21} 0.93500 0.12400 0.12200 ++ 0.00000 {?} {269.CG2} 19.99600 0.78700 0.78700 ? 0.00000 {?} 24.64980 0.42330 0 {?} 0 960 {335.HA} 4.17100 0.05600 0.15400 ++ 0.00000 {?} {335.HB1} 1.53500 0.08500 0.23600 ? 0.00000 {?} {335.CB} 18.19000 0.78700 0.78700 ? 0.00000 {?} 77.27140 1.10140 0 {?} 0 961 {354.HA} 3.77700 0.08600 0.09700 ++ 0.00000 {?} {354.HG21} 0.81300 0.14400 0.16600 ++ 0.00000 {?} {354.CG2} 18.24100 0.78700 0.78700 ? 0.00000 {?} 45.37180 0.49630 0 {?} 0 962 {?} 2.87600 0.09600 0.09600 ++ 0.00000 {?} {?} 0.80800 0.15100 0.15100 ++ 0.00000 {?} {?} 18.19700 0.09500 0.09500 ++ 0.00000 {?} 9.42430 0.18490 0 {?} 0 963 {328.HB1} 2.40000 0.10200 0.10200 ++ 0.00000 {?} {354.HG21} 0.81200 0.15500 0.15500 ++ 0.00000 {?} {354.CG2} 18.23000 0.25400 0.78700 ? 0.00000 {?} 8.23110 0.21220 0 {?} 0 964 {354.HB} 1.66700 0.09000 0.14500 ++ 0.00000 {?} {354.HG21} 0.81000 0.08600 0.12500 ++ 0.00000 {?} {354.CG2} 18.24000 0.78700 0.78700 ? 0.00000 {?} 81.92040 0.91450 0 {?} 0 965 {343.HD11} 1.04400 0.05300 0.08200 ? 0.00000 {?} {354.HG21} 0.81000 0.10800 0.10700 ++ 0.00000 {?} {354.CG2} 18.21700 0.78700 0.78700 ? 0.00000 {?} 20.97040 0.41820 0 {?} 0 966 {363.HA} 4.57100 0.06800 0.06800 ++ 0.00000 {?} {381.HE1} 2.03900 0.09100 0.09100 ++ 0.00000 {?} {381.CE} 18.15100 0.25200 0.25200 ++ 0.00000 {?} 3.56510 0.12210 0 {?} 0 967 {381.HG1} 2.71900 0.08200 0.08200 ++ 0.00000 {?} {381.HE1} 2.04400 0.16200 0.11900 ++ 0.00000 {?} {381.CE} 18.12400 0.43200 0.43200 ? 0.00000 {?} 9.62660 0.21760 0 {?} 0 968 {387.HB2} 2.22000 0.08400 0.09900 ++ 0.00000 {?} {308.HG21} 0.75500 0.09500 0.11100 ++ 0.00000 {?} {308.CG2} 17.96800 0.78700 0.78700 ? 0.00000 {?} 42.44360 0.43490 0 {?} 0 969 {308.HB} 1.97600 0.07700 0.10300 ++ 0.00000 {?} {308.HG21} 0.75400 0.09200 0.11900 ++ 0.00000 {?} {308.CG2} 17.96700 0.78700 0.78700 ? 0.00000 {?} 40.47210 0.49100 0 {?} 0 970 {381.HB1} 1.93800 0.05800 0.08400 ? 0.00000 {?} {381.HE1} 2.04500 0.04400 0.11100 ? 0.00000 {?} {381.CE} 18.12000 0.78700 0.78700 ? 0.00000 {?} 72.90040 1.55540 0 {?} 0 971 {381.HB2} 1.44200 0.08600 0.08600 ++ 0.00000 {?} {381.HE1} 2.04400 0.12800 0.11600 ++ 0.00000 {?} {381.CE} 18.07300 0.47900 0.47900 ? 0.00000 {?} 7.19880 0.12340 0 {?} 0 972 {310.HG21} 1.25500 0.06200 0.06200 ++ 0.00000 {?} {308.HG21} 0.75700 0.11600 0.11600 ++ 0.00000 {?} {308.CG2} 17.92800 0.21000 0.78700 ? 0.00000 {?} 5.11210 0.20220 0 {?} 0 973 {363.HG21} 0.88600 0.02200 0.06500 ? 0.00000 {?} {381.HE1} 2.04400 0.10400 0.14000 ++ 0.00000 {?} {381.CE} 18.07000 0.78700 0.78700 ? 0.00000 {?} 11.04540 0.35940 0 {?} 0 974 {363.HG11} 0.77300 0.07800 0.08000 ? 0.00000 {?} {381.HE1} 2.04700 0.09500 0.13300 ? 0.00000 {?} {381.CE} 18.10000 0.78700 0.78700 ? 0.00000 {?} 39.84230 0.43090 0 {?} 0 975 {308.HG11} 0.63700 0.07400 0.08800 ? 0.00000 {?} {308.HG21} 0.76100 0.09000 0.14000 ++ 0.00000 {?} {308.CG2} 17.97700 0.78700 0.78700 ? 0.00000 {?} 116.56180 1.36280 0 {?} 0 976 {361.HG11} 0.43000 0.04800 0.07200 ++ 0.00000 {?} {381.HE1} 2.04500 0.08000 0.11600 ++ 0.00000 {?} {381.CE} 18.07000 0.78700 0.78700 ? 0.00000 {?} 14.89660 0.27010 0 {?} 0 977 {?} 0.32100 0.06500 0.06500 ++ 0.00000 {?} {?} 2.04600 0.14100 0.07600 ++ 0.00000 {?} {?} 18.09100 0.22500 0.22500 ? 0.00000 {?} 1.36600 0.06160 0 {?} 0 978 {382.HD11} 0.10100 0.06100 0.08200 ++ 0.00000 {?} {308.HG21} 0.75100 0.09100 0.11900 ++ 0.00000 {?} {308.CG2} 17.95300 0.78700 0.78700 ? 0.00000 {?} 34.38430 0.47440 0 {?} 0 979 {280.HA} 4.14200 0.10800 0.10800 ++ 0.00000 {?} {283.HE1} 1.91800 0.14500 0.14500 ? 0.00000 {?} {283.CE} 17.43000 0.04000 0.78700 ? 0.00000 {?} 9.31530 0.18180 0 {?} 0 980 {283.HB1} 3.25300 0.09900 0.09500 ++ 0.00000 {?} {283.HE1} 1.91800 0.16900 0.16400 ? 0.00000 {?} {283.CE} 17.46000 0.78700 0.78700 ? 0.00000 {?} 27.87070 0.34480 0 {?} 0 981 {283.HB2} 2.44100 0.07300 0.09200 ++ 0.00000 {?} {283.HE1} 1.91900 0.10100 0.13000 ++ 0.00000 {?} {283.CE} 17.46500 0.78700 0.78700 ? 0.00000 {?} 47.06830 0.55220 0 {?} 0 982 {279.HB} 2.21800 0.08500 0.08500 ? 0.00000 {?} {283.HE1} 1.92100 0.08000 0.12300 ++ 0.00000 {?} {283.CE} 17.46800 0.48300 0.78700 ? 0.00000 {?} 11.59300 0.19380 0 {?} 0 983 {279.HG21} 0.96700 0.09300 0.11800 ++ 0.00000 {?} {283.HE1} 1.92400 0.10000 0.14400 ++ 0.00000 {?} {283.CE} 17.46000 0.78700 0.78700 ? 0.00000 {?} 70.95830 0.67590 0 {?} 0 984 {299.HG21} 0.82200 0.04100 0.07200 ? 0.00000 {?} {283.HE1} 1.92100 0.06900 0.11700 ? 0.00000 {?} {283.CE} 17.46500 0.78700 0.78700 ? 0.00000 {?} 38.05040 0.92140 0 {?} 0 985 {303.HD11} 0.73900 0.03300 0.06300 ? 0.00000 {?} {283.HE1} 1.92600 0.06000 0.12800 ? 0.00000 {?} {283.CE} 17.46300 0.78700 0.78700 ? 0.00000 {?} 37.74980 1.28010 0 {?} 0 986 {303.HD21} 0.61900 0.06400 0.08200 ? 0.00000 {?} {283.HE1} 1.92300 0.14000 0.14500 ++ 0.00000 {?} {283.CE} 17.46800 0.78700 0.78700 ? 0.00000 {?} 38.38740 0.40760 0 {?} 0 987 {362.HD21} 0.53900 0.07200 0.08200 ? 0.00000 {?} {283.HE1} 1.92600 0.12700 0.14500 ++ 0.00000 {?} {283.CE} 17.46800 0.78700 0.78700 ? 0.00000 {?} 38.61020 0.42550 0 {?} 0 988 {322.HG21} -0.51200 0.09800 0.09800 ++ 0.00000 {?} {283.HE1} 1.92100 0.16400 0.16400 ++ 0.00000 {?} {283.CE} 17.46100 0.23100 0.78700 ? 0.00000 {?} 12.15680 0.31360 0 {?} 0 989 {?} 4.58600 0.07600 0.06600 ++ 0.00000 {?} {?} 0.70700 0.11300 0.11300 ++ 0.00000 {?} {?} 17.00000 0.78700 0.78700 ? 0.00000 {?} 13.19480 0.17990 0 {?} 0 990 {384.HD1} 4.19900 0.07900 0.07900 ++ 0.00000 {?} {383.HG21} 0.70900 0.12300 0.12300 ++ 0.00000 {?} {383.CG2} 16.99300 0.20600 0.20600 ++ 0.00000 {?} 6.12730 0.17600 0 {?} 0 991 {304.HA} 3.56000 0.06600 0.09100 ++ 0.00000 {?} {304.HG21} 0.94100 0.08200 0.10800 ++ 0.00000 {?} {304.CG2} 17.05200 0.78700 0.78700 ? 0.00000 {?} 41.42930 0.59090 0 {?} 0 992 {304.HB} 1.86300 0.05100 0.10700 ? 0.00000 {?} {304.HG21} 0.94700 0.09200 0.16400 ++ 0.00000 {?} {304.CG2} 17.05300 0.78700 0.78700 ? 0.00000 {?} 72.30640 1.21540 0 {?} 0 993 {304.HG11} 1.77000 0.07000 0.07000 ? 0.00000 {?} {304.HG21} 0.94500 0.14000 0.14700 ++ 0.00000 {?} {304.CG2} 17.05600 0.78700 0.78700 ? 0.00000 {?} 41.32420 0.46940 0 {?} 0 994 {383.HB} 1.68900 0.07400 0.09200 ++ 0.00000 {?} {383.HG21} 0.70500 0.09900 0.12500 ++ 0.00000 {?} {383.CG2} 17.03200 0.78700 0.78700 ? 0.00000 {?} 53.11770 0.57590 0 {?} 0 995 {383.HG11} 1.21900 0.09600 0.09600 ++ 0.00000 {?} {383.HG21} 0.70300 0.20100 0.17900 ++ 0.00000 {?} {383.CG2} 17.03900 0.78700 0.78700 ? 0.00000 {?} 35.37490 0.35490 0 {?} 0 996 {354.HD11} 0.93000 0.06300 0.09000 ? 0.00000 {?} {383.HG21} 0.70200 0.11900 0.11300 ++ 0.00000 {?} {383.CG2} 17.01900 0.78700 0.78700 ? 0.00000 {?} 41.39140 0.59700 0 {?} 0 997 {?} 0.79100 0.06000 0.07900 ++ 0.00000 {?} {?} 2.11400 0.08600 0.12300 ++ 0.00000 {?} {?} 17.04400 0.78700 0.78700 ? 0.00000 {?} 8.03520 0.12080 0 {?} 0 998 {304.HG12} 0.83800 0.03300 0.06400 ? 0.00000 {?} {304.HG21} 0.95300 0.07500 0.10700 ++ 0.00000 {?} {304.CG2} 17.06000 0.49700 0.78700 ? 0.00000 {?} 20.90610 0.78090 0 {?} 0 999 {383.HG12} 0.83300 0.05600 0.07200 ? 0.00000 {?} {383.HG21} 0.70100 0.09100 0.11100 ++ 0.00000 {?} {383.CG2} 17.06000 0.51400 0.78700 ? 0.00000 {?} 36.48960 0.69490 0 {?} 0 1000 {322.HD11} 0.75900 0.07800 0.07800 ? 0.00000 {?} {304.HG21} 0.95100 0.09700 0.10600 ++ 0.00000 {?} {304.CG2} 17.07100 0.46100 0.78700 ? 0.00000 {?} 25.38800 0.42110 0 {?} 0 1001 {386.HD11} 0.28200 0.09400 0.09400 ++ 0.00000 {?} {383.HG21} 0.70700 0.21400 0.14000 ++ 0.00000 {?} {383.CG2} 17.01900 0.35400 0.35400 ? 0.00000 {?} 9.99840 0.28770 0 {?} 0 1002 {383.HD11} 0.16200 0.07800 0.08800 ++ 0.00000 {?} {383.HG21} 0.71000 0.16200 0.18400 ++ 0.00000 {?} {383.CG2} 17.03200 0.78700 0.78700 ? 0.00000 {?} 71.66570 0.72610 0 {?} 0 1003 {362.HA} 4.48900 0.12100 0.12100 ++ 0.00000 {?} {322.HG21} -0.50900 0.29300 0.17400 ++ 0.00000 {?} {322.CG2} 16.27600 0.41100 0.41100 ? 0.00000 {?} 15.22880 0.23750 0 {?} 0 1004 {322.HA} 4.14400 0.11700 0.13500 ++ 0.00000 {?} {322.HG21} -0.51100 0.13000 0.15800 ? 0.00000 {?} {322.CG2} 16.26900 0.78700 0.78700 ? 0.00000 {?} 57.30260 0.41130 0 {?} 0 1005 {322.HB} 1.41700 0.08300 0.11600 ++ 0.00000 {?} {322.HG21} -0.51400 0.10900 0.15400 ? 0.00000 {?} {322.CG2} 16.28200 0.78700 0.78700 ? 0.00000 {?} 54.99830 0.58180 0 {?} 0 1006 {322.HG11} 1.27900 0.05600 0.05600 ++ 0.00000 {?} {322.HG21} -0.52000 0.08300 0.10700 ? 0.00000 {?} {322.CG2} 16.30900 0.42200 0.42200 ? 0.00000 {?} 8.79030 0.31430 0 {?} 0 1007 {304.HD11} 0.98000 0.10400 0.10400 ++ 0.00000 {?} {322.HG21} -0.51200 0.08600 0.12600 ? 0.00000 {?} {322.CG2} 16.27900 0.45700 0.45700 ? 0.00000 {?} 20.03430 0.28510 0 {?} 0 1008 {322.HD11} 0.71600 0.03600 0.08200 ? 0.00000 {?} {322.HG21} -0.51400 0.10600 0.18000 ? 0.00000 {?} {322.CG2} 16.28900 0.78700 0.78700 ? 0.00000 {?} 48.85130 1.00360 0 {?} 0 1009 {322.HG12} 0.61500 0.08900 0.08900 ? 0.00000 {?} {322.HG21} -0.51600 0.09900 0.12600 ? 0.00000 {?} {322.CG2} 16.28800 0.78700 0.78700 ? 0.00000 {?} 39.56340 0.38760 0 {?} 0 1010 {362.HD21} 0.53900 0.06400 0.07300 ? 0.00000 {?} {322.HG21} -0.50900 0.12700 0.15700 ? 0.00000 {?} {322.CG2} 16.27800 0.78700 0.78700 ? 0.00000 {?} 35.19980 0.41450 0 {?} 0 1011 {300.HA} 4.16800 0.02900 0.09200 ? 0.00000 {?} {322.HD11} 0.71700 0.08500 0.13300 ++ 0.00000 {?} {322.CD1} 15.49900 0.78700 0.78700 ? 0.00000 {?} 38.01540 0.99390 0 {?} 0 1012 {303.HB1} 1.70500 0.06700 0.06500 ++ 0.00000 {?} {322.HD11} 0.72000 0.12100 0.11500 ++ 0.00000 {?} {322.CD1} 15.48300 0.78700 0.78700 ? 0.00000 {?} 22.44360 0.43140 0 {?} 0 1013 {322.HB} 1.41400 0.05500 0.06800 ++ 0.00000 {?} {322.HD11} 0.71800 0.08800 0.11000 ++ 0.00000 {?} {322.CD1} 15.49300 0.78700 0.78700 ? 0.00000 {?} 37.06210 0.60520 0 {?} 0 1014 {322.HG11} 1.28000 0.04300 0.06100 ++ 0.00000 {?} {322.HD11} 0.71700 0.07200 0.10600 ++ 0.00000 {?} {322.CD1} 15.50200 0.78700 0.78700 ? 0.00000 {?} 36.19020 0.80780 0 {?} 0 1015 {304.HD11} 0.95600 0.07500 0.07800 ++ 0.00000 {?} {322.HD11} 0.71500 0.10000 0.10400 ++ 0.00000 {?} {322.CD1} 15.45400 0.78700 0.78700 ? 0.00000 {?} 42.33410 0.53880 0 {?} 0 1016 {304.HG12} 0.83200 0.01700 0.06000 ? 0.00000 {?} {322.HD11} 0.71200 0.10600 0.12800 ++ 0.00000 {?} {322.CD1} 15.50700 0.40700 0.78700 ? 0.00000 {?} 6.54150 0.57820 0 {?} 0 1017 {322.HG12} 0.61300 0.04200 0.07900 ? 0.00000 {?} {322.HD11} 0.71700 0.09500 0.14000 ++ 0.00000 {?} {322.CD1} 15.50700 0.78700 0.78700 ? 0.00000 {?} 49.56760 1.01630 0 {?} 0 1018 {362.HD21} 0.54500 0.07300 0.07300 ? 0.00000 {?} {322.HD11} 0.71700 0.08000 0.11500 ++ 0.00000 {?} {322.CD1} 15.50600 0.78700 0.78700 ? 0.00000 {?} 47.63960 0.59740 0 {?} 0 1019 {322.HG21} -0.51300 0.09500 0.11600 ++ 0.00000 {?} {322.HD11} 0.71600 0.11200 0.15200 ++ 0.00000 {?} {322.CD1} 15.49900 0.78700 0.78700 ? 0.00000 {?} 83.48140 0.84510 0 {?} 0 1020 {343.HA} 4.20600 0.09100 0.09000 ++ 0.00000 {?} {354.HD11} 0.92800 0.14000 0.14000 ++ 0.00000 {?} {354.CD1} 15.16000 0.78700 0.78700 ? 0.00000 {?} 30.38230 0.37180 0 {?} 0 1021 {354.HA} 3.78000 0.11100 0.11100 ++ 0.00000 {?} {354.HD11} 0.92900 0.14900 0.14900 ++ 0.00000 {?} {354.CD1} 15.10000 0.06200 0.06200 ++ 0.00000 {?} 9.76250 0.20410 0 {?} 0 1022 {354.HG11} 1.68700 0.07700 0.10800 ++ 0.00000 {?} {354.HD11} 0.92600 0.07300 0.10700 ++ 0.00000 {?} {354.CD1} 15.15300 0.78700 0.78700 ? 0.00000 {?} 42.57070 0.55550 0 {?} 0 1023 {383.HG21} 0.71100 0.08500 0.08500 ? 0.00000 {?} {354.HD11} 0.92900 0.15100 0.13900 ++ 0.00000 {?} {354.CD1} 15.19100 0.52500 0.52500 ? 0.00000 {?} 38.09520 0.47320 0 {?} 0 1024 {354.HG12} 0.60400 0.08000 0.08000 ++ 0.00000 {?} {354.HD11} 0.93100 0.15200 0.14600 ++ 0.00000 {?} {354.CD1} 15.15700 0.78700 0.78700 ? 0.00000 {?} 33.14800 0.36490 0 {?} 0 1025 {386.HD11} 0.28000 0.08400 0.07300 ++ 0.00000 {?} {354.HD11} 0.92900 0.19300 0.16800 ++ 0.00000 {?} {354.CD1} 15.14500 0.78700 0.78700 ? 0.00000 {?} 22.88630 0.33090 0 {?} 0 1026 {321.HA} 4.74200 0.08000 0.08000 +E 0.00000 {?} {304.HD11} 0.95400 0.09600 0.12800 ++ 0.00000 {?} {304.CD1} 13.60800 0.78700 0.78700 ? 0.00000 {?} 62.64070 0.80010 0 {?} 0 1027 {300.HA} 4.17300 0.06000 0.09200 ? 0.00000 {?} {304.HD11} 0.95400 0.14000 0.16300 ++ 0.00000 {?} {304.CD1} 13.55700 0.78700 0.78700 ? 0.00000 {?} 41.18230 0.50600 0 {?} 0 1028 {301.HA} 4.06700 0.07200 0.08200 ? 0.00000 {?} {304.HD11} 0.95700 0.13800 0.16000 ++ 0.00000 {?} {304.CD1} 13.55000 0.78700 0.78700 ? 0.00000 {?} 44.46260 0.46260 0 {?} 0 1029 {304.HA} 3.56400 0.11500 0.09600 ++ 0.00000 {?} {304.HD11} 0.95400 0.15300 0.12700 ++ 0.00000 {?} {304.CD1} 13.55200 0.78700 0.78700 ? 0.00000 {?} 22.83040 0.30380 0 {?} 0 1030 {304.HB} 1.86400 0.06900 0.10800 ? 0.00000 {?} {304.HD11} 0.96000 0.07500 0.10700 ++ 0.00000 {?} {304.CD1} 13.55200 0.78700 0.78700 ? 0.00000 {?} 45.70610 0.67010 0 {?} 0 1031 {304.HG11} 1.76600 0.04800 0.07600 ? 0.00000 {?} {304.HD11} 0.95700 0.07900 0.12700 ++ 0.00000 {?} {304.CD1} 13.55700 0.78700 0.78700 ? 0.00000 {?} 43.49350 0.79980 0 {?} 0 1032 {322.HG11} 1.25900 0.06100 0.06100 ++ 0.00000 {?} {304.HD11} 0.95100 0.09400 0.09400 ++ 0.00000 {?} {304.CD1} 13.57300 0.22400 0.22400 ++ 0.00000 {?} 4.13790 0.15940 0 {?} 0 1033 {304.HG12} 0.80100 0.05400 0.06400 ? 0.00000 {?} {304.HD11} 0.95800 0.07200 0.12300 ++ 0.00000 {?} {304.CD1} 13.55200 0.78700 0.78700 ? 0.00000 {?} 49.37740 0.86650 0 {?} 0 1034 {322.HD11} 0.73500 0.07300 0.07300 ? 0.00000 {?} {304.HD11} 0.95800 0.09300 0.12700 ++ 0.00000 {?} {304.CD1} 13.55000 0.78700 0.78700 ? 0.00000 {?} 66.98790 0.79180 0 {?} 0 1035 {322.HG12} 0.62100 0.07900 0.07900 ++ 0.00000 {?} {304.HD11} 0.95700 0.10800 0.10800 ? 0.00000 {?} {304.CD1} 13.54800 0.03600 0.03600 ++ 0.00000 {?} 5.49650 0.15440 0 {?} 0 1036 {383.HA} 4.56900 0.06600 0.08800 ++ 0.00000 {?} {383.HD11} 0.15900 0.13000 0.17100 ++ 0.00000 {?} {383.CD1} 7.72100 0.78700 0.78700 ? 0.00000 {?} 33.37830 0.31650 0 {?} 0 1037 {383.HB} 1.69300 0.10600 0.10600 ++ 0.00000 {?} {383.HD11} 0.17100 0.14300 0.14300 ++ 0.00000 {?} {383.CD1} 7.70700 0.34500 0.78700 ? 0.00000 {?} 10.57800 0.20620 0 {?} 0 1038 {383.HG11} 1.23400 0.12500 0.10900 ++ 0.00000 {?} {383.HD11} 0.16900 0.13700 0.13700 ++ 0.00000 {?} {383.CD1} 7.71700 0.78700 0.78700 ? 0.00000 {?} 24.66000 0.22680 0 {?} 0 1039 {383.HG12} 0.83500 0.05300 0.07600 ? 0.00000 {?} {383.HD11} 0.16300 0.11500 0.13900 ++ 0.00000 {?} {383.CD1} 7.72100 0.78700 0.78700 ? 0.00000 {?} 27.70970 0.32970 0 {?} 0 1040 {383.HG21} 0.70900 0.06400 0.07300 ? 0.00000 {?} {383.HD11} 0.16200 0.12500 0.14800 ++ 0.00000 {?} {383.CD1} 7.71100 0.78700 0.78700 ? 0.00000 {?} 41.84210 0.44920 0 {?} 0 1041 {341.HA} 5.15300 0.07100 0.07100 ? 0.00000 {?} {331.HB} 3.81100 0.10100 0.10100 ++ 0.00000 {?} {331.CB} 71.82200 0.78700 0.78700 ? 0.00000 {?} 4.89890 0.05840 0 {?} 0 1042 {316.HA} 5.61700 0.11000 0.13000 ++ 0.00000 {?} {316.HB} 3.89800 0.11300 0.14300 ++ 0.00000 {?} {316.CB} 71.73000 0.78700 0.78700 ? 0.00000 {?} 41.96990 0.30950 0 {?} 0 1043 {350.HD1} 6.93900 0.07500 0.07500 ++ 0.00000 {?} {346.HA} 3.81400 0.13200 0.13200 ++ 0.00000 {?} {346.CA} 65.03800 0.09500 0.09500 ++ 0.00000 {?} 4.68360 0.10460 0 {?} 0 1044 {282.HD1} 7.20400 0.07400 0.07400 ++ 0.00000 {?} {282.HA} 4.31300 0.12700 0.12700 ++ 0.00000 {?} {282.CA} 61.25600 0.38100 0.78700 ? 0.00000 {?} 17.91990 0.45340 0 {?} 0 1045 {345.HD1} 6.70300 0.10300 0.10300 ++ 0.00000 {?} {345.HA} 4.29700 0.13000 0.13000 ++ 0.00000 {?} {345.CA} 61.33500 0.04800 0.04800 ++ 0.00000 {?} 4.72050 0.07630 0 {?} 0 1046 {341.HA} 5.12100 0.09800 0.09800 ++ 0.00000 {?} {331.HA} 4.95400 0.15000 0.15000 ++ 0.00000 {?} {331.CA} 59.13700 0.13200 0.13200 ++ 0.00000 {?} 2.36250 0.04180 0 {?} 0 1047 {309.HA} 5.32000 0.08500 0.08900 ++ 0.00000 {?} {316.HA} 5.61100 0.13800 0.14600 ++ 0.00000 {?} {316.CA} 58.61300 0.78700 0.78700 ? 0.00000 {?} 27.38610 0.22740 0 {?} 0 1048 {389.HA} 4.41900 0.05900 0.11600 ++ 0.00000 {?} {308.HA} 5.29000 0.08900 0.18400 ? 0.00000 {?} {308.CA} 58.14700 0.78700 0.78700 ? 0.00000 {?} 12.09960 0.18860 0 {?} 0 1049 {278.HA} 5.03300 0.08800 0.08800 ++ 0.00000 {?} {388.HA} 4.80500 0.14400 0.14400 ++ 0.00000 {?} {388.CA} 57.63500 0.48500 0.48500 ++ 0.00000 {?} 4.18760 0.04540 0 {?} 0 1050 {364.HB1} 3.65500 0.06400 0.11000 ++ 0.00000 {?} {364.HA} 5.21100 0.07600 0.16400 ? 0.00000 {?} {364.CA} 56.77200 0.78700 0.78700 ? 0.00000 {?} 18.13770 0.26070 0 {?} 0 1051 {350.HD1} 6.93000 0.08800 0.08800 ++ 0.00000 {?} {350.HA} 5.06200 0.16600 0.16600 ++ 0.00000 {?} {350.CA} 56.70100 0.41600 0.41600 ? 0.00000 {?} 9.20700 0.14370 0 {?} 0 1052 {350.HB1} 3.47700 0.05800 0.11000 ++ 0.00000 {?} {350.HA} 5.06200 0.05300 0.13000 ? 0.00000 {?} {350.CA} 56.66300 0.78700 0.78700 ? 0.00000 {?} 6.57290 0.13450 0 {?} 0 1053 {339.HA} 4.99400 0.07000 0.07000 ? 0.00000 {?} {333.HA} 4.72400 0.10900 0.13300 ? 0.00000 {?} {333.CA} 54.81900 0.78700 0.78700 ? 0.00000 {?} 23.61430 0.24590 0 {?} 0 1054 {316.HA} 5.62000 0.09900 0.09800 ++ 0.00000 {?} {309.HA} 5.32400 0.19000 0.18700 ++ 0.00000 {?} {309.CA} 52.92500 0.78700 0.78700 ? 0.00000 {?} 18.08950 0.18520 0 {?} 0 1055 {320.HA} 5.02200 0.05900 0.05900 ? 0.00000 {?} {320.HB1} 2.77100 0.11600 0.11600 ++ 0.00000 {?} {320.CB} 43.78400 0.12800 0.12800 ++ 0.00000 {?} 5.30760 0.16150 0 {?} 0 1056 {320.HA} 5.02400 0.05600 0.05600 ++ 0.00000 {?} {320.HB2} 2.48800 0.11400 0.11400 ++ 0.00000 {?} {320.CB} 43.80700 0.40300 0.40300 ? 0.00000 {?} 4.39900 0.13920 0 {?} 0 1057 {286.HD1} 7.17700 0.08200 0.08200 ++ 0.00000 {?} {286.HB2} 2.92200 0.11500 0.11500 ++ 0.00000 {?} {286.CB} 39.52800 0.23000 0.23000 ++ 0.00000 {?} 12.56440 0.27120 0 {?} 0 1058 {282.HD1} 7.20200 0.07600 0.07600 ++ 0.00000 {?} {282.HB2} 3.32400 0.13300 0.13300 ++ 0.00000 {?} {282.CB} 39.28700 0.30000 0.30000 ++ 0.00000 {?} 16.06070 0.36410 0 {?} 0 1059 {284.HD1} 7.31700 0.08300 0.08300 ++ 0.00000 {?} {284.HB1} 3.30200 0.13000 0.13000 ++ 0.00000 {?} {284.CB} 38.74100 0.78700 0.78700 ? 0.00000 {?} 46.10790 0.53630 0 {?} 0 1060 {339.HA} 5.00000 0.07300 0.07300 ? 0.00000 {?} {339.HG1} 2.08400 0.16400 0.14700 ++ 0.00000 {?} {339.CG} 36.97500 0.78700 0.78700 ? 0.00000 {?} 16.81690 0.19780 0 {?} 0 1061 {339.HA} 4.99700 0.08300 0.08300 ? 0.00000 {?} {339.HG2} 1.93700 0.12300 0.15000 ++ 0.00000 {?} {339.CG} 36.90800 0.78700 0.78700 ? 0.00000 {?} 31.33960 0.29610 0 {?} 0 1062 {317.HE1} 6.90900 0.06200 0.06200 ++ 0.00000 {?} {315.HB1} 1.58200 0.11500 0.11500 ++ 0.00000 {?} {315.CB} 35.26800 0.11000 0.11000 ++ 0.00000 {?} 1.60950 0.04110 0 {?} 0 1063 {387.HA} 5.05600 0.07400 0.07400 ? 0.00000 {?} {308.HB} 1.96900 0.12800 0.12800 ++ 0.00000 {?} {308.CB} 35.07000 0.07700 0.07700 ++ 0.00000 {?} 2.22090 0.06160 0 {?} 0 1064 {308.HA} 5.29700 0.08300 0.07800 ++ 0.00000 {?} {308.HB} 1.97700 0.19800 0.18400 ++ 0.00000 {?} {308.CB} 35.06100 0.78700 0.78700 ? 0.00000 {?} 21.88500 0.24890 0 {?} 0 1065 {339.HA} 4.99300 0.07400 0.07400 ? 0.00000 {?} {333.HB1} 1.67400 0.14900 0.14900 ++ 0.00000 {?} {333.CB} 33.68800 0.35200 0.78700 ? 0.00000 {?} 5.41150 0.12380 0 {?} 0 1066 {339.HA} 4.99500 0.07100 0.07100 ? 0.00000 {?} {339.HB1} 1.74900 0.13900 0.19200 ++ 0.00000 {?} {339.CB} 32.34000 0.78700 0.78700 ? 0.00000 {?} 49.09240 0.46920 0 {?} 0 1067 {286.HE1} 7.12700 0.07900 0.07900 ++ 0.00000 {?} {299.HB} 1.74100 0.12400 0.12400 ++ 0.00000 {?} {299.CB} 31.06600 0.43800 0.78700 ? 0.00000 {?} 16.50140 0.24050 0 {?} 0 1068 {345.HE1} 6.61200 0.08100 0.08100 ? 0.00000 {?} {334.HD1} 1.63600 0.15200 0.15200 ? 0.00000 {?} {334.CD} 29.07600 0.00400 0.78700 ? 0.00000 {?} 4.16630 0.09240 0 {?} 0 1069 {339.HA} 4.99400 0.07600 0.07600 ? 0.00000 {?} {333.HD1} 1.64000 0.09200 0.09200 ++ 0.00000 {?} {333.CD} 29.15500 0.24800 0.24800 ? 0.00000 {?} 2.93240 0.09870 0 {?} 0 1070 {286.HE1} 7.11000 0.06500 0.06500 ++ 0.00000 {?} {298.HB2} 2.23700 0.10600 0.10600 ++ 0.00000 {?} {298.CB} 28.75900 0.39000 0.78700 ? 0.00000 {?} 7.84030 0.21260 0 {?} 0 1071 {317.HE1} 6.92200 0.05200 0.05200 ++ 0.00000 {?} {315.HD1} 1.64300 0.10700 0.10700 ++ 0.00000 {?} {315.CD} 28.80700 0.27100 0.27100 ++ 0.00000 {?} 3.67100 0.11940 0 {?} 0 1072 {309.HA} 5.32200 0.08900 0.08900 ++ 0.00000 {?} {309.HG} 1.35400 0.12300 0.12300 ++ 0.00000 {?} {309.CG} 27.49100 0.25100 0.25100 ++ 0.00000 {?} 4.54050 0.11260 0 {?} 0 1073 {282.HE1} 7.19500 0.06000 0.07100 ++ 0.00000 {?} {303.HD11} 0.75700 0.09900 0.12500 ++ 0.00000 {?} {303.CD1} 26.14000 0.78700 0.78700 ? 0.00000 {?} 53.65090 0.67030 0 {?} 0 1074 {309.HA} 5.31900 0.09700 0.08700 ++ 0.00000 {?} {309.HD11} 0.78700 0.12900 0.11100 ++ 0.00000 {?} {309.CD1} 26.18600 0.78700 0.78700 ? 0.00000 {?} 12.82460 0.20760 0 {?} 0 1075 {312.HE1} 6.72700 0.08100 0.12500 ? 0.00000 {?} {386.HD11} 0.28300 0.12300 0.13200 ++ 0.00000 {?} {386.CD1} 25.83200 0.78700 0.78700 ? 0.00000 {?} 31.33540 0.28760 0 {?} 0 1076 {312.HD1} 6.64000 0.06500 0.06500 ? 0.00000 {?} {386.HD11} 0.28200 0.10500 0.08700 ++ 0.00000 {?} {386.CD1} 25.81400 0.78700 0.78700 ? 0.00000 {?} 7.26250 0.12710 0 {?} 0 1077 {282.HD1} 7.19600 0.11400 0.10300 ++ 0.00000 {?} {389.HD11} 0.64400 0.11200 0.10300 ++ 0.00000 {?} {389.CD1} 25.58900 0.78700 0.78700 ? 0.00000 {?} 29.00140 0.40490 0 {?} 0 1078 {317.HE1} 6.91600 0.06200 0.06200 ++ 0.00000 {?} {382.HD11} 0.10700 0.11800 0.11800 ++ 0.00000 {?} {382.CD1} 25.12500 0.08300 0.08300 ++ 0.00000 {?} 5.08900 0.13200 0 {?} 0 1079 {317.HD1} 6.84400 0.06400 0.06400 ++ 0.00000 {?} {382.HD11} 0.10900 0.15700 0.11800 ++ 0.00000 {?} {382.CD1} 25.13400 0.78700 0.78700 ? 0.00000 {?} 15.42110 0.19440 0 {?} 0 1080 {324.HZ3} 7.30500 0.07100 0.08200 ? 0.00000 {?} {299.HG11} 0.66800 0.15800 0.14400 ++ 0.00000 {?} {299.CG1} 24.13500 0.78700 0.78700 ? 0.00000 {?} 38.06480 0.34140 0 {?} 0 1081 {286.HD1} 7.19500 0.07700 0.10000 ? 0.00000 {?} {299.HG11} 0.67400 0.10200 0.15500 ++ 0.00000 {?} {299.CG1} 24.15400 0.78700 0.78700 ? 0.00000 {?} 111.93360 1.10330 0 {?} 0 1082 {284.HE1} 7.37900 0.05800 0.05800 ++ 0.00000 {?} {280.HD21} 0.95100 0.13400 0.13400 ++ 0.00000 {?} {280.CD2} 23.74700 0.04800 0.04800 ++ 0.00000 {?} 5.24920 0.12140 0 {?} 0 1083 {284.HD1} 7.31700 0.05700 0.05700 ++ 0.00000 {?} {280.HD21} 0.95000 0.13900 0.13900 ++ 0.00000 {?} {280.CD2} 23.75700 0.20400 0.20400 ++ 0.00000 {?} 10.13570 0.33510 0 {?} 0 1084 {316.HA} 5.61600 0.08300 0.08300 ++ 0.00000 {?} {309.HD21} 0.74400 0.11000 0.11000 ++ 0.00000 {?} {309.CD2} 23.78100 0.21000 0.21000 ++ 0.00000 {?} 5.22880 0.16360 0 {?} 0 1085 {309.HA} 5.32100 0.08700 0.12500 ++ 0.00000 {?} {309.HD21} 0.74300 0.08900 0.12700 ++ 0.00000 {?} {309.CD2} 23.79100 0.78700 0.78700 ? 0.00000 {?} 40.71920 0.46520 0 {?} 0 1086 {317.HE1} 6.91400 0.04800 0.08700 ? 0.00000 {?} {310.HG21} 1.26300 0.07600 0.11300 ++ 0.00000 {?} {310.CG2} 23.22600 0.78700 0.78700 ? 0.00000 {?} 25.93210 0.43400 0 {?} 0 1087 {317.HD1} 6.84000 0.05900 0.05900 ? 0.00000 {?} {310.HG21} 1.26200 0.12300 0.11300 ++ 0.00000 {?} {310.CG2} 23.22900 0.78700 0.78700 ? 0.00000 {?} 23.86010 0.35060 0 {?} 0 1088 {312.HE1} 6.73200 0.07300 0.07900 ++ 0.00000 {?} {310.HG21} 1.26200 0.14500 0.15600 ++ 0.00000 {?} {310.CG2} 23.21700 0.78700 0.78700 ? 0.00000 {?} 32.02470 0.31520 0 {?} 0 1089 {387.HA} 5.04200 0.06400 0.08700 ? 0.00000 {?} {310.HG21} 1.25700 0.11800 0.13900 ++ 0.00000 {?} {310.CG2} 23.22700 0.78700 0.78700 ? 0.00000 {?} 25.04770 0.27550 0 {?} 0 1090 {317.HE1} 6.91400 0.06400 0.06400 ++ 0.00000 {?} {382.HD21} 0.06400 0.12100 0.09900 ++ 0.00000 {?} {382.CD2} 22.15000 0.78700 0.78700 ? 0.00000 {?} 7.87460 0.12920 0 {?} 0 1091 {312.HE1} 6.74000 0.08200 0.08200 ++ 0.00000 {?} {386.HD21} 0.83900 0.11400 0.11400 ++ 0.00000 {?} {386.CD2} 21.95500 0.78700 0.78700 ? 0.00000 {?} 36.67910 0.32330 0 {?} 0 1092 {316.HA} 5.61500 0.06300 0.11100 ++ 0.00000 {?} {316.HG21} 1.03500 0.08100 0.14100 ++ 0.00000 {?} {316.CG2} 22.02500 0.78700 0.78700 ? 0.00000 {?} 56.55900 0.79010 0 {?} 0 1093 {309.HA} 5.32100 0.07200 0.10600 ++ 0.00000 {?} {316.HG21} 1.04000 0.08600 0.12600 ++ 0.00000 {?} {316.CG2} 22.02500 0.78700 0.78700 ? 0.00000 {?} 40.26930 0.51570 0 {?} 0 1094 {295.HZ} 7.29000 0.10000 0.10000 ++ 0.00000 {?} {299.HG21} 0.83100 0.15100 0.15100 ++ 0.00000 {?} {299.CG2} 21.65800 0.49800 0.78700 ? 0.00000 {?} 38.44510 0.32380 0 {?} 0 1095 {324.HZ2} 7.13300 0.06100 0.09400 ? 0.00000 {?} {299.HG21} 0.83300 0.09000 0.14100 ++ 0.00000 {?} {299.CG2} 21.70900 0.78700 0.78700 ? 0.00000 {?} 54.73760 0.78880 0 {?} 0 1096 {324.HH2} 6.77700 0.06800 0.09100 ? 0.00000 {?} {299.HG21} 0.82800 0.15600 0.15600 ++ 0.00000 {?} {299.CG2} 21.71000 0.51100 0.51100 ? 0.00000 {?} 37.18300 0.43300 0 {?} 0 1097 {308.HA} 5.29200 0.07200 0.10500 ++ 0.00000 {?} {390.HG21} 1.20800 0.11800 0.17400 ++ 0.00000 {?} {390.CG2} 21.72000 0.78700 0.78700 ? 0.00000 {?} 45.39180 0.51930 0 {?} 0 1098 {308.HA} 5.29900 0.07300 0.11100 ++ 0.00000 {?} {308.HG11} 0.64200 0.12000 0.18900 ++ 0.00000 {?} {308.CG1} 21.67600 0.78700 0.78700 ? 0.00000 {?} 63.02770 0.71320 0 {?} 0 1099 {316.HA} 5.61300 0.07400 0.07400 ++ 0.00000 {?} {307.HG21} 0.79900 0.11000 0.11000 ++ 0.00000 {?} {307.CG2} 21.38300 0.14800 0.14800 ++ 0.00000 {?} 3.52450 0.13390 0 {?} 0 1100 {341.HA} 5.15400 0.05600 0.10900 ? 0.00000 {?} {331.HG21} 0.96700 0.07100 0.11000 ++ 0.00000 {?} {331.CG2} 21.22200 0.78700 0.78700 ? 0.00000 {?} 19.19480 0.32340 0 {?} 0 1101 {331.HA} 4.95800 0.08800 0.08800 ? 0.00000 {?} {331.HG21} 0.96800 0.08800 0.11900 ++ 0.00000 {?} {331.CG2} 21.22300 0.78700 0.78700 ? 0.00000 {?} 43.95130 0.47420 0 {?} 0 1102 {388.HD1} 7.18900 0.11200 0.11200 ++ 0.00000 {?} {278.HG21} 0.94400 0.14200 0.14200 ++ 0.00000 {?} {278.CG2} 20.96500 0.78700 0.78700 ? 0.00000 {?} 49.26200 0.29400 0 {?} 0 1103 {388.HE1} 6.83700 0.06600 0.08400 ++ 0.00000 {?} {278.HG21} 0.95000 0.10600 0.13900 ++ 0.00000 {?} {278.CG2} 20.89800 0.78700 0.78700 ? 0.00000 {?} 22.36130 0.29030 0 {?} 0 1104 {278.HA} 5.03100 0.04900 0.08400 ? 0.00000 {?} {278.HG21} 0.95900 0.08400 0.13300 ++ 0.00000 {?} {278.CG2} 20.93800 0.78700 0.78700 ? 0.00000 {?} 27.53550 0.44120 0 {?} 0 1105 {286.HE1} 7.11200 0.05900 0.06800 ++ 0.00000 {?} {290.HG21} 1.22300 0.12600 0.13900 ++ 0.00000 {?} {290.CG2} 20.74500 0.78700 0.78700 ? 0.00000 {?} 27.77110 0.30350 0 {?} 0 1106 {317.HE1} 6.91300 0.03400 0.06400 ? 0.00000 {?} {380.HB1} 1.24700 0.09500 0.14600 ++ 0.00000 {?} {380.CB} 19.88000 0.78700 0.78700 ? 0.00000 {?} 16.25570 0.33970 0 {?} 0 1107 {317.HD1} 6.84800 0.07500 0.07500 ? 0.00000 {?} {380.HB1} 1.24300 0.22100 0.14100 ++ 0.00000 {?} {380.CB} 19.83000 0.42100 0.78700 ? 0.00000 {?} 13.89340 0.25140 0 {?} 0 1108 {317.HD1} 6.84400 0.07300 0.07300 ++ 0.00000 {?} {308.HG21} 0.75700 0.15500 0.15500 ++ 0.00000 {?} {308.CG2} 17.95800 0.34400 0.78700 ? 0.00000 {?} 8.67580 0.19980 0 {?} 0 1109 {308.HA} 5.29100 0.09400 0.09400 ++ 0.00000 {?} {308.HG21} 0.75900 0.18000 0.14800 ++ 0.00000 {?} {308.CG2} 17.96300 0.78700 0.78700 ? 0.00000 {?} 22.43110 0.25550 0 {?} 0 1110 {324.HZ3} 7.29600 0.09000 0.09500 ++ 0.00000 {?} {283.HE1} 1.91900 0.12700 0.13600 ++ 0.00000 {?} {283.CE} 17.46300 0.78700 0.78700 ? 0.00000 {?} 45.34440 0.40620 0 {?} 0 1111 {324.HZ2} 7.13700 0.06500 0.06500 ++ 0.00000 {?} {283.HE1} 1.92900 0.10700 0.10700 ++ 0.00000 {?} {283.CE} 17.46300 0.32400 0.78700 ? 0.00000 {?} 6.65850 0.19130 0 {?} 0 1112 {320.HA} 5.02500 0.08000 0.11400 ? 0.00000 {?} {304.HG21} 0.94600 0.12600 0.16900 ++ 0.00000 {?} {304.CG2} 17.05800 0.78700 0.78700 ? 0.00000 {?} 44.06490 0.50130 0 {?} 0 1113 {324.HZ3} 7.29100 0.00000 0.10400 ? 0.00000 {?} {322.HG21} -0.51800 0.00000 0.13400 ? 0.00000 {?} {322.CG2} 16.18300 0.00000 0.00000 ? 0.00000 {?} 0.00000 0.12300 0 {?} 0 1114 {324.HZ2} 7.13100 0.07300 0.07300 ++ 0.00000 {?} {322.HD11} 0.71800 0.16400 0.12600 ++ 0.00000 {?} {322.CD1} 15.52100 0.38200 0.38200 ? 0.00000 {?} 7.08420 0.26140 0 {?} 0 1115 {346.HE1} 6.64900 0.07400 0.07400 ++ 0.00000 {?} {383.HD11} 0.15900 0.09500 0.09500 ++ 0.00000 {?} {383.CD1} 7.72900 0.07600 0.07600 ++ 0.00000 {?} 2.40650 0.07060 0 {?} 0 1116 {387.HA} 5.04200 0.07800 0.07800 ++ 0.00000 {?} {279.HG11} 0.80600 0.09400 0.09400 ++ 0.00000 {?} {279.CG1} 24.66300 0.08900 0.08900 EE 0.00000 {?} 3.92270 0.14350 0 {?} 0 1117 {339.HG1} 2.06200 0.05400 0.05600 ++ 0.00000 {?} {331.HB} 3.81600 0.06600 0.07000 ++ 0.00000 {?} {331.CB} 71.80200 0.27900 0.27900 EE 0.00000 {?} 0.70780 0.03350 0 {?} 0 1118 {392.HG} 1.57800 0.06300 0.09400 ++ 0.00000 {?} {390.HB} 4.26100 0.09000 0.13400 ++ 0.00000 {?} {390.CB} 71.27700 0.39600 0.39600 EE 0.00000 {?} 6.92360 0.22060 0 {?} 0 1119 {307.HG11} 0.79600 0.05700 0.06600 ++ 0.00000 {?} {390.HB} 4.25500 0.10400 0.12700 ++ 0.00000 {?} {390.CB} 71.27700 0.33300 0.33300 EE 0.00000 {?} 4.70670 0.14110 0 {?} 0 1120 {312.HE1} 6.72800 0.05100 0.06600 ++ 0.00000 {?} {310.HB} 3.39300 0.08300 0.10800 ++ 0.00000 {?} {310.CB} 68.91600 0.35100 0.35100 EE 0.00000 {?} 1.97790 0.07890 0 {?} 0 1121 {279.HG11} 0.80200 0.04800 0.08500 ? 0.00000 {?} {384.HA} 3.80300 0.09100 0.11500 ++ 0.00000 {?} {384.CA} 67.65000 0.34700 0.34700 EE 0.00000 {?} 3.96840 0.18020 0 {?} 0 1122 {279.HG21} 0.98200 0.06500 0.08700 ++ 0.00000 {?} {384.HA} 3.80400 0.09000 0.12600 ++ 0.00000 {?} {384.CA} 67.65000 0.37500 0.37500 EE 0.00000 {?} 6.76030 0.23430 0 {?} 0 1123 {384.HB2} 1.94500 0.05900 0.08700 ++ 0.00000 {?} {384.HA} 3.79900 0.10000 0.12700 ++ 0.00000 {?} {384.CA} 67.65000 0.34700 0.34700 EE 0.00000 {?} 5.99330 0.20290 0 {?} 0 1124 {384.HB1} 2.43300 0.07300 0.07300 ++ 0.00000 {?} {384.HA} 3.80300 0.11100 0.11300 ++ 0.00000 {?} {384.CA} 67.65000 0.26500 0.26500 EE 0.00000 {?} 4.13840 0.10550 0 {?} 0 1125 {387.HB1} 2.76300 0.05500 0.05600 ++ 0.00000 {?} {384.HA} 3.80300 0.08900 0.09100 ++ 0.00000 {?} {384.CA} 67.65000 0.26700 0.26700 EE 0.00000 {?} 2.67740 0.10580 0 {?} 0 1126 {279.HB} 2.20700 0.06800 0.06600 ++ 0.00000 {?} {279.HA} 3.60500 0.16600 0.16600 ++ 0.00000 {?} {279.CA} 66.03100 0.24900 0.24900 EE 0.00000 {?} 3.83270 0.11950 0 {?} 0 1127 {282.HB2} 3.29800 0.06900 0.09700 ++ 0.00000 {?} {279.HA} 3.60900 0.10200 0.14700 ++ 0.00000 {?} {279.CA} 66.03100 0.37600 0.37600 EE 0.00000 {?} 6.20590 0.17510 0 {?} 0 1128 {282.HB1} 3.46600 0.06400 0.08800 ? 0.00000 {?} {279.HA} 3.61300 0.06600 0.14000 ? 0.00000 {?} {279.CA} 66.03100 0.41100 0.41100 EE 0.00000 {?} 9.04260 0.28080 0 {?} 0 1129 {342.HB1} 3.66100 0.07000 0.08200 ++ 0.00000 {?} {328.HA} 4.54900 0.09000 0.12000 ++ 0.00000 {?} {328.CA} 66.03100 0.33200 0.33200 EE 0.00000 {?} 4.13720 0.12610 0 {?} 0 1130 {342.HB2} 3.17000 0.08100 0.07800 ++ 0.00000 {?} {328.HA} 4.56000 0.09600 0.09200 ++ 0.00000 {?} {328.CA} 66.03100 0.25300 0.25300 EE 0.00000 {?} 1.21170 0.06180 0 {?} 0 1131 {328.HB1} 2.41500 0.07500 0.07500 ++ 0.00000 {?} {328.HA} 4.56200 0.14500 0.10200 ++ 0.00000 {?} {328.CA} 66.03100 0.16500 0.16500 EE 0.00000 {?} 1.76700 0.06410 0 {?} 0 1132 {?} 1.82500 0.08800 0.08800 ++ 0.00000 {?} {?} 4.56300 0.08900 0.08900 ++ 0.00000 {?} {?} 66.03100 0.15900 0.15900 EE 0.00000 {?} 1.36900 0.03870 0 {?} 0 1133 {383.HD11} 0.16300 0.08100 0.08100 ++ 0.00000 {?} {328.HA} 4.55900 0.14600 0.11900 ++ 0.00000 {?} {328.CA} 66.03100 0.18400 0.18400 EE 0.00000 {?} 1.76790 0.06360 0 {?} 0 1134 {380.HB1} 1.24200 0.04400 0.07400 ++ 0.00000 {?} {364.HB1} 3.64600 0.06800 0.14100 ? 0.00000 {?} {364.CB} 65.50600 0.39800 0.39800 EE 0.00000 {?} 3.37890 0.11960 0 {?} 0 1135 {380.HB1} 1.23400 0.05100 0.06100 ++ 0.00000 {?} {364.HB2} 3.44000 0.11300 0.13400 ? 0.00000 {?} {364.CB} 65.50600 0.31800 0.31800 EE 0.00000 {?} 2.34920 0.08390 0 {?} 0 1136 {382.HD11} 0.10100 0.08500 0.09100 ++ 0.00000 {?} {364.HB2} 3.45100 0.11200 0.14100 ++ 0.00000 {?} {364.CB} 65.50600 0.29400 0.29400 EE 0.00000 {?} 4.09870 0.10630 0 {?} 0 1137 {382.HD11} 0.10200 0.08800 0.08600 ++ 0.00000 {?} {364.HB1} 3.65900 0.13900 0.13900 ++ 0.00000 {?} {364.CB} 65.50600 0.25700 0.25700 EE 0.00000 {?} 4.02630 0.10080 0 {?} 0 1138 {302.HB2} 1.87500 0.06200 0.06700 ++ 0.00000 {?} {299.HA} 3.19100 0.10300 0.11500 ++ 0.00000 {?} {299.CA} 65.40000 0.29600 0.29600 EE 0.00000 {?} 3.80610 0.11920 0 {?} 0 1139 {302.HG1} 2.31300 0.04300 0.07700 ? 0.00000 {?} {299.HA} 3.19000 0.13200 0.14500 ++ 0.00000 {?} {299.CA} 65.40000 0.28500 0.28500 EE 0.00000 {?} 3.56900 0.11920 0 {?} 0 1140 {286.HZ} 7.22800 0.01800 0.05900 ? 0.00000 {?} {299.HA} 3.18800 0.10000 0.12000 ++ 0.00000 {?} {299.CA} 65.44000 0.33100 0.33100 EE 0.00000 {?} 1.20450 0.08560 0 {?} 0 1141 {350.HE1} 6.81200 0.06000 0.06900 ++ 0.00000 {?} {346.HA} 3.81400 0.10900 0.12400 ++ 0.00000 {?} {346.CA} 65.03800 0.30200 0.30200 EE 0.00000 {?} 2.40220 0.05990 0 {?} 0 1142 {312.HD1} 6.64200 0.05500 0.04900 ? 0.00000 {?} {346.HA} 3.81600 0.10900 0.09500 ++ 0.00000 {?} {346.CA} 65.03800 0.22600 0.22600 EE 0.00000 {?} 0.76940 0.05030 0 {?} 0 1143 {346.HD1} 7.22400 0.07000 0.07900 ++ 0.00000 {?} {346.HA} 3.81800 0.10700 0.13500 ++ 0.00000 {?} {346.CA} 65.03800 0.31500 0.31500 EE 0.00000 {?} 4.79730 0.12210 0 {?} 0 1144 {346.HB1} 3.06800 0.07100 0.07800 ++ 0.00000 {?} {346.HA} 3.81900 0.10700 0.11800 ++ 0.00000 {?} {346.CA} 65.03800 0.29200 0.29200 EE 0.00000 {?} 3.20490 0.08440 0 {?} 0 1145 {346.HB2} 2.91900 0.06700 0.07800 ++ 0.00000 {?} {346.HA} 3.81800 0.12200 0.14300 ++ 0.00000 {?} {346.CA} 65.03800 0.31600 0.31600 EE 0.00000 {?} 4.32360 0.11380 0 {?} 0 1146 {304.HB} 1.86000 0.06800 0.10600 ? 0.00000 {?} {304.HA} 3.56700 0.11500 0.15100 ++ 0.00000 {?} {304.CA} 64.62400 0.34400 0.34400 EE 0.00000 {?} 5.92290 0.14990 0 {?} 0 1147 {389.HD11} 0.65500 0.05300 0.06900 ++ 0.00000 {?} {276.HB1} 3.87200 0.11000 0.13300 ++ 0.00000 {?} {276.CB} 63.93200 0.32500 0.32500 EE 0.00000 {?} 3.05620 0.10470 0 {?} 0 1148 {388.HE1} 6.83700 0.06000 0.07500 ++ 0.00000 {?} {276.HB1} 3.87200 0.08400 0.12200 ++ 0.00000 {?} {276.CB} 63.93200 0.35600 0.35600 EE 0.00000 {?} 3.07880 0.12420 0 {?} 0 1149 {388.HD1} 7.18500 0.07800 0.08600 ++ 0.00000 {?} {276.HB1} 3.87400 0.08600 0.10200 ++ 0.00000 {?} {276.CB} 63.93200 0.30300 0.30300 EE 0.00000 {?} 3.35350 0.09950 0 {?} 0 1150 {328.HD2} 3.55600 0.06600 0.07600 ++ 0.00000 {?} {327.HA} 5.47100 0.07800 0.09400 ++ 0.00000 {?} {327.CA} 52.39000 0.32100 0.32100 EE 0.00000 {?} 2.66300 0.09400 0 {?} 0 1151 {309.HA} 5.32200 0.07000 0.08900 ++ 0.00000 {?} {309.HB1} 1.68400 0.05600 0.14100 ? 0.00000 {?} {309.CB} 46.35600 0.37400 0.37400 EE 0.00000 {?} 1.97360 0.08800 0 {?} 0 1152 {309.HA} 5.32200 0.05700 0.08300 ++ 0.00000 {?} {309.HB2} 1.33500 0.09900 0.12500 ++ 0.00000 {?} {309.CB} 46.35600 0.34100 0.34100 EE 0.00000 {?} 3.23900 0.09450 0 {?} 0 1153 {388.HB2} 2.85700 0.06400 0.06400 ++ 0.00000 {?} {309.HB1} 1.67700 0.08900 0.08800 ++ 0.00000 {?} {309.CB} 46.35600 0.25800 0.25800 EE 0.00000 {?} 1.18950 0.05300 0 {?} 0 1154 {388.HB1} 3.10400 0.05800 0.05800 ++ 0.00000 {?} {309.HB1} 1.67000 0.12700 0.11600 ++ 0.00000 {?} {309.CB} 46.35600 0.23700 0.23700 EE 0.00000 {?} 1.59670 0.06040 0 {?} 0 1155 {316.HG21} 1.03800 0.04300 0.04300 ++ 0.00000 {?} {309.HB1} 1.68200 0.11100 0.11100 ++ 0.00000 {?} {309.CB} 46.35600 0.26100 0.26100 EE 0.00000 {?} 2.02640 0.08950 0 {?} 0 1156 {309.HD21} 0.77400 0.06200 0.09500 ++ 0.00000 {?} {309.HB2} 1.33500 0.09300 0.23600 ? 0.00000 {?} {309.CB} 46.35600 0.45000 0.45000 EE 0.00000 {?} 15.07100 0.28810 0 {?} 0 1157 {309.HB2} 1.33200 0.02300 0.07900 ? 0.00000 {?} {309.HB1} 1.67800 0.07300 0.12800 ++ 0.00000 {?} {309.CB} 46.35600 0.45700 0.45700 EE 0.00000 {?} 5.24550 0.30220 0 {?} 0 1158 {397.HB1} 1.88400 0.02600 0.05000 ? 0.00000 {?} {374.HA2} 3.97900 0.08500 0.09100 ? 0.00000 {?} {374.CA} 45.30700 0.29000 0.29000 EE 0.00000 {?} 2.01860 0.11550 0 {?} 0 1159 {397.HB2} 1.80200 0.06800 0.06800 ? 0.00000 {?} {374.HA2} 3.97400 0.07500 0.07200 ++ 0.00000 {?} {374.CA} 45.30700 0.25000 0.25000 EE 0.00000 {?} 1.69140 0.08740 0 {?} 0 1160 {375.HG21} 1.23200 0.05400 0.06000 ++ 0.00000 {?} {374.HA1} 4.03100 0.05200 0.08100 ? 0.00000 {?} {374.CA} 45.30700 0.30100 0.30100 EE 0.00000 {?} 1.48710 0.09220 0 {?} 0 1161 {382.HD21} 0.08900 0.07800 0.09400 ++ 0.00000 {?} {382.HB1} 1.29600 0.11800 0.17300 ++ 0.00000 {?} {382.CB} 45.30700 0.36600 0.36600 EE 0.00000 {?} 6.62850 0.13410 0 {?} 0 1162 {382.HB1} 1.28000 0.03200 0.06300 ++ 0.00000 {?} {382.HB2} 1.01400 0.06200 0.13200 ? 0.00000 {?} {382.CB} 45.30700 0.37700 0.37700 EE 0.00000 {?} 2.82880 0.21790 0 {?} 0 1163 {303.HA} 4.25600 0.06400 0.09000 ? 0.00000 {?} {303.HB1} 1.70500 0.09200 0.14500 ++ 0.00000 {?} {303.CB} 45.04500 0.38000 0.38000 EE 0.00000 {?} 5.84490 0.20420 0 {?} 0 1164 {303.HA} 4.25500 0.03100 0.06900 ? 0.00000 {?} {303.HB2} 1.31900 0.09900 0.14500 ++ 0.00000 {?} {303.CB} 45.04500 0.39400 0.39400 EE 0.00000 {?} 4.13390 0.21180 0 {?} 0 1165 {300.HA} 4.16800 0.06800 0.06800 ? 0.00000 {?} {303.HB1} 1.69900 0.07700 0.09200 ++ 0.00000 {?} {303.CB} 45.04500 0.31700 0.31700 EE 0.00000 {?} 4.11430 0.13310 0 {?} 0 1166 {363.HG11} 0.78400 0.06000 0.08300 ++ 0.00000 {?} {321.HB1} 2.70700 0.11200 0.15700 ++ 0.00000 {?} {321.CB} 43.20800 0.37900 0.37900 EE 0.00000 {?} 3.02200 0.07750 0 {?} 0 1167 {363.HG21} 0.90300 0.06500 0.07300 ++ 0.00000 {?} {321.HB1} 2.70800 0.13000 0.13600 ++ 0.00000 {?} {321.CB} 43.20800 0.27700 0.27700 EE 0.00000 {?} 3.31390 0.07290 0 {?} 0 1168 {363.HG21} 0.88100 0.04500 0.09100 ? 0.00000 {?} {321.HB2} 2.23900 0.11700 0.14700 ++ 0.00000 {?} {321.CB} 43.20800 0.33300 0.33300 EE 0.00000 {?} 3.87380 0.12060 0 {?} 0 1169 {363.HB} 1.66800 0.06300 0.08800 ++ 0.00000 {?} {321.HB1} 2.68800 0.10700 0.13300 ++ 0.00000 {?} {321.CB} 43.20800 0.35900 0.35900 EE 0.00000 {?} 4.59200 0.11910 0 {?} 0 1170 {363.HB} 1.66600 0.06100 0.08700 ++ 0.00000 {?} {321.HB2} 2.25900 0.10000 0.14900 ++ 0.00000 {?} {321.CB} 43.20800 0.38000 0.38000 EE 0.00000 {?} 5.03360 0.15220 0 {?} 0 1171 {317.HB2} 2.23500 0.05900 0.08000 ++ 0.00000 {?} {317.HB1} 2.91600 0.09200 0.13700 ? 0.00000 {?} {317.CB} 43.20800 0.36700 0.36700 EE 0.00000 {?} 3.60810 0.12270 0 {?} 0 1172 {317.HB1} 2.91800 0.07900 0.10400 ++ 0.00000 {?} {317.HB2} 2.24400 0.11600 0.13500 ++ 0.00000 {?} {317.CB} 43.20800 0.33200 0.33200 EE 0.00000 {?} 6.31410 0.13660 0 {?} 0 1173 {382.HD11} 0.10300 0.08600 0.09300 ++ 0.00000 {?} {317.HB2} 2.24100 0.13200 0.15200 ++ 0.00000 {?} {317.CB} 43.20800 0.29600 0.29600 EE 0.00000 {?} 4.90850 0.11340 0 {?} 0 1174 {382.HD11} 0.10600 0.05300 0.04800 ++ 0.00000 {?} {317.HB1} 2.92600 0.14200 0.13300 ++ 0.00000 {?} {317.CB} 43.20800 0.23800 0.23800 EE 0.00000 {?} 1.45780 0.07140 0 {?} 0 1175 {308.HG21} 0.77300 0.06900 0.06900 ++ 0.00000 {?} {317.HB1} 2.92500 0.14500 0.12300 ++ 0.00000 {?} {317.CB} 43.20800 0.21200 0.21200 EE 0.00000 {?} 1.45530 0.04610 0 {?} 0 1176 {317.HD1} 6.85300 0.06700 0.09300 ++ 0.00000 {?} {317.HB2} 2.23400 0.13400 0.16100 ++ 0.00000 {?} {317.CB} 43.20800 0.32200 0.32200 EE 0.00000 {?} 5.35540 0.11400 0 {?} 0 1177 {317.HD1} 6.85500 0.07100 0.07700 ? 0.00000 {?} {317.HB1} 2.92500 0.12000 0.13700 ++ 0.00000 {?} {317.CB} 43.20800 0.30000 0.30000 EE 0.00000 {?} 4.04550 0.08910 0 {?} 0 1178 {?} 5.64300 0.04200 0.05300 ++ 0.00000 {?} {?} 3.22800 0.05900 0.07600 ++ 0.00000 {?} {?} 43.20800 0.37000 0.37000 EE 0.00000 {?} 0.41070 0.03670 0 {?} 0 1179 {?} 6.84700 0.04500 0.08800 ? 0.00000 {?} {?} 3.21400 0.08800 0.12300 ++ 0.00000 {?} {?} 43.20800 0.35900 0.35900 EE 0.00000 {?} 1.98450 0.07870 0 {?} 0 1180 {322.HA} 4.14700 0.07900 0.11900 ++ 0.00000 {?} {322.HB} 1.41300 0.10900 0.15300 ++ 0.00000 {?} {322.CB} 40.84700 0.38500 0.38500 EE 0.00000 {?} 7.78410 0.16820 0 {?} 0 1181 {279.HA} 3.61400 0.04500 0.07300 ? 0.00000 {?} {282.HB1} 3.46000 0.06400 0.11500 ? 0.00000 {?} {282.CB} 39.27300 0.32000 0.32000 EE 0.00000 {?} 2.44860 0.13120 0 {?} 0 1182 {279.HA} 3.60500 0.06500 0.10800 ? 0.00000 {?} {282.HB2} 3.31400 0.09700 0.12400 ? 0.00000 {?} {282.CB} 39.27300 0.35700 0.35700 EE 0.00000 {?} 7.83840 0.19470 0 {?} 0 1183 {304.HD11} 0.95800 0.03200 0.04600 ++ 0.00000 {?} {304.HG12} 0.77900 0.06200 0.07900 ++ 0.00000 {?} {304.CG1} 29.83000 0.42500 0.42500 EE 0.00000 {?} 2.13270 0.17820 0 {?} 0 1184 {322.HA} 4.14500 0.07800 0.10800 ++ 0.00000 {?} {322.HG12} 0.61100 0.09500 0.14100 ++ 0.00000 {?} {322.CG1} 27.20600 0.37000 0.37000 EE 0.00000 {?} 6.55020 0.16110 0 {?} 0 1185 {322.HA} 4.13800 0.07900 0.10600 ++ 0.00000 {?} {322.HG11} 1.28000 0.10100 0.16300 ? 0.00000 {?} {322.CG1} 27.20600 0.39100 0.39100 EE 0.00000 {?} 7.80080 0.16790 0 {?} 0 1186 {322.HG21} -0.51600 0.06600 0.09100 ++ 0.00000 {?} {322.HG12} 0.61800 0.10100 0.13700 ++ 0.00000 {?} {322.CG1} 27.20600 0.36800 0.36800 EE 0.00000 {?} 7.42260 0.20420 0 {?} 0 1187 {322.HG21} -0.51500 0.08700 0.10700 ++ 0.00000 {?} {322.HG11} 1.27800 0.09700 0.12600 ++ 0.00000 {?} {322.CG1} 27.20600 0.34000 0.34000 EE 0.00000 {?} 7.73350 0.21680 0 {?} 0 1188 {354.HG21} 0.79900 0.02400 0.05700 ? 0.00000 {?} {354.HD11} 0.92900 0.06700 0.09800 ++ 0.00000 {?} {354.CD1} 15.13900 0.49800 0.49800 EE 0.00000 {?} 7.75520 0.49940 0 {?} 0 1189 {342.HB2} 3.16200 0.04800 0.05700 ++ 0.00000 {?} {383.HD11} 0.16500 0.10000 0.13000 ++ 0.00000 {?} {383.CD1} 7.79400 0.34100 0.34100 EE 0.00000 {?} 2.56090 0.10220 0 {?} 0 1190 {342.HB1} 3.64200 0.06300 0.07100 ++ 0.00000 {?} {383.HD11} 0.16900 0.10000 0.11000 ++ 0.00000 {?} {383.CD1} 7.79400 0.28700 0.28700 EE 0.00000 {?} 3.15230 0.09280 0 {?} 0 1191 {?} 4.28400 0.04600 0.06200 ++ 0.00000 {?} {?} 0.15900 0.06900 0.09500 ++ 0.00000 {?} {?} 7.79400 0.36500 0.36500 EE 0.00000 {?} 1.25710 0.05800 0 {?} 0 1192 {384.HD1} 4.19300 0.05500 0.08800 ++ 0.00000 {?} {383.HD11} 0.15900 0.10500 0.14900 ++ 0.00000 {?} {383.CD1} 7.79400 0.39200 0.39200 EE 0.00000 {?} 5.17030 0.14690 0 {?} 0 1193 {346.HD1} 7.21600 0.06400 0.06400 ++ 0.00000 {?} {383.HD11} 0.16900 0.09800 0.09800 ++ 0.00000 {?} {383.CD1} 7.79400 0.21500 0.21500 EE 0.00000 {?} 2.02560 0.05940 0 {?} 0 1194 {342.HD1} 7.43700 0.10600 0.09900 ++ 0.00000 {?} {383.HD11} 0.16300 0.15700 0.14200 ++ 0.00000 {?} {383.CD1} 7.79400 0.23200 0.23200 EE 0.00000 {?} 3.60610 0.10500 0 {?} 0 1195 {361.HG11} 0.43500 0.04400 0.06000 ++ 0.00000 {?} {383.HD11} 0.16600 0.09300 0.12800 ++ 0.00000 {?} {383.CD1} 7.79400 0.37600 0.37600 EE 0.00000 {?} 2.12850 0.08730 0 {?} 0 1196 {321.HB2} 2.24600 0.06800 0.06100 ++ 0.00000 {?} {304.HD11} 0.95700 0.08800 0.08800 ++ 0.00000 {?} {304.CD1} 13.56500 0.22700 0.22700 EE 0.00000 {?} 1.81690 0.08640 0 {?} 0 1197 {321.HB1} 2.69200 0.06100 0.06600 ++ 0.00000 {?} {304.HD11} 0.95600 0.11200 0.11900 ++ 0.00000 {?} {304.CD1} 13.56500 0.28500 0.28500 EE 0.00000 {?} 2.66030 0.08440 0 {?} 0 1198 {322.HB} 1.42100 0.05200 0.05600 ++ 0.00000 {?} {304.HD11} 0.95600 0.07100 0.07700 ++ 0.00000 {?} {304.CD1} 13.56500 0.28600 0.28600 EE 0.00000 {?} 2.30540 0.11400 0 {?} 0 1199 {328.HB1} 2.40000 0.06400 0.07500 ++ 0.00000 {?} {354.HD11} 0.92700 0.08100 0.10300 ++ 0.00000 {?} {354.CD1} 15.13900 0.32100 0.32100 EE 0.00000 {?} 2.80600 0.10060 0 {?} 0 1200 {346.HB2} 2.90900 0.05500 0.07200 ++ 0.00000 {?} {354.HD11} 0.92900 0.08900 0.13100 ++ 0.00000 {?} {354.CD1} 15.13900 0.37200 0.37200 EE 0.00000 {?} 4.59480 0.15160 0 {?} 0 1201 {346.HB1} 3.06600 0.06600 0.09100 ++ 0.00000 {?} {354.HD11} 0.93100 0.07100 0.11800 ++ 0.00000 {?} {354.CD1} 15.13900 0.39300 0.39300 EE 0.00000 {?} 4.87510 0.14220 0 {?} 0 1202 {346.HE1} 6.64200 0.05100 0.05900 ++ 0.00000 {?} {354.HD11} 0.92800 0.08800 0.10600 ++ 0.00000 {?} {354.CD1} 15.13900 0.32200 0.32200 EE 0.00000 {?} 1.33160 0.05280 0 {?} 0 1203 {346.HD1} 7.22200 0.07700 0.09900 ++ 0.00000 {?} {354.HD11} 0.92300 0.08100 0.11600 ++ 0.00000 {?} {354.CD1} 15.13900 0.36200 0.36200 EE 0.00000 {?} 4.71570 0.14530 0 {?} 0 1204 {324.HZ3} 7.28800 0.08000 0.07600 ++ 0.00000 {?} {322.HD11} 0.71600 0.11300 0.11300 ++ 0.00000 {?} {322.CD1} 15.40100 0.24600 0.24600 EE 0.00000 {?} 3.15510 0.09420 0 {?} 0 1205 {304.HG11} 1.75900 0.03400 0.05800 ? 0.00000 {?} {322.HD11} 0.72200 0.07400 0.11700 ++ 0.00000 {?} {322.CD1} 15.40100 0.39800 0.39800 EE 0.00000 {?} 5.71090 0.31020 0 {?} 0 1206 {362.HA} 4.47500 0.05000 0.06500 ++ 0.00000 {?} {322.HD11} 0.71800 0.08600 0.11900 ++ 0.00000 {?} {322.CD1} 15.40100 0.35500 0.35500 EE 0.00000 {?} 2.79560 0.11530 0 {?} 0 1207 {360.HB1} 1.65800 0.06000 0.11300 ? 0.00000 {?} {322.HG21} -0.50900 0.08300 0.11800 ++ 0.00000 {?} {322.CG2} 16.18800 0.39800 0.39800 EE 0.00000 {?} 6.00300 0.16590 0 {?} 0 1208 {283.HE1} 1.91400 0.07100 0.08900 ++ 0.00000 {?} {322.HG21} -0.51100 0.10300 0.14400 ++ 0.00000 {?} {322.CG2} 16.18800 0.37400 0.37400 EE 0.00000 {?} 5.75730 0.15500 0 {?} 0 1209 {324.HB1} 3.68100 0.05200 0.06300 ++ 0.00000 {?} {322.HG21} -0.51200 0.07300 0.08200 ++ 0.00000 {?} {322.CG2} 16.18800 0.33200 0.33200 EE 0.00000 {?} 2.26070 0.12370 0 {?} 0 1210 {324.HZ2} 7.12800 0.06500 0.07900 ++ 0.00000 {?} {322.HG21} -0.51400 0.10500 0.13600 ++ 0.00000 {?} {322.CG2} 16.18800 0.33200 0.33200 EE 0.00000 {?} 3.72550 0.11590 0 {?} 0 1211 {385.HA} 4.00000 0.03900 0.04300 ++ 0.00000 {?} {383.HG21} 0.71300 0.06700 0.07600 ++ 0.00000 {?} {383.CG2} 16.97500 0.29600 0.29600 EE 0.00000 {?} 0.59840 0.04470 0 {?} 0 1212 {385.HB1} 2.67500 0.05500 0.05700 ++ 0.00000 {?} {383.HG21} 0.70100 0.08800 0.09000 ++ 0.00000 {?} {383.CG2} 16.97500 0.27200 0.27200 EE 0.00000 {?} 2.37310 0.10080 0 {?} 0 1213 {328.HB1} 2.40000 0.07300 0.08000 ++ 0.00000 {?} {383.HG21} 0.70600 0.11400 0.12400 ++ 0.00000 {?} {383.CG2} 16.97500 0.29600 0.29600 EE 0.00000 {?} 3.71700 0.09750 0 {?} 0 1214 {?} 2.00800 0.06800 0.06800 ++ 0.00000 {?} {?} 0.70900 0.11000 0.11000 ++ 0.00000 {?} {?} 16.97500 0.23400 0.23400 EE 0.00000 {?} 3.95760 0.10500 0 {?} 0 1215 {320.HB2} 2.48300 0.07500 0.07200 ++ 0.00000 {?} {304.HG21} 0.94500 0.10400 0.10100 ++ 0.00000 {?} {304.CG2} 16.97500 0.24700 0.24700 EE 0.00000 {?} 2.85070 0.13540 0 {?} 0 1216 {305.HA1} 4.50000 0.06900 0.07500 ++ 0.00000 {?} {304.HG21} 0.94500 0.08100 0.09100 ++ 0.00000 {?} {304.CG2} 16.97500 0.29900 0.29900 EE 0.00000 {?} 2.74240 0.09870 0 {?} 0 1217 {301.HA} 4.05400 0.05200 0.05900 ++ 0.00000 {?} {304.HG21} 0.94100 0.08900 0.11300 ++ 0.00000 {?} {304.CG2} 16.97500 0.31300 0.31300 EE 0.00000 {?} 2.29770 0.09680 0 {?} 0 1218 {305.HA2} 3.43900 0.06600 0.06600 ? 0.00000 {?} {304.HG21} 0.94600 0.11100 0.13200 ++ 0.00000 {?} {304.CG2} 16.97500 0.31700 0.31700 EE 0.00000 {?} 4.46880 0.13600 0 {?} 0 1219 {?} 1.21700 0.03400 0.03800 ++ 0.00000 {?} {?} 2.11700 0.07800 0.08400 ++ 0.00000 {?} {?} 16.97500 0.29600 0.29600 EE 0.00000 {?} 0.69890 0.05120 0 {?} 0 1220 {396.HB1} 2.63200 0.04700 0.05700 ++ 0.00000 {?} {396.HE1} 2.12000 0.12000 0.14200 ++ 0.00000 {?} {396.CE} 16.97500 0.33100 0.33100 EE 0.00000 {?} 6.51120 0.26130 0 {?} 0 1221 {396.HA} 4.44900 0.05600 0.06100 ++ 0.00000 {?} {396.HE1} 2.12000 0.11300 0.12300 ++ 0.00000 {?} {396.CE} 16.97500 0.29000 0.29000 EE 0.00000 {?} 1.78450 0.08340 0 {?} 0 1222 {324.HH2} 6.78200 0.08800 0.10400 ++ 0.00000 {?} {283.HE1} 1.92400 0.08500 0.11700 ++ 0.00000 {?} {283.CE} 17.46200 0.36200 0.36200 EE 0.00000 {?} 7.67140 0.22820 0 {?} 0 1223 {360.HD1} 3.67700 0.04300 0.07000 ? 0.00000 {?} {283.HE1} 1.92300 0.10500 0.16100 ++ 0.00000 {?} {283.CE} 17.46200 0.38300 0.38300 EE 0.00000 {?} 5.18390 0.19970 0 {?} 0 1224 {283.HA} 3.97500 0.04800 0.07000 ++ 0.00000 {?} {283.HE1} 1.92100 0.10300 0.13900 ++ 0.00000 {?} {283.CE} 17.46200 0.37900 0.37900 EE 0.00000 {?} 3.52550 0.13370 0 {?} 0 1225 {359.HA} 4.52100 0.08900 0.10800 ++ 0.00000 {?} {283.HE1} 1.92100 0.13000 0.14500 ? 0.00000 {?} {283.CE} 17.46200 0.36700 0.36700 EE 0.00000 {?} 6.47430 0.13980 0 {?} 0 1226 {283.HG1} 2.57600 0.06500 0.10400 ? 0.00000 {?} {283.HE1} 1.91900 0.07100 0.11400 ++ 0.00000 {?} {283.CE} 17.46200 0.40000 0.40000 EE 0.00000 {?} 7.94920 0.24400 0 {?} 0 1227 {379.HG1} 2.05300 0.05400 0.06600 ++ 0.00000 {?} {380.HB1} 1.24500 0.07700 0.10300 ++ 0.00000 {?} {380.CB} 19.83000 0.33800 0.33800 EE 0.00000 {?} 2.40410 0.09150 0 {?} 0 1228 {295.HB1} 3.32700 0.06800 0.09800 ++ 0.00000 {?} {290.HG21} 1.22600 0.08600 0.13600 ++ 0.00000 {?} {290.CG2} 20.64800 0.38800 0.38800 EE 0.00000 {?} 5.81150 0.19700 0 {?} 0 1229 {298.HB2} 2.27100 0.04900 0.06600 ++ 0.00000 {?} {290.HG21} 1.22300 0.07700 0.13100 ++ 0.00000 {?} {290.CG2} 20.64800 0.40200 0.40200 EE 0.00000 {?} 6.15150 0.20000 0 {?} 0 1230 {296.HA} 3.02400 0.07400 0.09300 ++ 0.00000 {?} {296.HG2} 0.20700 0.12900 0.15900 ++ 0.00000 {?} {296.CG} 32.45300 0.33800 0.33800 EE 0.00000 {?} 5.46230 0.13060 0 {?} 0 1231 {296.HB1} 1.49100 0.06500 0.07400 ++ 0.00000 {?} {296.HG2} 0.20800 0.17600 0.19800 ++ 0.00000 {?} {296.CG} 32.45300 0.30800 0.30800 EE 0.00000 {?} 4.47650 0.11410 0 {?} 0 1232 {283.HA} 3.98200 0.07400 0.07800 ++ 0.00000 {?} {283.HB1} 3.23300 0.12100 0.13000 ++ 0.00000 {?} {283.CB} 34.02700 0.28500 0.28500 EE 0.00000 {?} 2.90530 0.08660 0 {?} 0 1233 {299.HG11} 0.67800 0.05800 0.04900 ? 0.00000 {?} {283.HB1} 3.26400 0.08100 0.08100 ++ 0.00000 {?} {283.CB} 34.02700 0.20100 0.20100 EE 0.00000 {?} 0.81370 0.04820 0 {?} 0 1234 {279.HG21} 0.97500 0.05300 0.04700 ++ 0.00000 {?} {283.HB1} 3.24300 0.11700 0.10600 ++ 0.00000 {?} {283.CB} 34.02700 0.22900 0.22900 EE 0.00000 {?} 1.28810 0.07120 0 {?} 0 1235 {299.HG11} 0.68000 0.04100 0.04600 ? 0.00000 {?} {283.HB2} 2.45400 0.11300 0.12600 ++ 0.00000 {?} {283.CB} 34.02700 0.30300 0.30300 EE 0.00000 {?} 2.87310 0.11660 0 {?} 0 1236 {323.HB1} 2.86400 0.08500 0.10600 ++ 0.00000 {?} {361.HB} 1.45400 0.07900 0.10300 ++ 0.00000 {?} {361.CB} 34.55100 0.34400 0.34400 EE 0.00000 {?} 3.81700 0.10130 0 {?} 0 1237 {361.HA} 4.00800 0.05000 0.06200 ++ 0.00000 {?} {361.HB} 1.45900 0.09200 0.11700 ++ 0.00000 {?} {361.CB} 34.55100 0.33800 0.33800 EE 0.00000 {?} 1.29010 0.04680 0 {?} 0 1238 {317.HE1} 6.91200 0.05500 0.06900 ++ 0.00000 {?} {315.HB2} 1.38700 0.07800 0.10800 ? 0.00000 {?} {315.CB} 35.33800 0.36500 0.36500 EE 0.00000 {?} 1.24210 0.04180 0 {?} 0 1239 {386.HD21} 0.83900 0.05100 0.06000 ++ 0.00000 {?} {385.HG2} 2.38200 0.11300 0.12800 ? 0.00000 {?} {385.CG} 35.07600 0.31900 0.31900 EE 0.00000 {?} 3.46180 0.10940 0 {?} 0 1240 {386.HD21} 0.84300 0.06300 0.06000 ++ 0.00000 {?} {385.HG1} 2.52800 0.10000 0.10700 ? 0.00000 {?} {385.CG} 35.07600 0.25000 0.25000 EE 0.00000 {?} 1.46560 0.06070 0 {?} 0 1241 {280.HD11} 0.96000 0.05500 0.08800 ++ 0.00000 {?} {385.HG2} 2.39100 0.10600 0.15000 ? 0.00000 {?} {385.CG} 35.07600 0.39300 0.39300 EE 0.00000 {?} 5.97200 0.14920 0 {?} 0 1242 {280.HD11} 0.96000 0.05800 0.09600 ++ 0.00000 {?} {385.HG1} 2.51900 0.06300 0.11700 ? 0.00000 {?} {385.CG} 35.07600 0.40100 0.40100 EE 0.00000 {?} 5.27500 0.20540 0 {?} 0 1243 {385.HB2} 1.65200 0.06700 0.08700 ++ 0.00000 {?} {385.HG2} 2.40000 0.07900 0.12400 ? 0.00000 {?} {385.CG} 35.07600 0.34700 0.34700 EE 0.00000 {?} 5.66190 0.15100 0 {?} 0 1244 {385.HB2} 1.65200 0.07000 0.09100 ++ 0.00000 {?} {385.HG1} 2.51600 0.08900 0.13300 ? 0.00000 {?} {385.CG} 35.07600 0.34800 0.34800 EE 0.00000 {?} 4.96020 0.13030 0 {?} 0 1245 {385.HA} 3.99900 0.06400 0.07900 ++ 0.00000 {?} {385.HG1} 2.50600 0.13000 0.17000 ? 0.00000 {?} {385.CG} 35.07600 0.34400 0.34400 EE 0.00000 {?} 6.32910 0.14150 0 {?} 0 1246 {385.HA} 3.99900 0.05100 0.05700 ++ 0.00000 {?} {385.HG2} 2.41100 0.10800 0.12200 ? 0.00000 {?} {385.CG} 35.07600 0.29900 0.29900 EE 0.00000 {?} 4.58960 0.12680 0 {?} 0 1247 {389.HD11} 0.65300 0.04100 0.07200 ++ 0.00000 {?} {277.HG1} 2.47200 0.09400 0.14300 ++ 0.00000 {?} {277.CG} 36.38800 0.38700 0.38700 EE 0.00000 {?} 4.52320 0.19090 0 {?} 0 1248 {278.HG21} 0.93500 0.05600 0.07300 ++ 0.00000 {?} {277.HG1} 2.47700 0.10000 0.13200 ++ 0.00000 {?} {277.CG} 36.38800 0.34800 0.34800 EE 0.00000 {?} 3.38940 0.11430 0 {?} 0 1249 {281.HB2} 2.86400 0.05900 0.08200 ++ 0.00000 {?} {277.HG1} 2.48000 0.07600 0.10600 ++ 0.00000 {?} {277.CG} 36.38800 0.38600 0.38600 EE 0.00000 {?} 6.86510 0.24220 0 {?} 0 1250 {388.HD1} 7.18300 0.07700 0.07000 ++ 0.00000 {?} {277.HG1} 2.46800 0.12600 0.11800 ++ 0.00000 {?} {277.CG} 36.38800 0.24200 0.24200 EE 0.00000 {?} 2.34090 0.09290 0 {?} 0 1251 {388.HE1} 6.83600 0.06200 0.05300 ++ 0.00000 {?} {277.HG1} 2.47300 0.11200 0.11200 ++ 0.00000 {?} {277.CG} 36.38800 0.21200 0.21200 EE 0.00000 {?} 1.59360 0.07250 0 {?} 0 1252 {309.HD21} 0.74300 0.06000 0.07800 ++ 0.00000 {?} {314.HB2} 2.66800 0.14100 0.17600 ++ 0.00000 {?} {314.CB} 37.96200 0.33700 0.33700 EE 0.00000 {?} 4.23890 0.11610 0 {?} 0 1253 {309.HD21} 0.74700 0.04300 0.06800 ++ 0.00000 {?} {314.HB1} 3.09600 0.07500 0.11700 ++ 0.00000 {?} {314.CB} 37.96200 0.39700 0.39700 EE 0.00000 {?} 4.01270 0.18880 0 {?} 0 1254 {354.HG12} 0.59700 0.06600 0.06600 ++ 0.00000 {?} {354.HB} 1.67500 0.13200 0.13100 ++ 0.00000 {?} {354.CB} 39.53600 0.25800 0.25800 EE 0.00000 {?} 3.08130 0.10300 0 {?} 0 1255 {354.HA} 3.77500 0.05300 0.07300 ++ 0.00000 {?} {354.HB} 1.66200 0.10700 0.23600 ? 0.00000 {?} {354.CB} 39.53600 0.39600 0.39600 EE 0.00000 {?} 5.55770 0.14710 0 {?} 0 1256 {376.HD11} 0.92800 0.04600 0.06500 ++ 0.00000 {?} {377.HD2} 3.65400 0.10300 0.15200 ++ 0.00000 {?} {377.CD} 50.81600 0.40000 0.40000 EE 0.00000 {?} 3.67580 0.11650 0 {?} 0 1257 {376.HD11} 0.92400 0.04200 0.05000 ++ 0.00000 {?} {377.HD1} 3.95500 0.09100 0.11500 ++ 0.00000 {?} {377.CD} 50.81600 0.33300 0.33300 EE 0.00000 {?} 1.24340 0.05420 0 {?} 0 1258 {376.HB1} 1.63900 0.05900 0.07500 ++ 0.00000 {?} {377.HD1} 3.94400 0.05700 0.15400 ? 0.00000 {?} {377.CD} 50.81600 0.37300 0.37300 EE 0.00000 {?} 2.23030 0.11190 0 {?} 0 1259 {361.HG21} 0.22800 0.05200 0.06600 ++ 0.00000 {?} {327.HA} 5.48100 0.06300 0.08400 ++ 0.00000 {?} {327.CA} 52.39000 0.35100 0.35100 EE 0.00000 {?} 0.72580 0.03790 0 {?} 0 1260 {350.HE1} 6.80700 0.04200 0.05200 ++ 0.00000 {?} {350.HA} 5.05600 0.08500 0.11100 ++ 0.00000 {?} {350.CA} 56.58700 0.34700 0.34700 EE 0.00000 {?} 1.45070 0.05870 0 {?} 0 1261 {349.HG1} 1.65800 0.06200 0.08800 ++ 0.00000 {?} {349.HA} 3.77300 0.10200 0.15500 ++ 0.00000 {?} {349.CA} 56.84900 0.37800 0.37800 EE 0.00000 {?} 4.65390 0.12660 0 {?} 0 1262 {349.HG2} 1.00700 0.06400 0.09300 ++ 0.00000 {?} {349.HA} 3.77500 0.08700 0.12200 ++ 0.00000 {?} {349.CA} 56.84900 0.39100 0.39100 EE 0.00000 {?} 5.95280 0.18720 0 {?} 0 1263 {360.HB1} 1.65200 0.07700 0.10100 ++ 0.00000 {?} {324.HA} 4.49400 0.08400 0.10400 ++ 0.00000 {?} {324.CA} 58.16100 0.34000 0.34000 EE 0.00000 {?} 4.08170 0.11160 0 {?} 0 1264 {360.HB2} 0.97700 0.06900 0.07600 ++ 0.00000 {?} {324.HA} 4.49200 0.11100 0.13100 ++ 0.00000 {?} {324.CA} 58.16100 0.29800 0.29800 EE 0.00000 {?} 4.71990 0.11210 0 {?} 0 1265 {296.HG2} 0.20400 0.06700 0.09100 ++ 0.00000 {?} {296.HA} 3.02100 0.11500 0.14900 ++ 0.00000 {?} {296.CA} 59.21000 0.35800 0.35800 EE 0.00000 {?} 5.89640 0.15610 0 {?} 0 1266 {296.HB1} 1.48800 0.07200 0.08700 ++ 0.00000 {?} {296.HA} 3.03200 0.12800 0.17300 ++ 0.00000 {?} {296.CA} 59.21000 0.35300 0.35300 EE 0.00000 {?} 6.82570 0.16660 0 {?} 0 1267 {296.HG1} 1.67300 0.06600 0.06800 ++ 0.00000 {?} {296.HA} 3.03900 0.11900 0.12400 ++ 0.00000 {?} {296.CA} 59.21000 0.27800 0.27800 EE 0.00000 {?} 2.60060 0.09900 0 {?} 0 1268 {324.HZ2} 7.12900 0.05100 0.06600 ++ 0.00000 {?} {296.HA} 3.02300 0.11200 0.14300 ++ 0.00000 {?} {296.CA} 59.21000 0.34500 0.34500 EE 0.00000 {?} 4.38220 0.14140 0 {?} 0 1269 {331.HG21} 0.96300 0.04900 0.07000 ++ 0.00000 {?} {331.HA} 4.94300 0.08400 0.12500 ? 0.00000 {?} {331.CA} 59.21000 0.39100 0.39100 EE 0.00000 {?} 1.02930 0.04310 0 {?} 0 1270 {360.HB1} 1.63800 0.06300 0.09500 ++ 0.00000 {?} {360.HA} 5.16500 0.09200 0.13900 ++ 0.00000 {?} {360.CA} 61.57100 0.38200 0.38200 EE 0.00000 {?} 3.95980 0.13470 0 {?} 0 1271 {360.HB2} 0.99900 0.06800 0.08300 ++ 0.00000 {?} {360.HA} 5.17000 0.08300 0.10700 ++ 0.00000 {?} {360.CA} 61.57100 0.33200 0.33200 EE 0.00000 {?} 4.44510 0.14170 0 {?} 0 1272 {360.HG1} 0.77000 0.07000 0.07200 ++ 0.00000 {?} {360.HA} 5.16900 0.04700 0.08800 ? 0.00000 {?} {360.CA} 61.57100 0.27700 0.27700 EE 0.00000 {?} 1.68720 0.07310 0 {?} 0 1273 {389.HB1} 1.70200 0.04200 0.06900 ? 0.00000 {?} {390.HA} 4.60600 0.07800 0.10500 ++ 0.00000 {?} {390.CA} 61.57100 0.34900 0.34900 EE 0.00000 {?} 1.11450 0.04700 0 {?} 0 1274 {331.HG21} 0.97600 0.06300 0.07700 ++ 0.00000 {?} {341.HB2} 3.94000 0.12000 0.14100 ++ 0.00000 {?} {341.CB} 65.50600 0.32700 0.32700 EE 0.00000 {?} 2.48090 0.07430 0 {?} 0 1275 {341.HA} 5.16700 0.05600 0.09100 ++ 0.00000 {?} {341.HB2} 3.94700 0.08700 0.12300 ++ 0.00000 {?} {341.CB} 65.50600 0.36100 0.36100 EE 0.00000 {?} 2.13220 0.07160 0 {?} 0 1276 {309.HA} 5.32100 0.06900 0.08200 ++ 0.00000 {?} {316.HB} 3.89400 0.10200 0.11600 ++ 0.00000 {?} {316.CB} 71.74000 0.32600 0.32600 EE 0.00000 {?} 2.97820 0.08280 0 {?} 0 1277 {281.HA} 4.43900 0.06000 0.08400 ++ 0.00000 {?} {281.HB1} 3.16300 0.12100 0.17700 ++ 0.00000 {?} {281.CB} 40.84700 0.38000 0.38000 EE 0.00000 {?} 6.28940 0.17720 0 {?} 0 1278 {273.HA} 4.10800 0.02300 0.07700 ? 0.00000 {?} {273.HB} 2.06400 0.07600 0.17500 ? 0.00000 {?} {273.CB} 32.71500 0.49300 0.49300 EE 0.00000 {?} 15.34760 0.76270 0 {?} 0 1279 {273.HA} 4.10000 0.02400 0.08400 ? 0.00000 {?} {273.HG21} 0.95300 0.06700 0.21400 ? 0.00000 {?} {273.CG2} 20.64800 0.50400 0.50400 EE 0.00000 {?} 28.20060 1.62080 0 {?} 0 1280 {311.HE1} 2.59900 0.03700 0.05500 ++ 0.00000 {?} {311.HD2} 1.27000 0.05500 0.09500 ++ 0.00000 {?} {311.CD} 29.83000 0.38500 0.38500 EE 0.00000 {?} 1.80970 0.11060 0 {?} 0 1281 {311.HE2} 2.13100 0.04300 0.06100 ++ 0.00000 {?} {311.HD1} 1.49400 0.05400 0.10800 ? 0.00000 {?} {311.CD} 29.83000 0.38000 0.38000 EE 0.00000 {?} 1.15820 0.07450 0 {?} 0 1282 {278.HA} 5.04300 0.05900 0.08700 ++ 0.00000 {?} {278.HB} 4.67400 0.15300 0.21400 ++ 0.00000 {?} {278.CB} 72.58900 0.39100 0.39100 EE 0.00000 {?} 7.91100 0.16950 0 {?} 0 1283 {362.HD11} 0.70500 0.07100 0.07100 ? 0.00000 {?} {387.HB2} 2.21200 0.09000 0.14300 ++ 0.00000 {?} {387.CB} 30.61700 0.38600 0.38600 EE 0.00000 {?} 8.98790 0.22880 0 {?} 0 1284 {384.HA} 3.80700 0.06400 0.09400 ++ 0.00000 {?} {387.HB2} 2.19700 0.08700 0.12400 ++ 0.00000 {?} {387.CB} 30.61700 0.38100 0.38100 EE 0.00000 {?} 6.29090 0.22180 0 {?} 0 1285 {387.HB1} 2.76800 0.08900 0.09900 ++ 0.00000 {?} {308.HG11} 0.63300 0.09400 0.10500 ++ 0.00000 {?} {308.CG1} 21.69700 0.30300 0.30300 EE 0.00000 {?} 4.11200 0.12890 0 {?} 0 1286 {280.HB1} 1.89100 0.08000 0.10200 ++ 0.00000 {?} {280.HA} 4.14200 0.09100 0.14300 ? 0.00000 {?} {280.CA} 57.89900 0.35300 0.35300 EE 0.00000 {?} 9.95530 0.22420 0 {?} 0 1287 {385.HA} 4.00600 0.05700 0.06200 ++ 0.00000 {?} {280.HB1} 1.87600 0.09700 0.10500 ++ 0.00000 {?} {280.CB} 41.37200 0.29200 0.29200 EE 0.00000 {?} 3.09750 0.11190 0 {?} 0 1288 {280.HG} 1.57100 0.05700 0.06400 ++ 0.00000 {?} {280.HA} 4.13000 0.10200 0.12700 ? 0.00000 {?} {280.CA} 57.89900 0.29700 0.29700 EE 0.00000 {?} 3.74040 0.12380 0 {?} 0 1289 {280.HD11} 0.95500 0.03300 0.10400 ? 0.00000 {?} {280.HG} 1.57400 0.07900 0.16100 ? 0.00000 {?} {280.CG} 26.15700 0.47300 0.47300 EE 0.00000 {?} 26.26690 0.73970 0 {?} 0 1290 {281.HB1} 3.16300 0.05900 0.08300 ? 0.00000 {?} {281.HA} 4.43400 0.06500 0.10700 ? 0.00000 {?} {281.CA} 57.63600 0.40800 0.40800 EE 0.00000 {?} 8.89370 0.28650 0 {?} 0 1291 {345.HE1} 6.61800 0.07800 0.08600 ? 0.00000 {?} {345.HA} 4.29400 0.10200 0.11200 ++ 0.00000 {?} {345.CA} 61.30900 0.29600 0.29600 EE 0.00000 {?} 3.39000 0.07210 0 {?} 0 1292 {345.HB2} 3.13600 0.04600 0.06800 ? 0.00000 {?} {345.HA} 4.29400 0.08400 0.12500 ++ 0.00000 {?} {345.CA} 61.30900 0.37400 0.37400 EE 0.00000 {?} 2.31720 0.08750 0 {?} 0 1293 {345.HA} 4.30600 0.05500 0.07300 ++ 0.00000 {?} {345.HB2} 3.16200 0.06000 0.13200 ? 0.00000 {?} {345.CB} 39.27300 0.37700 0.37700 EE 0.00000 {?} 1.93410 0.09220 0 {?} 0 1294 {283.HG1} 2.57700 0.06500 0.06200 ++ 0.00000 {?} {283.HA} 3.98300 0.10000 0.09500 ++ 0.00000 {?} {283.CA} 60.52200 0.24800 0.24800 EE 0.00000 {?} 3.42280 0.16840 0 {?} 0 1295 {283.HA} 3.98200 0.05200 0.07200 ? 0.00000 {?} {283.HB2} 2.45400 0.09500 0.15000 ? 0.00000 {?} {283.CB} 34.02700 0.38500 0.38500 EE 0.00000 {?} 6.60500 0.20480 0 {?} 0 1296 {290.HA} 4.48000 0.06300 0.09000 ? 0.00000 {?} {291.HG1} 2.33200 0.11600 0.16900 ++ 0.00000 {?} {291.CG} 36.65000 0.38100 0.38100 EE 0.00000 {?} 6.54550 0.15190 0 {?} 0 1297 {291.HB1} 2.14000 0.04500 0.09300 ? 0.00000 {?} {291.HA} 4.40200 0.06300 0.13200 ? 0.00000 {?} {291.CA} 56.06200 0.48300 0.48300 EE 0.00000 {?} 32.01150 0.80840 0 {?} 0 1298 {290.HA} 4.47600 0.02800 0.09700 ? 0.00000 {?} {290.HG21} 1.22300 0.06100 0.17900 ? 0.00000 {?} {290.CG2} 20.64800 0.50000 0.50000 EE 0.00000 {?} 21.45230 1.13310 0 {?} 0 1299 {295.HA} 4.28200 0.04200 0.10900 ? 0.00000 {?} {290.HG21} 1.22300 0.06400 0.16800 ? 0.00000 {?} {290.CG2} 20.64800 0.47400 0.47400 EE 0.00000 {?} 22.38240 0.57810 0 {?} 0 1300 {292.HG2} 2.20700 0.04900 0.06300 ? 0.00000 {?} {292.HA} 3.95400 0.07200 0.12200 ? 0.00000 {?} {292.CA} 59.99700 0.38200 0.38200 EE 0.00000 {?} 5.18690 0.21960 0 {?} 0 1301 {295.HB2} 3.00600 0.06100 0.08200 ++ 0.00000 {?} {292.HA} 3.95500 0.09600 0.13300 ++ 0.00000 {?} {292.CA} 59.99700 0.34800 0.34800 EE 0.00000 {?} 5.17230 0.16270 0 {?} 0 1302 {295.HB1} 3.33400 0.05900 0.07600 ++ 0.00000 {?} {292.HA} 3.95600 0.11300 0.15200 ++ 0.00000 {?} {292.CA} 59.99700 0.34600 0.34600 EE 0.00000 {?} 5.09680 0.15750 0 {?} 0 1303 {347.HB2} 1.99500 0.05300 0.09400 ? 0.00000 {?} {347.HA} 4.15100 0.07200 0.15100 ? 0.00000 {?} {347.CA} 59.73500 0.44500 0.44500 EE 0.00000 {?} 12.87650 0.25390 0 {?} 0 1304 {347.HG2} 1.62900 0.04800 0.07600 ++ 0.00000 {?} {347.HA} 4.15700 0.06900 0.15800 ? 0.00000 {?} {347.CA} 59.73500 0.38700 0.38700 EE 0.00000 {?} 3.51200 0.15240 0 {?} 0 1305 {295.HB2} 3.00900 0.04100 0.06400 ++ 0.00000 {?} {295.HA} 4.28300 0.07600 0.10500 ++ 0.00000 {?} {295.CA} 61.30900 0.36700 0.36700 EE 0.00000 {?} 3.63090 0.16880 0 {?} 0 1306 {295.HA} 4.28700 0.06100 0.06600 ++ 0.00000 {?} {295.HB2} 2.99000 0.13100 0.14200 ? 0.00000 {?} {295.CB} 39.27300 0.29300 0.29300 EE 0.00000 {?} 4.76820 0.11120 0 {?} 0 1307 {286.HA} 4.16200 0.05500 0.07800 ++ 0.00000 {?} {286.HB1} 3.17700 0.06800 0.15300 ? 0.00000 {?} {286.CB} 39.53600 0.37600 0.37600 EE 0.00000 {?} 4.69520 0.20600 0 {?} 0 1308 {296.HB2} 0.76000 0.06600 0.06600 ? 0.00000 {?} {296.HA} 3.02700 0.14800 0.13000 ++ 0.00000 {?} {296.CA} 59.21000 0.18000 0.18000 EE 0.00000 {?} 6.18540 0.19180 0 {?} 0 1309 {296.HA} 3.02600 0.05100 0.06200 ++ 0.00000 {?} {296.HB1} 1.48900 0.09300 0.11700 ++ 0.00000 {?} {296.CB} 26.64400 0.32600 0.32600 EE 0.00000 {?} 2.20370 0.09430 0 {?} 0 1310 {296.HA} 3.02400 0.06600 0.08400 ++ 0.00000 {?} {296.HB2} 0.76200 0.12300 0.15100 ++ 0.00000 {?} {296.CB} 26.64400 0.33800 0.33800 EE 0.00000 {?} 5.21680 0.14170 0 {?} 0 1311 {296.HA} 3.02600 0.06100 0.06500 ++ 0.00000 {?} {296.HG1} 1.64400 0.10400 0.11400 ? 0.00000 {?} {296.CG} 32.45300 0.30800 0.30800 EE 0.00000 {?} 1.90660 0.08510 0 {?} 0 1312 {298.HA} 4.09600 0.04800 0.07600 ? 0.00000 {?} {298.HB1} 2.30900 0.08900 0.10600 ++ 0.00000 {?} {298.CB} 28.78000 0.31100 0.31100 EE 0.00000 {?} 9.65090 0.38600 0 {?} 0 1313 {294.HB1} 1.92200 0.07800 0.08500 ? 0.00000 {?} {298.HG2} 2.47300 0.05000 0.10400 ? 0.00000 {?} {298.CG} 34.39100 0.32400 0.32400 EE 0.00000 {?} 2.92880 0.13790 0 {?} 0 1314 {294.HB1} 1.93100 0.05900 0.06500 ? 0.00000 {?} {298.HG1} 2.63900 0.06600 0.08600 ? 0.00000 {?} {298.CG} 34.39100 0.29200 0.29200 EE 0.00000 {?} 3.54690 0.14050 0 {?} 0 1315 {294.HD1} 1.68300 0.06700 0.07700 ++ 0.00000 {?} {298.HG1} 2.62500 0.11000 0.12100 ? 0.00000 {?} {298.CG} 34.39100 0.27200 0.27200 EE 0.00000 {?} 3.20190 0.08810 0 {?} 0 1316 {286.HZ} 7.19500 0.07100 0.07800 ? 0.00000 {?} {298.HG2} 2.45700 0.12300 0.13400 ? 0.00000 {?} {298.CG} 34.25000 0.27400 0.27400 EE 0.00000 {?} 6.30100 0.14710 0 {?} 0 1317 {286.HZ} 7.19600 0.06900 0.06900 ++ 0.00000 {?} {298.HG1} 2.63000 0.06000 0.10100 ? 0.00000 {?} {298.CG} 34.25100 0.19500 0.19500 EE 0.00000 {?} 2.31410 0.11290 0 {?} 0 1318 {302.HG2} 2.07800 0.06700 0.06300 ++ 0.00000 {?} {299.HA} 3.18600 0.10700 0.09800 ++ 0.00000 {?} {299.CA} 65.40000 0.23700 0.23700 EE 0.00000 {?} 1.74230 0.08690 0 {?} 0 1319 {286.HD1} 7.18700 0.04500 0.04500 ++ 0.00000 {?} {299.HA} 3.18800 0.12000 0.12000 ++ 0.00000 {?} {299.CA} 65.44000 0.11100 0.11100 EE 0.00000 {?} 3.59680 0.14040 0 {?} 0 1320 {286.HB2} 2.92200 0.05500 0.09400 ++ 0.00000 {?} {299.HG11} 0.67100 0.08300 0.12100 ++ 0.00000 {?} {299.CG1} 24.15800 0.38900 0.38900 EE 0.00000 {?} 4.70250 0.16930 0 {?} 0 1321 {300.HB1} 4.07800 0.07300 0.07300 ? 0.00000 {?} {300.HA} 4.16200 0.06800 0.13600 ? 0.00000 {?} {300.CA} 62.88000 0.49800 0.49800 EE 0.00000 {?} 138.07280 1.99930 0 {?} 0 1322 {303.HB1} 1.70900 0.06100 0.06500 ? 0.00000 {?} {300.HA} 4.16500 0.10000 0.10500 ++ 0.00000 {?} {300.CA} 62.88000 0.28000 0.28000 EE 0.00000 {?} 3.72120 0.11470 0 {?} 0 1323 {303.HG} 1.76500 0.05700 0.06800 ? 0.00000 {?} {300.HA} 4.16200 0.11700 0.12400 ++ 0.00000 {?} {300.CA} 62.88000 0.28300 0.28300 EE 0.00000 {?} 4.32070 0.11360 0 {?} 0 1324 {299.HG21} 0.82000 0.04400 0.08200 ? 0.00000 {?} {300.HA} 4.15800 0.09300 0.13100 ++ 0.00000 {?} {300.CA} 62.88300 0.36600 0.36600 EE 0.00000 {?} 3.69390 0.14870 0 {?} 0 1325 {322.HD11} 0.72000 0.06000 0.06000 ? 0.00000 {?} {300.HA} 4.16400 0.18400 0.14100 ++ 0.00000 {?} {300.CA} 62.88300 0.19700 0.19700 EE 0.00000 {?} 15.33520 0.50230 0 {?} 0 1326 {301.HE1} 3.04800 0.03600 0.05100 ++ 0.00000 {?} {301.HB1} 1.98600 0.09800 0.14000 ++ 0.00000 {?} {301.CB} 32.19000 0.38200 0.38200 EE 0.00000 {?} 3.58720 0.19960 0 {?} 0 1327 {301.HE1} 3.04300 0.03700 0.05500 ? 0.00000 {?} {301.HA} 4.08200 0.12100 0.13000 ++ 0.00000 {?} {301.CA} 58.68600 0.29000 0.29000 EE 0.00000 {?} 2.77600 0.12670 0 {?} 0 1328 {302.HG2} 2.07200 0.03800 0.06300 ? 0.00000 {?} {302.HA} 4.20300 0.08500 0.14800 ++ 0.00000 {?} {302.CA} 57.37400 0.37600 0.37600 EE 0.00000 {?} 4.06370 0.19050 0 {?} 0 1329 {383.HG21} 0.70700 0.06800 0.09200 ++ 0.00000 {?} {383.HB} 1.69700 0.09500 0.12700 ++ 0.00000 {?} {383.CB} 36.65000 0.36200 0.36200 EE 0.00000 {?} 5.56030 0.16940 0 {?} 0 1330 {383.HG11} 1.22100 0.06700 0.09100 ++ 0.00000 {?} {383.HB} 1.70200 0.11000 0.15700 ++ 0.00000 {?} {383.CB} 36.65000 0.38700 0.38700 EE 0.00000 {?} 7.72110 0.19530 0 {?} 0 1331 {304.HA} 3.56400 0.06900 0.09100 ++ 0.00000 {?} {304.HB} 1.87000 0.09600 0.14000 ++ 0.00000 {?} {304.CB} 36.65000 0.35400 0.35400 EE 0.00000 {?} 6.07010 0.17120 0 {?} 0 1332 {304.HA} 3.57300 0.05300 0.06600 ++ 0.00000 {?} {304.HG11} 1.75500 0.10200 0.12500 ++ 0.00000 {?} {304.CG1} 29.83000 0.33200 0.33200 EE 0.00000 {?} 4.12560 0.15830 0 {?} 0 1333 {304.HA} 3.55500 0.04000 0.05000 ++ 0.00000 {?} {304.HG12} 0.79200 0.11000 0.12800 ++ 0.00000 {?} {304.CG1} 29.83000 0.32400 0.32400 EE 0.00000 {?} 2.01050 0.08370 0 {?} 0 1334 {306.HA} 4.40300 0.04000 0.05200 ++ 0.00000 {?} {306.HB1} 1.86900 0.05100 0.12400 ? 0.00000 {?} {306.CB} 41.89700 0.35700 0.35700 EE 0.00000 {?} 1.77820 0.13330 0 {?} 0 1335 {389.HA} 4.42000 0.04000 0.09700 ? 0.00000 {?} {389.HG} 1.49400 0.15600 0.15600 ? 0.00000 {?} {389.CG} 27.73100 0.42600 0.42600 EE 0.00000 {?} 16.50370 0.30190 0 {?} 0 1336 {322.HA} 4.13400 0.05700 0.07500 ++ 0.00000 {?} {363.HG11} 0.77400 0.07200 0.09100 ? 0.00000 {?} {363.CG1} 20.12300 0.33400 0.33400 EE 0.00000 {?} 2.40020 0.08940 0 {?} 0 1337 {385.HB1} 2.67300 0.06300 0.08900 ++ 0.00000 {?} {385.HB2} 1.65500 0.10400 0.15000 ++ 0.00000 {?} {385.CB} 32.19000 0.37700 0.37700 EE 0.00000 {?} 7.34640 0.20690 0 {?} 0 1338 {385.HG1} 2.52400 0.07400 0.08500 ++ 0.00000 {?} {385.HB2} 1.65500 0.10700 0.12300 ++ 0.00000 {?} {385.CB} 32.19000 0.30300 0.30300 EE 0.00000 {?} 4.29070 0.10800 0 {?} 0 1339 {385.HG2} 2.38700 0.07800 0.09300 ++ 0.00000 {?} {385.HB2} 1.65500 0.15000 0.15000 ? 0.00000 {?} {385.CB} 32.19000 0.30700 0.30700 EE 0.00000 {?} 6.88750 0.11950 0 {?} 0 1340 {383.HG12} 0.82200 0.06800 0.10800 ? 0.00000 {?} {385.HB2} 1.65500 0.07400 0.12000 ? 0.00000 {?} {385.CB} 32.19000 0.41900 0.41900 EE 0.00000 {?} 9.32800 0.18610 0 {?} 0 1341 {308.HA} 5.30000 0.06800 0.08200 ++ 0.00000 {?} {307.HG21} 0.79500 0.05600 0.10300 ? 0.00000 {?} {307.CG2} 21.43500 0.33400 0.33400 EE 0.00000 {?} 2.07730 0.11680 0 {?} 0 1342 {308.HG21} 0.76400 0.03100 0.05300 ++ 0.00000 {?} {308.HB} 1.97700 0.06300 0.14600 ++ 0.00000 {?} {308.CB} 35.07600 0.43900 0.43900 EE 0.00000 {?} 5.26160 0.25770 0 {?} 0 1343 {390.HG21} 1.21600 0.05100 0.06800 ? 0.00000 {?} {309.HA} 5.31600 0.08400 0.12400 ++ 0.00000 {?} {309.CA} 52.91400 0.37000 0.37000 EE 0.00000 {?} 2.33080 0.09600 0 {?} 0 1344 {309.HB1} 1.67300 0.05700 0.07800 ++ 0.00000 {?} {309.HA} 5.32200 0.09300 0.13400 ++ 0.00000 {?} {309.CA} 52.91400 0.37500 0.37500 EE 0.00000 {?} 3.28860 0.10730 0 {?} 0 1345 {316.HG21} 1.03600 0.04400 0.06600 ++ 0.00000 {?} {309.HG} 1.36600 0.09200 0.13600 ++ 0.00000 {?} {309.CG} 27.46900 0.39000 0.39000 EE 0.00000 {?} 3.23540 0.13390 0 {?} 0 1346 {310.HA} 4.91300 0.03500 0.08200 ? 0.00000 {?} {310.HG21} 1.27200 0.04400 0.12000 ? 0.00000 {?} {310.CG2} 23.27100 0.49300 0.49300 EE 0.00000 {?} 8.49010 0.46910 0 {?} 0 1347 {356.HB1} 3.05000 0.05800 0.08900 ++ 0.00000 {?} {356.HA} 4.87700 0.09000 0.13400 ++ 0.00000 {?} {356.CA} 53.70100 0.38300 0.38300 EE 0.00000 {?} 2.35820 0.07990 0 {?} 0 1348 {312.HD1} 6.63200 0.04200 0.06100 ? 0.00000 {?} {312.HB1} 3.09600 0.10000 0.10000 ++ 0.00000 {?} {312.CB} 37.43700 0.14600 0.14600 EE 0.00000 {?} 1.03500 0.04030 0 {?} 0 1349 {323.HB2} 2.11000 0.08500 0.11300 ++ 0.00000 {?} {323.HA} 4.90000 0.08900 0.14300 ++ 0.00000 {?} {323.CA} 51.87000 0.36500 0.36500 EE 0.00000 {?} 2.93850 0.07710 0 {?} 0 1350 {352.HG2} 1.95300 0.06300 0.08700 ? 0.00000 {?} {352.HA} 4.55200 0.09800 0.13900 ? 0.00000 {?} {352.CA} 53.43900 0.35600 0.35600 EE 0.00000 {?} 4.84820 0.14990 0 {?} 0 1351 {365.HB1} 2.13700 0.05900 0.07500 ? 0.00000 {?} {365.HA} 4.73100 0.06500 0.14800 ? 0.00000 {?} {365.CA} 53.43900 0.36600 0.36600 EE 0.00000 {?} 1.53680 0.06880 0 {?} 0 1352 {317.HB2} 2.23100 0.06600 0.09000 ++ 0.00000 {?} {317.HA} 4.66700 0.10300 0.10300 ? 0.00000 {?} {317.CA} 56.84900 0.35000 0.35000 EE 0.00000 {?} 3.63170 0.09870 0 {?} 0 1353 {317.HD1} 6.83900 0.02900 0.02900 ? 0.00000 {?} {317.HA} 4.66900 0.10600 0.13400 ++ 0.00000 {?} {317.CA} 56.84900 0.33500 0.33500 EE 0.00000 {?} 1.97860 0.10600 0 {?} 0 1354 {317.HE1} 6.89200 0.00900 0.05700 ? 0.00000 {?} {317.HA} 4.66200 0.10200 0.13200 ++ 0.00000 {?} {317.CA} 56.84900 0.32600 0.32600 EE 0.00000 {?} 0.38140 0.07280 0 {?} 0 1355 {317.HA} 4.66700 0.06200 0.07700 ? 0.00000 {?} {317.HB2} 2.23700 0.11600 0.13700 ++ 0.00000 {?} {317.CB} 43.20800 0.32300 0.32300 EE 0.00000 {?} 3.95800 0.10020 0 {?} 0 1356 {318.HB2} 1.65400 0.02400 0.07000 ? 0.00000 {?} {318.HA} 4.84800 0.05500 0.11500 ? 0.00000 {?} {318.CA} 55.01300 0.45900 0.45900 EE 0.00000 {?} 1.15000 0.08470 0 {?} 0 1357 {318.HB1} 1.87300 0.06300 0.08800 ? 0.00000 {?} {318.HA} 4.85800 0.08100 0.10300 ++ 0.00000 {?} {318.CA} 55.01300 0.30800 0.30800 EE 0.00000 {?} 1.46340 0.04590 0 {?} 0 1358 {321.HB2} 2.24600 0.06100 0.06800 ++ 0.00000 {?} {321.HA} 4.73900 0.09200 0.11000 ++ 0.00000 {?} {321.CA} 52.65200 0.31300 0.31300 EE 0.00000 {?} 1.92770 0.08130 0 {?} 0 1359 {321.HB1} 2.69700 0.05200 0.07700 ++ 0.00000 {?} {321.HA} 4.74100 0.09100 0.12100 ? 0.00000 {?} {321.CA} 52.65200 0.36400 0.36400 EE 0.00000 {?} 3.77820 0.12230 0 {?} 0 1360 {321.HA} 4.74600 0.04200 0.06700 ++ 0.00000 {?} {321.HB1} 2.67900 0.11400 0.17500 ? 0.00000 {?} {321.CB} 43.20800 0.41300 0.41300 EE 0.00000 {?} 5.54910 0.16320 0 {?} 0 1361 {362.HD21} 0.53800 0.04200 0.05900 ? 0.00000 {?} {322.HA} 4.12900 0.05800 0.13900 ? 0.00000 {?} {322.CA} 61.24700 0.38900 0.38900 EE 0.00000 {?} 2.08480 0.13230 0 {?} 0 1362 {322.HG12} 0.61300 0.05600 0.06900 ? 0.00000 {?} {322.HA} 4.12900 0.09700 0.13600 ++ 0.00000 {?} {322.CA} 61.24700 0.36900 0.36900 EE 0.00000 {?} 3.81370 0.12400 0 {?} 0 1363 {322.HD11} 0.72300 0.05300 0.06700 ? 0.00000 {?} {322.HA} 4.13200 0.09500 0.13300 ? 0.00000 {?} {322.CA} 61.24700 0.36900 0.36900 EE 0.00000 {?} 4.79410 0.15450 0 {?} 0 1364 {363.HG11} 0.78900 0.01600 0.04700 ? 0.00000 {?} {322.HA} 4.12900 0.05500 0.10500 ? 0.00000 {?} {322.CA} 61.24700 0.37300 0.37300 EE 0.00000 {?} 0.55200 0.06310 0 {?} 0 1365 {322.HG11} 1.31100 0.05400 0.06500 ++ 0.00000 {?} {322.HA} 4.13500 0.07400 0.09100 ++ 0.00000 {?} {322.CA} 61.24700 0.32000 0.32000 EE 0.00000 {?} 3.62720 0.17250 0 {?} 0 1366 {322.HB} 1.41700 0.07100 0.08600 ++ 0.00000 {?} {322.HA} 4.12900 0.07800 0.14400 ? 0.00000 {?} {322.CA} 61.24700 0.32900 0.32900 EE 0.00000 {?} 3.38520 0.09980 0 {?} 0 1367 {322.HG12} 0.61800 0.05700 0.08400 ? 0.00000 {?} {322.HB} 1.41300 0.10500 0.15600 ++ 0.00000 {?} {322.CB} 40.84700 0.41000 0.41000 EE 0.00000 {?} 7.82280 0.19260 0 {?} 0 1368 {362.HD21} 0.54500 0.05000 0.05900 ? 0.00000 {?} {322.HB} 1.41700 0.11700 0.14000 ++ 0.00000 {?} {322.CB} 40.84700 0.31200 0.31200 EE 0.00000 {?} 3.52980 0.10420 0 {?} 0 1369 {322.HB} 1.41800 0.03500 0.07100 ? 0.00000 {?} {322.HG12} 0.61600 0.09700 0.13400 ++ 0.00000 {?} {322.CG1} 27.20600 0.38600 0.38600 EE 0.00000 {?} 3.55370 0.17090 0 {?} 0 1370 {283.HE1} 1.91900 0.02600 0.07900 ? 0.00000 {?} {322.HD11} 0.71700 0.06800 0.11000 ++ 0.00000 {?} {322.CD1} 15.40100 0.41000 0.41000 EE 0.00000 {?} 3.29720 0.26030 0 {?} 0 1371 {322.HA} 4.08100 0.06100 0.07100 ++ 0.00000 {?} {322.HD11} 0.71700 0.09700 0.11800 ? 0.00000 {?} {322.CD1} 15.40100 0.34000 0.34000 EE 0.00000 {?} 11.51900 0.34610 0 {?} 0 1372 {322.HG11} 1.27900 0.04500 0.07400 ++ 0.00000 {?} {322.HB} 1.41900 0.10600 0.14000 ++ 0.00000 {?} {322.CB} 40.84700 0.41800 0.41800 EE 0.00000 {?} 9.84990 0.26720 0 {?} 0 1373 {363.HG11} 0.78000 0.04900 0.07000 ++ 0.00000 {?} {323.HB1} 2.85800 0.14900 0.19700 ? 0.00000 {?} {323.CB} 40.32300 0.36800 0.36800 EE 0.00000 {?} 3.49080 0.09080 0 {?} 0 1374 {363.HG11} 0.77800 0.05700 0.06600 ++ 0.00000 {?} {323.HB2} 2.11200 0.10900 0.13600 ++ 0.00000 {?} {323.CB} 40.32300 0.32300 0.32300 EE 0.00000 {?} 2.24530 0.07430 0 {?} 0 1375 {324.HD1} 7.30600 0.06500 0.06300 ++ 0.00000 {?} {324.HB1} 3.63700 0.13100 0.12500 ++ 0.00000 {?} {324.CB} 28.68000 0.24600 0.24600 EE 0.00000 {?} 1.27260 0.05320 0 {?} 0 1376 {324.HD1} 7.33000 0.07100 0.07000 ++ 0.00000 {?} {324.HB2} 3.06900 0.09900 0.09600 ++ 0.00000 {?} {324.CB} 28.68000 0.25400 0.25400 EE 0.00000 {?} 2.03930 0.10500 0 {?} 0 1377 {324.HA} 4.49300 0.04200 0.05400 ++ 0.00000 {?} {324.HB1} 3.63600 0.08400 0.12800 ? 0.00000 {?} {324.CB} 28.67800 0.33300 0.33300 EE 0.00000 {?} 2.68140 0.11030 0 {?} 0 1378 {324.HA} 4.49500 0.04200 0.07000 ? 0.00000 {?} {324.HB2} 3.04200 0.12900 0.14100 ++ 0.00000 {?} {324.CB} 28.67800 0.28700 0.28700 EE 0.00000 {?} 6.01040 0.13000 0 {?} 0 1379 {325.HA} 4.92800 0.02700 0.07200 ++ 0.00000 {?} {325.HB1} 2.95300 0.07900 0.19100 ? 0.00000 {?} {325.CB} 41.37200 0.47600 0.47600 EE 0.00000 {?} 11.49550 0.45120 0 {?} 0 1380 {326.HB1} 2.28200 0.06800 0.07200 ++ 0.00000 {?} {326.HA} 4.72000 0.11900 0.12600 ++ 0.00000 {?} {326.CA} 55.01300 0.28600 0.28600 EE 0.00000 {?} 2.30280 0.06210 0 {?} 0 1381 {326.HG1} 2.43500 0.05200 0.06500 ++ 0.00000 {?} {326.HA} 4.72100 0.10700 0.13600 ++ 0.00000 {?} {326.CA} 55.01300 0.33000 0.33000 EE 0.00000 {?} 2.05510 0.07050 0 {?} 0 1382 {326.HG2} 2.15000 0.03300 0.10900 ? 0.00000 {?} {326.HG1} 2.43100 0.05700 0.14900 ? 0.00000 {?} {326.CG} 35.86300 0.52100 0.52100 EE 0.00000 {?} 15.11650 0.47740 0 {?} 0 1383 {381.HB2} 1.42200 0.05700 0.08000 ++ 0.00000 {?} {381.HA} 5.08700 0.09900 0.14800 ++ 0.00000 {?} {381.CA} 53.17700 0.39900 0.39900 EE 0.00000 {?} 2.14620 0.04920 0 {?} 0 1384 {381.HB1} 1.97600 0.02700 0.04800 ? 0.00000 {?} {381.HA} 5.08700 0.08400 0.11600 ++ 0.00000 {?} {381.CA} 53.17700 0.39000 0.39000 EE 0.00000 {?} 1.01740 0.04750 0 {?} 0 1385 {381.HG2} 2.41900 0.05100 0.07200 ++ 0.00000 {?} {381.HA} 5.09100 0.09900 0.15000 ++ 0.00000 {?} {381.CA} 53.17700 0.38100 0.38100 EE 0.00000 {?} 1.83170 0.05650 0 {?} 0 1386 {381.HG1} 2.70900 0.05500 0.07400 ++ 0.00000 {?} {381.HA} 5.08700 0.10800 0.13600 ++ 0.00000 {?} {381.CA} 53.17700 0.34500 0.34500 EE 0.00000 {?} 1.51620 0.05390 0 {?} 0 1387 {327.HB2} 2.80400 0.07800 0.08600 ? 0.00000 {?} {327.HB1} 3.14100 0.09400 0.14900 ? 0.00000 {?} {327.CB} 39.01100 0.40900 0.40900 EE 0.00000 {?} 8.38770 0.15240 0 {?} 0 1388 {327.HB1} 3.14700 0.07800 0.13500 ++ 0.00000 {?} {327.HB2} 2.79800 0.10600 0.19300 ? 0.00000 {?} {327.CB} 39.01100 0.41200 0.41200 EE 0.00000 {?} 16.33220 0.21570 0 {?} 0 1389 {327.HA} 5.48200 0.05400 0.07800 ++ 0.00000 {?} {327.HB2} 2.79700 0.10200 0.15400 ++ 0.00000 {?} {327.CB} 39.01100 0.38400 0.38400 EE 0.00000 {?} 3.69100 0.12430 0 {?} 0 1390 {327.HA} 5.48400 0.05400 0.06300 ++ 0.00000 {?} {327.HB1} 3.14100 0.10100 0.12300 ++ 0.00000 {?} {327.CB} 39.01100 0.33000 0.33000 EE 0.00000 {?} 2.38870 0.08250 0 {?} 0 1391 {372.HG1} 2.07500 0.04400 0.08700 ? 0.00000 {?} {372.HA} 4.47400 0.07200 0.13700 ? 0.00000 {?} {372.CA} 63.67000 0.45200 0.45200 EE 0.00000 {?} 13.40580 0.36350 0 {?} 0 1392 {342.HB2} 3.15900 0.05300 0.07800 ++ 0.00000 {?} {342.HA} 4.57800 0.08400 0.12900 ++ 0.00000 {?} {342.CA} 63.93200 0.38600 0.38600 EE 0.00000 {?} 3.72640 0.12380 0 {?} 0 1393 {329.HG1} 1.68700 0.04500 0.09800 ? 0.00000 {?} {329.HA} 4.48200 0.08800 0.15800 ? 0.00000 {?} {329.CA} 57.11200 0.40600 0.40600 EE 0.00000 {?} 6.79230 0.23020 0 {?} 0 1394 {329.HD1} 1.87200 0.04100 0.07200 ++ 0.00000 {?} {329.HA} 4.48600 0.08400 0.15200 ? 0.00000 {?} {329.CA} 57.11200 0.41800 0.41800 EE 0.00000 {?} 6.57440 0.20890 0 {?} 0 1395 {357.HD11} 0.98200 0.05000 0.06300 ? 0.00000 {?} {329.HA} 4.48200 0.09600 0.12400 ++ 0.00000 {?} {329.CA} 57.11200 0.34500 0.34500 EE 0.00000 {?} 3.15060 0.12470 0 {?} 0 1396 {334.HA} 4.35900 0.04400 0.07600 ? 0.00000 {?} {335.HB1} 1.53000 0.07700 0.11000 ++ 0.00000 {?} {335.CB} 18.28700 0.38100 0.38100 EE 0.00000 {?} 2.18970 0.09590 0 {?} 0 1397 {338.HA} 4.35900 0.04500 0.12200 ++ 0.00000 {?} {338.HB1} 3.84300 0.10400 0.24400 ? 0.00000 {?} {338.CB} 64.19500 0.49800 0.49800 EE 0.00000 {?} 54.70330 1.00100 0 {?} 0 1398 {339.HG2} 1.94600 0.05700 0.08700 ++ 0.00000 {?} {339.HA} 5.00500 0.04600 0.12600 ? 0.00000 {?} {339.CA} 55.01300 0.39000 0.39000 EE 0.00000 {?} 2.02970 0.10930 0 {?} 0 1399 {339.HG1} 2.09500 0.05400 0.06600 ++ 0.00000 {?} {339.HA} 4.99000 0.10900 0.14000 ++ 0.00000 {?} {339.CA} 55.01300 0.33500 0.33500 EE 0.00000 {?} 2.10630 0.07310 0 {?} 0 1400 {331.HB} 3.81800 0.05100 0.08600 ++ 0.00000 {?} {339.HG2} 1.92600 0.09500 0.16400 ? 0.00000 {?} {339.CG} 36.91200 0.40700 0.40700 EE 0.00000 {?} 5.08840 0.14160 0 {?} 0 1401 {333.HE1} 2.96500 0.04800 0.05500 ++ 0.00000 {?} {339.HG1} 2.10100 0.09600 0.11800 ++ 0.00000 {?} {339.CG} 36.91200 0.31600 0.31600 EE 0.00000 {?} 1.88780 0.07940 0 {?} 0 1402 {333.HE1} 2.96300 0.04900 0.05600 ++ 0.00000 {?} {339.HG2} 1.92900 0.10300 0.12000 ++ 0.00000 {?} {339.CG} 36.91200 0.31700 0.31700 EE 0.00000 {?} 1.26560 0.05880 0 {?} 0 1403 {331.HG21} 0.96600 0.04400 0.06700 ++ 0.00000 {?} {339.HG1} 2.09600 0.07500 0.11900 ? 0.00000 {?} {339.CG} 36.91200 0.40700 0.40700 EE 0.00000 {?} 2.19970 0.07740 0 {?} 0 1404 {354.HG21} 0.81600 0.05700 0.05700 ? 0.00000 {?} {343.HA} 4.19800 0.09500 0.12000 ++ 0.00000 {?} {343.CA} 58.68600 0.36300 0.36300 EE 0.00000 {?} 3.15110 0.10290 0 {?} 0 1405 {269.HG11} 0.94500 0.05900 0.07400 ++ 0.00000 {?} {270.HA} 4.39300 0.08600 0.11800 ? 0.00000 {?} {270.CA} 58.94800 0.34300 0.34300 EE 0.00000 {?} 3.25440 0.11000 0 {?} 0 1406 {331.HG21} 0.96000 0.06400 0.08900 ++ 0.00000 {?} {340.HA} 4.51700 0.06400 0.12600 ? 0.00000 {?} {340.CA} 59.21000 0.37300 0.37300 EE 0.00000 {?} 2.02520 0.07210 0 {?} 0 1407 {377.HD1} 3.93900 0.03800 0.06100 ? 0.00000 {?} {377.HA} 4.55700 0.06900 0.08900 ? 0.00000 {?} {377.CA} 62.88300 0.37000 0.37000 EE 0.00000 {?} 1.99200 0.10670 0 {?} 0 1408 {342.HB2} 3.16500 0.07300 0.08800 ++ 0.00000 {?} {342.HB1} 3.65400 0.12200 0.15900 ++ 0.00000 {?} {342.CB} 38.22600 0.34700 0.34700 EE 0.00000 {?} 2.56330 0.05540 0 {?} 0 1409 {342.HB1} 3.65400 0.06000 0.06900 ++ 0.00000 {?} {342.HB2} 3.15700 0.10600 0.13000 ++ 0.00000 {?} {342.CB} 38.22600 0.32100 0.32100 EE 0.00000 {?} 2.13000 0.07090 0 {?} 0 1410 {342.HA} 4.56600 0.05500 0.07300 ++ 0.00000 {?} {342.HB1} 3.64800 0.09300 0.13800 ++ 0.00000 {?} {342.CB} 38.22600 0.37900 0.37900 EE 0.00000 {?} 2.71460 0.09170 0 {?} 0 1411 {377.HA} 4.55900 0.04400 0.05800 ++ 0.00000 {?} {377.HD1} 3.93500 0.06200 0.13700 ? 0.00000 {?} {377.CD} 50.81600 0.36600 0.36600 EE 0.00000 {?} 1.95880 0.12080 0 {?} 0 1412 {377.HA} 4.56200 0.02500 0.06000 ? 0.00000 {?} {377.HD2} 3.65700 0.06900 0.12900 ? 0.00000 {?} {377.CD} 50.81600 0.38100 0.38100 EE 0.00000 {?} 1.32020 0.11590 0 {?} 0 1413 {344.HG1} 2.33800 0.08300 0.10000 ++ 0.00000 {?} {344.HA} 4.17500 0.13100 0.15400 ++ 0.00000 {?} {344.CA} 58.94800 0.30300 0.30300 EE 0.00000 {?} 23.89950 0.39860 0 {?} 0 1414 {344.HG2} 2.25300 0.04300 0.07400 ? 0.00000 {?} {344.HA} 4.17700 0.05300 0.16000 ? 0.00000 {?} {344.CA} 58.95100 0.46500 0.46500 EE 0.00000 {?} 7.11880 0.30230 0 {?} 0 1415 {287.HB1} 2.83300 0.03400 0.07800 ? 0.00000 {?} {284.HA} 4.35700 0.07000 0.11300 ++ 0.00000 {?} {284.CA} 61.04700 0.39800 0.39800 EE 0.00000 {?} 3.07850 0.15740 0 {?} 0 1416 {287.HB2} 2.72600 0.06800 0.06800 ? 0.00000 {?} {284.HA} 4.35400 0.08400 0.12600 ++ 0.00000 {?} {284.CA} 61.04700 0.36500 0.36500 EE 0.00000 {?} 3.66200 0.11040 0 {?} 0 1417 {279.HG11} 0.79000 0.06200 0.08000 ++ 0.00000 {?} {282.HB1} 3.45400 0.09300 0.12500 ? 0.00000 {?} {282.CB} 39.27300 0.35600 0.35600 EE 0.00000 {?} 2.09750 0.06710 0 {?} 0 1418 {340.HG21} 0.83800 0.04800 0.05700 ++ 0.00000 {?} {345.HB2} 3.16800 0.15000 0.15000 ? 0.00000 {?} {345.CB} 39.27300 0.32900 0.32900 EE 0.00000 {?} 1.30550 0.03730 0 {?} 0 1419 {346.HB1} 3.07900 0.04300 0.07300 ++ 0.00000 {?} {346.HB2} 2.90800 0.04000 0.11300 ? 0.00000 {?} {346.CB} 37.17000 0.51700 0.51700 EE 0.00000 {?} 4.14010 0.17590 0 {?} 0 1420 {346.HD1} 7.22100 0.07500 0.07700 ++ 0.00000 {?} {346.HB1} 3.06900 0.06400 0.10700 ? 0.00000 {?} {346.CB} 37.17500 0.27200 0.27200 EE 0.00000 {?} 1.58180 0.05800 0 {?} 0 1421 {346.HA} 3.82200 0.06200 0.05900 ++ 0.00000 {?} {346.HB1} 3.07500 0.11700 0.11000 ++ 0.00000 {?} {346.CB} 37.17500 0.24900 0.24900 EE 0.00000 {?} 1.79080 0.07660 0 {?} 0 1422 {346.HA} 3.82600 0.05400 0.06400 ++ 0.00000 {?} {346.HB2} 2.92400 0.08100 0.09400 ++ 0.00000 {?} {346.CB} 37.17500 0.31000 0.31000 EE 0.00000 {?} 2.43710 0.08930 0 {?} 0 1423 {347.HD1} 3.24000 0.05400 0.08000 ++ 0.00000 {?} {347.HA} 4.17400 0.11600 0.17000 ++ 0.00000 {?} {347.CA} 59.73500 0.39300 0.39300 EE 0.00000 {?} 8.17620 0.22460 0 {?} 0 1424 {299.HA} 3.20400 0.03700 0.05500 ++ 0.00000 {?} {298.HA} 4.09800 0.03300 0.09400 ? 0.00000 {?} {298.CA} 58.94800 0.39900 0.39900 EE 0.00000 {?} 1.35300 0.15840 0 {?} 0 1425 {345.HE1} 6.61700 0.05100 0.06100 ++ 0.00000 {?} {349.HB1} 1.15900 0.08200 0.09600 ++ 0.00000 {?} {349.CB} 28.30600 0.31500 0.31500 EE 0.00000 {?} 1.68180 0.07050 0 {?} 0 1426 {350.HD1} 6.95400 0.06600 0.06100 ++ 0.00000 {?} {349.HB2} 0.68000 0.10400 0.09800 ++ 0.00000 {?} {349.CB} 28.30600 0.24900 0.24900 EE 0.00000 {?} 1.13840 0.05770 0 {?} 0 1427 {345.HE1} 6.62700 0.05300 0.05300 ++ 0.00000 {?} {349.HB2} 0.69300 0.07600 0.07600 ++ 0.00000 {?} {349.CB} 28.30600 0.13300 0.13300 EE 0.00000 {?} 0.99280 0.04130 0 {?} 0 1428 {350.HD1} 6.93300 0.07100 0.06200 ++ 0.00000 {?} {349.HB1} 1.15700 0.07200 0.07200 ++ 0.00000 {?} {349.CB} 28.30600 0.19600 0.19600 EE 0.00000 {?} 0.91350 0.04290 0 {?} 0 1429 {345.HE1} 6.61400 0.05000 0.06300 ++ 0.00000 {?} {349.HG1} 1.66000 0.09600 0.11800 ++ 0.00000 {?} {349.CG} 32.19000 0.33900 0.33900 EE 0.00000 {?} 1.51740 0.05900 0 {?} 0 1430 {350.HE1} 6.79500 0.03600 0.08300 ? 0.00000 {?} {349.HG1} 1.66000 0.08000 0.11800 ++ 0.00000 {?} {349.CG} 32.19000 0.36800 0.36800 EE 0.00000 {?} 1.30880 0.07300 0 {?} 0 1431 {345.HE1} 6.61500 0.05700 0.07500 ++ 0.00000 {?} {349.HG2} 1.02600 0.08700 0.11000 ++ 0.00000 {?} {349.CG} 32.19000 0.32700 0.32700 EE 0.00000 {?} 1.80010 0.06620 0 {?} 0 1432 {350.HE1} 6.79500 0.05700 0.09000 ++ 0.00000 {?} {349.HG2} 1.00100 0.09400 0.12100 ++ 0.00000 {?} {349.CG} 32.19000 0.36200 0.36200 EE 0.00000 {?} 2.07380 0.06510 0 {?} 0 1433 {350.HD1} 6.95900 0.05500 0.05500 ++ 0.00000 {?} {349.HG2} 1.01000 0.13400 0.10200 ++ 0.00000 {?} {349.CG} 32.19000 0.18800 0.18800 EE 0.00000 {?} 0.97530 0.04120 0 {?} 0 1434 {350.HD1} 6.92300 0.05100 0.05100 ++ 0.00000 {?} {349.HG1} 1.67700 0.05000 0.05000 ++ 0.00000 {?} {349.CG} 32.19000 0.10100 0.10100 EE 0.00000 {?} 0.60880 0.03530 0 {?} 0 1435 {350.HB2} 2.49800 0.08500 0.10300 ++ 0.00000 {?} {350.HA} 5.05800 0.10500 0.14600 ? 0.00000 {?} {350.CA} 56.58700 0.34100 0.34100 EE 0.00000 {?} 4.73280 0.11410 0 {?} 0 1436 {350.HB1} 3.47200 0.06700 0.08200 ++ 0.00000 {?} {350.HB2} 2.48800 0.11000 0.14600 ++ 0.00000 {?} {350.CB} 41.11000 0.33800 0.33800 EE 0.00000 {?} 2.66930 0.06960 0 {?} 0 1437 {350.HB2} 2.50200 0.02900 0.08500 ? 0.00000 {?} {350.HB1} 3.47300 0.09800 0.14000 ++ 0.00000 {?} {350.CB} 41.11000 0.38600 0.38600 EE 0.00000 {?} 2.21830 0.10760 0 {?} 0 1438 {350.HA} 5.06400 0.10200 0.09100 ++ 0.00000 {?} {350.HB2} 2.49900 0.13100 0.13100 ++ 0.00000 {?} {350.CB} 41.11000 0.22600 0.22600 EE 0.00000 {?} 2.15590 0.06450 0 {?} 0 1439 {350.HD1} 6.92700 0.07700 0.08800 ++ 0.00000 {?} {350.HB1} 3.47700 0.10500 0.12500 ++ 0.00000 {?} {350.CB} 41.11000 0.31500 0.31500 EE 0.00000 {?} 2.88170 0.06140 0 {?} 0 1440 {350.HD1} 6.93800 0.05700 0.06500 ++ 0.00000 {?} {350.HB2} 2.50900 0.14200 0.16700 ++ 0.00000 {?} {350.CB} 41.11000 0.30300 0.30300 EE 0.00000 {?} 2.15630 0.04540 0 {?} 0 1441 {347.HA} 4.15700 0.05600 0.07400 ++ 0.00000 {?} {351.HA} 4.91500 0.09500 0.12600 ++ 0.00000 {?} {351.CA} 54.48800 0.36000 0.36000 EE 0.00000 {?} 1.71940 0.07450 0 {?} 0 1442 {351.HA} 4.92000 0.02100 0.07900 ? 0.00000 {?} {351.HB1} 3.25600 0.05300 0.13300 ? 0.00000 {?} {351.CB} 37.43700 0.49900 0.49900 EE 0.00000 {?} 11.40580 0.75000 0 {?} 0 1443 {351.HA} 4.91900 0.05000 0.07300 ? 0.00000 {?} {351.HB2} 2.79800 0.07100 0.13300 ++ 0.00000 {?} {351.CB} 37.43700 0.50100 0.50100 EE 0.00000 {?} 28.59200 0.76870 0 {?} 0 1444 {352.HG1} 2.37400 0.09000 0.10100 ++ 0.00000 {?} {352.HA} 4.55900 0.10700 0.11600 ++ 0.00000 {?} {352.CA} 53.43900 0.29400 0.29400 EE 0.00000 {?} 2.45890 0.06230 0 {?} 0 1445 {352.HB1} 2.08100 0.05200 0.12800 ? 0.00000 {?} {352.HB2} 1.76100 0.11100 0.17800 ? 0.00000 {?} {352.CB} 31.40600 0.43600 0.43600 EE 0.00000 {?} 20.87140 0.26680 0 {?} 0 1446 {352.HG2} 1.95000 0.04100 0.12600 ? 0.00000 {?} {352.HG1} 2.39300 0.10500 0.23000 ? 0.00000 {?} {352.CG} 33.50200 0.48800 0.48800 EE 0.00000 {?} 25.91220 0.44980 0 {?} 0 1447 {352.HB2} 1.69400 0.06100 0.09700 ? 0.00000 {?} {352.HG1} 2.38500 0.09300 0.14100 ? 0.00000 {?} {352.CG} 33.50200 0.39700 0.39700 EE 0.00000 {?} 5.17680 0.14070 0 {?} 0 1448 {352.HB1} 2.06200 0.04500 0.10100 ? 0.00000 {?} {352.HG1} 2.38900 0.08800 0.19400 ? 0.00000 {?} {352.CG} 33.50200 0.46100 0.46100 EE 0.00000 {?} 12.77300 0.26210 0 {?} 0 1449 {352.HA} 4.55200 0.05200 0.09200 ++ 0.00000 {?} {352.HG1} 2.37900 0.07800 0.15600 ? 0.00000 {?} {352.CG} 33.50200 0.39300 0.39300 EE 0.00000 {?} 3.53250 0.12970 0 {?} 0 1450 {353.HB2} 1.83000 0.04600 0.09800 ? 0.00000 {?} {353.HA} 4.40200 0.07800 0.20600 ? 0.00000 {?} {353.CA} 55.01300 0.49100 0.49100 EE 0.00000 {?} 39.37050 0.87250 0 {?} 0 1451 {353.HB1} 1.94100 0.04100 0.09200 ? 0.00000 {?} {353.HA} 4.39800 0.09300 0.22700 ? 0.00000 {?} {353.CA} 55.01300 0.47700 0.47700 EE 0.00000 {?} 26.98240 0.65020 0 {?} 0 1452 {353.HG1} 2.11900 0.01900 0.08400 ? 0.00000 {?} {353.HA} 4.40700 0.09200 0.19200 ? 0.00000 {?} {353.CA} 55.01300 0.48900 0.48900 EE 0.00000 {?} 14.45590 0.80300 0 {?} 0 1453 {355.HG21} 1.20000 0.04800 0.07600 ++ 0.00000 {?} {353.HB1} 1.93200 0.08400 0.15000 ? 0.00000 {?} {353.CB} 30.61700 0.40000 0.40000 EE 0.00000 {?} 2.95360 0.11470 0 {?} 0 1454 {355.HG21} 1.20200 0.05200 0.07400 ++ 0.00000 {?} {353.HB2} 1.80700 0.09400 0.13500 ? 0.00000 {?} {353.CB} 30.61700 0.37200 0.37200 EE 0.00000 {?} 3.82560 0.11970 0 {?} 0 1455 {353.HA} 4.39800 0.02000 0.08600 ? 0.00000 {?} {353.HB2} 1.82200 0.09600 0.15900 ? 0.00000 {?} {353.CB} 30.61700 0.51000 0.51000 EE 0.00000 {?} 58.11970 2.12360 0 {?} 0 1456 {354.HG12} 0.60600 0.06100 0.08500 ? 0.00000 {?} {354.HA} 3.77800 0.09000 0.13800 ++ 0.00000 {?} {354.CA} 61.57100 0.37700 0.37700 EE 0.00000 {?} 6.02190 0.20210 0 {?} 0 1457 {354.HD11} 0.92900 0.03800 0.09400 ? 0.00000 {?} {354.HA} 3.78100 0.10300 0.13300 ++ 0.00000 {?} {354.CA} 61.57100 0.34500 0.34500 EE 0.00000 {?} 5.17110 0.20650 0 {?} 0 1458 {355.HG21} 1.19900 0.08500 0.09100 ++ 0.00000 {?} {354.HA} 3.78100 0.10600 0.11300 ++ 0.00000 {?} {354.CA} 61.57100 0.28300 0.28300 EE 0.00000 {?} 3.12620 0.09780 0 {?} 0 1459 {354.HD11} 0.92300 0.03500 0.07000 ? 0.00000 {?} {354.HB} 1.67000 0.11800 0.15400 ++ 0.00000 {?} {354.CB} 39.53600 0.38000 0.38000 EE 0.00000 {?} 4.40620 0.21840 0 {?} 0 1460 {343.HD21} 0.98400 0.05400 0.05400 ? 0.00000 {?} {354.HB} 1.67500 0.12000 0.15000 ++ 0.00000 {?} {354.CB} 39.53600 0.36600 0.36600 EE 0.00000 {?} 5.39200 0.18410 0 {?} 0 1461 {357.HG} 1.79000 0.04500 0.09600 ? 0.00000 {?} {354.HG21} 0.81300 0.07700 0.11200 ++ 0.00000 {?} {354.CG2} 18.28700 0.38400 0.38400 EE 0.00000 {?} 5.91350 0.22990 0 {?} 0 1462 {384.HA} 3.80500 0.05300 0.06600 ++ 0.00000 {?} {279.HG11} 0.80200 0.08900 0.12500 ++ 0.00000 {?} {279.CG1} 24.66300 0.38500 0.38500 EE 0.00000 {?} 5.23750 0.20390 0 {?} 0 1463 {354.HG11} 1.70100 0.03800 0.06300 ++ 0.00000 {?} {354.HG12} 0.60200 0.06000 0.12500 ? 0.00000 {?} {354.CG1} 28.51800 0.44300 0.44300 EE 0.00000 {?} 4.89280 0.23460 0 {?} 0 1464 {356.HB2} 2.36500 0.03300 0.09000 ? 0.00000 {?} {356.HB1} 3.07400 0.09800 0.19300 ? 0.00000 {?} {356.CB} 42.42100 0.45500 0.45500 EE 0.00000 {?} 3.47410 0.10630 0 {?} 0 1465 {280.HD11} 0.95700 0.04900 0.07500 ++ 0.00000 {?} {356.HB2} 2.36600 0.10000 0.15300 ++ 0.00000 {?} {356.CB} 42.42100 0.40800 0.40800 EE 0.00000 {?} 5.55820 0.15660 0 {?} 0 1466 {280.HD11} 0.95300 0.06300 0.08400 ++ 0.00000 {?} {356.HB1} 3.04600 0.09800 0.16700 ++ 0.00000 {?} {356.CB} 42.42100 0.37900 0.37900 EE 0.00000 {?} 5.13170 0.15690 0 {?} 0 1467 {357.HG} 1.80100 0.05000 0.10600 ? 0.00000 {?} {357.HA} 4.28600 0.06300 0.16700 ? 0.00000 {?} {357.CA} 55.01300 0.49100 0.49100 EE 0.00000 {?} 14.75480 0.34580 0 {?} 0 1468 {357.HD11} 0.99500 0.05200 0.07400 ++ 0.00000 {?} {357.HA} 4.29000 0.09600 0.14500 ++ 0.00000 {?} {357.CA} 55.01300 0.37500 0.37500 EE 0.00000 {?} 4.71730 0.18370 0 {?} 0 1469 {357.HA} 4.28200 0.06500 0.08400 ++ 0.00000 {?} {357.HB1} 1.76600 0.17500 0.22200 ++ 0.00000 {?} {357.CB} 40.58500 0.37000 0.37000 EE 0.00000 {?} 8.00430 0.17010 0 {?} 0 1470 {?} 2.86800 0.08600 0.09400 ++ 0.00000 {?} {?} 0.80400 0.10400 0.11700 ++ 0.00000 {?} {?} 23.27100 0.29600 0.29600 EE 0.00000 {?} 3.67580 0.10500 0 {?} 0 1471 {329.HE1} 3.10400 0.05800 0.08600 ++ 0.00000 {?} {357.HD21} 0.80600 0.06800 0.10100 ++ 0.00000 {?} {357.CD2} 23.27100 0.40100 0.40100 EE 0.00000 {?} 5.56040 0.20040 0 {?} 0 1472 {328.HB1} 2.41600 0.06300 0.07600 ? 0.00000 {?} {357.HD21} 0.81200 0.05900 0.09100 ++ 0.00000 {?} {357.CD2} 23.27100 0.37800 0.37800 EE 0.00000 {?} 3.46110 0.14960 0 {?} 0 1473 {358.HG1} 1.49700 0.02700 0.05900 ? 0.00000 {?} {358.HB2} 1.94500 0.11200 0.11200 ? 0.00000 {?} {358.CB} 33.76400 0.47000 0.47000 EE 0.00000 {?} 16.12550 0.38130 0 {?} 0 1474 {326.HB1} 2.28700 0.02500 0.06800 ? 0.00000 {?} {361.HB} 1.45800 0.06800 0.08400 ? 0.00000 {?} {361.CB} 34.55100 0.32200 0.32200 EE 0.00000 {?} 0.89950 0.07460 0 {?} 0 1475 {323.HB2} 2.12500 0.03900 0.07900 ? 0.00000 {?} {361.HB} 1.45800 0.07700 0.10600 ? 0.00000 {?} {361.CB} 34.55100 0.37800 0.37800 EE 0.00000 {?} 1.97710 0.10010 0 {?} 0 1476 {362.HD11} 0.71700 0.06700 0.09000 ? 0.00000 {?} {362.HA} 4.46100 0.08300 0.15200 ? 0.00000 {?} {362.CA} 52.91400 0.39900 0.39900 EE 0.00000 {?} 8.13340 0.21370 0 {?} 0 1477 {362.HD21} 0.54500 0.06300 0.08800 ? 0.00000 {?} {362.HB1} 1.69900 0.10900 0.16000 ++ 0.00000 {?} {362.CB} 42.15900 0.36000 0.36000 EE 0.00000 {?} 3.44560 0.09130 0 {?} 0 1478 {362.HD21} 0.53200 0.04300 0.05600 ++ 0.00000 {?} {362.HB2} 1.17700 0.11200 0.16000 ++ 0.00000 {?} {362.CB} 42.15900 0.35200 0.35200 EE 0.00000 {?} 3.57330 0.14590 0 {?} 0 1479 {362.HD11} 0.71000 0.06600 0.10200 ? 0.00000 {?} {362.HB2} 1.18000 0.10000 0.17100 ? 0.00000 {?} {362.CB} 42.15900 0.40200 0.40200 EE 0.00000 {?} 8.50930 0.20620 0 {?} 0 1480 {362.HB1} 1.68400 0.05000 0.05900 ++ 0.00000 {?} {362.HB2} 1.18500 0.11600 0.13400 ++ 0.00000 {?} {362.CB} 42.15900 0.31500 0.31500 EE 0.00000 {?} 4.31350 0.12370 0 {?} 0 1481 {362.HA} 4.45900 0.08100 0.08700 ++ 0.00000 {?} {362.HB2} 1.18000 0.07900 0.15800 ? 0.00000 {?} {362.CB} 42.15900 0.28400 0.28400 EE 0.00000 {?} 2.57430 0.08590 0 {?} 0 1482 {362.HD21} 0.54100 0.06800 0.06800 ? 0.00000 {?} {384.HG1} 1.49000 0.11100 0.13300 ++ 0.00000 {?} {384.CG} 27.46900 0.31500 0.31500 EE 0.00000 {?} 2.92170 0.07880 0 {?} 0 1483 {322.HA} 4.17400 0.05700 0.05900 ++ 0.00000 {?} {362.HG} 1.40400 0.10700 0.10900 ++ 0.00000 {?} {362.CG} 26.41900 0.26900 0.26900 EE 0.00000 {?} 3.25020 0.09640 0 {?} 0 1484 {362.HA} 4.49000 0.08100 0.07600 ++ 0.00000 {?} {362.HG} 1.41900 0.10900 0.10900 ? 0.00000 {?} {362.CG} 26.41900 0.24200 0.24200 EE 0.00000 {?} 3.53830 0.09120 0 {?} 0 1485 {385.HG2} 2.39300 0.05300 0.07500 ? 0.00000 {?} {385.HA} 4.00300 0.10500 0.12700 ? 0.00000 {?} {385.CA} 58.16100 0.32900 0.32900 EE 0.00000 {?} 5.10670 0.15990 0 {?} 0 1486 {385.HG1} 2.51900 0.03800 0.07300 ? 0.00000 {?} {385.HA} 4.00700 0.05700 0.09400 ++ 0.00000 {?} {385.CA} 58.16100 0.35100 0.35100 EE 0.00000 {?} 2.34660 0.15460 0 {?} 0 1487 {385.HB1} 2.68000 0.04800 0.09200 ? 0.00000 {?} {385.HA} 3.99400 0.06500 0.09300 ++ 0.00000 {?} {385.CA} 58.16100 0.33900 0.33900 EE 0.00000 {?} 3.30440 0.15570 0 {?} 0 1488 {385.HA} 4.00100 0.05500 0.06900 ++ 0.00000 {?} {385.HB1} 2.68900 0.10800 0.13200 ++ 0.00000 {?} {385.CB} 32.19000 0.34600 0.34600 EE 0.00000 {?} 3.37510 0.10300 0 {?} 0 1489 {385.HA} 3.99800 0.07300 0.07100 ++ 0.00000 {?} {385.HB2} 1.64700 0.13100 0.12800 ++ 0.00000 {?} {385.CB} 32.19000 0.25800 0.25800 EE 0.00000 {?} 2.18710 0.09160 0 {?} 0 1490 {308.HG11} 0.63700 0.05100 0.05400 ++ 0.00000 {?} {387.HB1} 2.76100 0.11500 0.12400 ++ 0.00000 {?} {387.CB} 30.61700 0.28600 0.28600 EE 0.00000 {?} 2.40340 0.08430 0 {?} 0 1491 {308.HB} 1.98100 0.04100 0.06800 ? 0.00000 {?} {387.HB1} 2.76800 0.11000 0.12800 ++ 0.00000 {?} {387.CB} 30.61700 0.31500 0.31500 EE 0.00000 {?} 1.82850 0.07290 0 {?} 0 1492 {385.HG1} 2.52000 0.05100 0.08700 ? 0.00000 {?} {280.HD11} 0.95200 0.08100 0.12000 ++ 0.00000 {?} {280.CD1} 25.63900 0.40900 0.40900 EE 0.00000 {?} 6.00250 0.22310 0 {?} 0 1493 {386.HD11} 0.28100 0.03900 0.05000 ++ 0.00000 {?} {386.HA} 4.57400 0.09200 0.11600 ++ 0.00000 {?} {386.CA} 52.65200 0.34400 0.34400 EE 0.00000 {?} 2.46860 0.11970 0 {?} 0 1494 {386.HB2} 1.97200 0.06500 0.09700 ++ 0.00000 {?} {386.HA} 4.58400 0.05900 0.08400 ++ 0.00000 {?} {386.CA} 52.65200 0.37800 0.37800 EE 0.00000 {?} 4.54280 0.20280 0 {?} 0 1495 {386.HD11} 0.28000 0.04500 0.06100 ++ 0.00000 {?} {386.HB2} 1.97500 0.12100 0.17400 ++ 0.00000 {?} {386.CB} 42.42100 0.37500 0.37500 EE 0.00000 {?} 3.94340 0.13200 0 {?} 0 1496 {386.HD21} 0.83600 0.05200 0.07200 ++ 0.00000 {?} {386.HB2} 1.98600 0.13100 0.16000 ? 0.00000 {?} {386.CB} 42.42100 0.36800 0.36800 EE 0.00000 {?} 5.71180 0.13700 0 {?} 0 1497 {386.HG} 1.21900 0.05000 0.05400 ++ 0.00000 {?} {386.HB2} 1.97500 0.11600 0.12700 ++ 0.00000 {?} {386.CB} 42.42100 0.29400 0.29400 EE 0.00000 {?} 2.87450 0.08280 0 {?} 0 1498 {386.HB2} 1.97500 0.05400 0.06600 ? 0.00000 {?} {386.HG} 1.22000 0.09600 0.11600 ++ 0.00000 {?} {386.CG} 27.46900 0.32000 0.32000 EE 0.00000 {?} 3.99500 0.12970 0 {?} 0 1499 {386.HG} 1.21400 0.05000 0.09900 ++ 0.00000 {?} {386.HD21} 0.83900 0.08200 0.17300 ? 0.00000 {?} {386.CD2} 21.96000 0.49500 0.49500 EE 0.00000 {?} 58.28210 1.09100 0 {?} 0 1500 {387.HB1} 2.77400 0.05300 0.06600 ++ 0.00000 {?} {387.HA} 5.03500 0.08900 0.11800 ++ 0.00000 {?} {387.CA} 57.89900 0.35000 0.35000 EE 0.00000 {?} 1.19590 0.03970 0 {?} 0 1501 {387.HB2} 2.22300 0.07700 0.09300 ++ 0.00000 {?} {387.HA} 5.04300 0.10000 0.12900 ++ 0.00000 {?} {387.CA} 57.89900 0.33300 0.33300 EE 0.00000 {?} 2.01480 0.05320 0 {?} 0 1502 {387.HA} 5.04800 0.07500 0.09300 ++ 0.00000 {?} {387.HB2} 2.22700 0.10100 0.13900 ++ 0.00000 {?} {387.CB} 30.61700 0.38800 0.38800 EE 0.00000 {?} 5.01170 0.11340 0 {?} 0 1503 {388.HB2} 2.86500 0.07100 0.09000 ++ 0.00000 {?} {276.HA} 4.60100 0.07800 0.11600 ++ 0.00000 {?} {276.CA} 58.16100 0.33500 0.33500 EE 0.00000 {?} 2.79500 0.10110 0 {?} 0 1504 {388.HB2} 2.85000 0.05500 0.09600 ++ 0.00000 {?} {388.HB1} 3.09600 0.13000 0.15900 ? 0.00000 {?} {388.CB} 40.06000 0.43900 0.43900 EE 0.00000 {?} 17.24570 0.22860 0 {?} 0 1505 {388.HB1} 3.10800 0.06600 0.09900 ? 0.00000 {?} {388.HB2} 2.84600 0.15500 0.15500 ? 0.00000 {?} {388.CB} 40.06000 0.41500 0.41500 EE 0.00000 {?} 15.65290 0.18450 0 {?} 0 1506 {388.HD1} 7.15800 0.05900 0.08100 ++ 0.00000 {?} {388.HB1} 3.10800 0.07800 0.15200 ? 0.00000 {?} {388.CB} 40.06000 0.38700 0.38700 EE 0.00000 {?} 4.54440 0.13360 0 {?} 0 1507 {388.HD1} 7.15800 0.05700 0.09300 ++ 0.00000 {?} {388.HB2} 2.84300 0.11500 0.16300 ? 0.00000 {?} {388.CB} 40.06000 0.37800 0.37800 EE 0.00000 {?} 5.24830 0.12430 0 {?} 0 1508 {388.HD1} 7.16200 0.04000 0.04500 ++ 0.00000 {?} {388.HA} 4.83800 0.07300 0.08200 ++ 0.00000 {?} {388.CA} 57.63600 0.29900 0.29900 EE 0.00000 {?} 0.46840 0.03020 0 {?} 0 1509 {390.HG21} 1.21200 0.03600 0.10300 ++ 0.00000 {?} {390.HB} 4.26200 0.10100 0.23400 ? 0.00000 {?} {390.CB} 71.27700 0.50300 0.50300 EE 0.00000 {?} 42.40440 1.04260 0 {?} 0 1510 {390.HA} 4.61000 0.04100 0.10600 ? 0.00000 {?} {390.HB} 4.25300 0.08600 0.20200 ? 0.00000 {?} {390.CB} 71.27700 0.50100 0.50100 EE 0.00000 {?} 43.14790 1.08350 0 {?} 0 1511 {307.HG11} 0.80100 0.06700 0.06700 ? 0.00000 {?} {392.HA} 4.57400 0.08200 0.15500 ? 0.00000 {?} {392.CA} 54.75100 0.36600 0.36600 EE 0.00000 {?} 3.73600 0.12140 0 {?} 0 1512 {392.HB1} 1.70500 0.03500 0.08600 ? 0.00000 {?} {392.HD21} 0.89400 0.07000 0.12900 ? 0.00000 {?} {392.CD2} 23.27000 0.45500 0.45500 EE 0.00000 {?} 29.77100 1.07000 0 {?} 0 1513 {392.HD11} 0.92000 0.03300 0.08600 ? 0.00000 {?} {392.HG} 1.60500 0.09300 0.12300 ? 0.00000 {?} {392.CG} 27.20600 0.51500 0.51500 EE 0.00000 {?} 84.33760 2.32360 0 {?} 0 1514 {395.HG1} 1.47400 0.05100 0.06700 ++ 0.00000 {?} {393.HB} 4.22800 0.07700 0.10600 ++ 0.00000 {?} {393.CB} 70.75300 0.35300 0.35300 EE 0.00000 {?} 2.68660 0.12180 0 {?} 0 1515 {311.HB2} 1.70700 0.02200 0.08500 ? 0.00000 {?} {311.HE1} 2.58300 0.09200 0.13200 ++ 0.00000 {?} {311.CE} 41.37200 0.36000 0.36000 EE 0.00000 {?} 1.19760 0.08990 0 {?} 0 1516 {311.HB1} 1.80100 0.05400 0.07300 ++ 0.00000 {?} {311.HE1} 2.58800 0.08600 0.11300 ++ 0.00000 {?} {311.CE} 41.37200 0.34300 0.34300 EE 0.00000 {?} 1.62100 0.05340 0 {?} 0 1517 {273.HG11} 0.93500 0.06200 0.09200 ++ 0.00000 {?} {272.HA} 4.32700 0.10300 0.16300 ? 0.00000 {?} {272.CA} 56.32500 0.44100 0.44100 EE 0.00000 {?} 18.59350 0.28920 0 {?} 0 1518 {381.HG2} 2.41500 0.06100 0.08200 ++ 0.00000 {?} {381.HE1} 2.04300 0.05600 0.10900 ? 0.00000 {?} {381.CE} 18.12500 0.39300 0.39300 EE 0.00000 {?} 6.24140 0.25150 0 {?} 0 1519 {381.HB2} 1.41400 0.07300 0.11600 ++ 0.00000 {?} {381.HG1} 2.71100 0.09600 0.16800 ++ 0.00000 {?} {381.CG} 32.71500 0.41100 0.41100 EE 0.00000 {?} 4.17010 0.07320 0 {?} 0 1520 {381.HB2} 1.41800 0.05700 0.08300 ? 0.00000 {?} {381.HG2} 2.41800 0.07500 0.10000 ++ 0.00000 {?} {381.CG} 32.71500 0.37400 0.37400 EE 0.00000 {?} 1.22470 0.05130 0 {?} 0 1521 {363.HG11} 0.80900 0.06200 0.06200 ? 0.00000 {?} {365.HG1} 2.41100 0.10300 0.12700 ++ 0.00000 {?} {365.CG} 32.71500 0.32700 0.32700 EE 0.00000 {?} 3.46690 0.10150 0 {?} 0 1522 {363.HG21} 0.89600 0.02600 0.04100 ? 0.00000 {?} {365.HG1} 2.40600 0.09000 0.15700 ++ 0.00000 {?} {365.CG} 32.71500 0.40600 0.40600 EE 0.00000 {?} 1.99910 0.09950 0 {?} 0 1523 {376.HD21} 0.94700 0.01300 0.04700 ? 0.00000 {?} {366.HB1} 2.40600 0.06700 0.14100 ? 0.00000 {?} {366.CB} 32.71500 0.31600 0.31600 EE 0.00000 {?} 0.43180 0.07080 0 {?} 0 1524 {381.HA} 5.10600 0.04500 0.07200 ++ 0.00000 {?} {381.HG1} 2.71100 0.08600 0.11500 ++ 0.00000 {?} {381.CG} 32.71500 0.38300 0.38300 EE 0.00000 {?} 1.57120 0.06350 0 {?} 0 1525 {381.HA} 5.09800 0.04300 0.08100 ? 0.00000 {?} {381.HG2} 2.41800 0.08800 0.13200 ++ 0.00000 {?} {381.CG} 32.71500 0.40900 0.40900 EE 0.00000 {?} 1.63800 0.05780 0 {?} 0 1526 {365.HG1} 2.41500 0.05000 0.08400 ? 0.00000 {?} {363.HG11} 0.77500 0.08200 0.09300 ++ 0.00000 {?} {363.CG1} 20.12300 0.32100 0.32100 EE 0.00000 {?} 1.50550 0.06020 0 {?} 0 1527 {381.HA} 5.09300 0.05300 0.07000 ++ 0.00000 {?} {363.HG11} 0.76600 0.05900 0.09400 ++ 0.00000 {?} {363.CG1} 20.12300 0.39500 0.39500 EE 0.00000 {?} 2.25150 0.10490 0 {?} 0 1528 {?} 2.03700 0.03900 0.07800 ? 0.00000 {?} {?} 4.34800 0.07100 0.13800 ? 0.00000 {?} {?} 43.99500 0.31000 0.31000 EE 0.00000 {?} 1.31830 0.06450 0 {?} 0 1529 {377.HD2} 3.66400 0.04400 0.07000 ++ 0.00000 {?} {377.HB1} 2.34700 0.09400 0.14100 ++ 0.00000 {?} {377.CB} 32.45300 0.43500 0.43500 EE 0.00000 {?} 6.67370 0.16900 0 {?} 0 1530 {377.HD2} 3.67500 0.05300 0.07800 ++ 0.00000 {?} {377.HB2} 2.01000 0.06900 0.15400 ? 0.00000 {?} {377.CB} 32.45300 0.42900 0.42900 EE 0.00000 {?} 5.60140 0.20570 0 {?} 0 1531 {377.HB1} 2.33500 0.04500 0.09700 ++ 0.00000 {?} {377.HB2} 1.99900 0.09900 0.19400 ? 0.00000 {?} {377.CB} 32.45300 0.51100 0.51100 EE 0.00000 {?} 98.33330 1.62390 0 {?} 0 1532 {?} 4.55300 0.02100 0.06500 ? 0.00000 {?} {?} 3.69100 0.09400 0.12200 ++ 0.00000 {?} {?} 49.76600 0.36800 0.36800 EE 0.00000 {?} 1.62440 0.11530 0 {?} 0 1533 {377.HB1} 2.36200 0.04800 0.06700 ++ 0.00000 {?} {377.HD1} 3.92100 0.07700 0.13500 ? 0.00000 {?} {377.CD} 50.81600 0.37000 0.37000 EE 0.00000 {?} 2.27210 0.08340 0 {?} 0 1534 {377.HB1} 2.35200 0.05900 0.07500 ++ 0.00000 {?} {377.HD2} 3.65200 0.08200 0.13300 ? 0.00000 {?} {377.CD} 50.81600 0.37100 0.37100 EE 0.00000 {?} 2.69100 0.09350 0 {?} 0 1535 {366.HB1} 2.33500 0.04000 0.05800 ++ 0.00000 {?} {366.HD1} 3.84200 0.10100 0.12200 ? 0.00000 {?} {366.CD} 50.81600 0.37200 0.37200 EE 0.00000 {?} 3.22410 0.10410 0 {?} 0 1536 {334.HA} 4.38000 0.03900 0.08700 ? 0.00000 {?} {334.HD1} 1.65900 0.08000 0.13900 ? 0.00000 {?} {334.CD} 29.05000 0.47600 0.47600 EE 0.00000 {?} 12.30670 0.32010 0 {?} 0 1537 {399.HB1} 2.66800 0.04100 0.07500 ? 0.00000 {?} {399.HA} 4.41800 0.07200 0.11500 ++ 0.00000 {?} {399.CA} 55.80000 0.44200 0.44200 EE 0.00000 {?} 20.52760 0.64510 0 {?} 0 1538 {376.HB1} 1.63600 0.06100 0.06400 ++ 0.00000 {?} {375.HA} 4.36300 0.09800 0.10700 ++ 0.00000 {?} {375.CA} 61.57100 0.28300 0.28300 EE 0.00000 {?} 2.69570 0.09550 0 {?} 0 1539 {376.HG} 2.05000 0.05600 0.08400 ++ 0.00000 {?} {376.HB1} 1.63400 0.13400 0.17900 ++ 0.00000 {?} {376.CB} 42.15900 0.39900 0.39900 EE 0.00000 {?} 8.21860 0.17930 0 {?} 0 1540 {376.HD21} 0.95400 0.02300 0.07900 ? 0.00000 {?} {376.HG} 2.03700 0.10100 0.13900 ++ 0.00000 {?} {376.CG} 27.46900 0.39700 0.39700 EE 0.00000 {?} 1.61930 0.10920 0 {?} 0 1541 {373.HA2} 3.95400 0.04000 0.08600 ? 0.00000 {?} {373.HA1} 4.07600 0.07200 0.15900 ? 0.00000 {?} {373.CA} 44.25800 0.44000 0.44000 EE 0.00000 {?} 8.55190 0.25100 0 {?} 0 1542 {282.HA} 4.32400 0.04400 0.07600 ++ 0.00000 {?} {282.HB1} 3.45400 0.09700 0.14300 ? 0.00000 {?} {282.CB} 39.27300 0.38500 0.38500 EE 0.00000 {?} 5.59960 0.19520 0 {?} 0 1543 {389.HD11} 0.65100 0.05600 0.07500 ++ 0.00000 {?} {282.HB1} 3.45800 0.07500 0.13300 ? 0.00000 {?} {282.CB} 39.27300 0.36800 0.36800 EE 0.00000 {?} 3.74330 0.13770 0 {?} 0 1544 {389.HD11} 0.64800 0.05500 0.07500 ++ 0.00000 {?} {282.HB2} 3.31200 0.06300 0.11300 ? 0.00000 {?} {282.CB} 39.27300 0.39000 0.39000 EE 0.00000 {?} 3.83150 0.18000 0 {?} 0 1545 {282.HD1} 7.20000 0.06900 0.08000 ++ 0.00000 {?} {282.HB1} 3.46000 0.15900 0.18600 ? 0.00000 {?} {282.CB} 39.27300 0.30600 0.30600 EE 0.00000 {?} 12.17120 0.22860 0 {?} 0 1546 {357.HD21} 0.80500 0.05000 0.07400 ++ 0.00000 {?} {329.HG1} 1.67300 0.06800 0.11500 ? 0.00000 {?} {329.CG} 25.89500 0.38600 0.38600 EE 0.00000 {?} 4.03930 0.17950 0 {?} 0 1547 {357.HD21} 0.80800 0.03300 0.06300 ++ 0.00000 {?} {329.HG2} 1.55500 0.08000 0.12600 ? 0.00000 {?} {329.CG} 25.89500 0.41400 0.41400 EE 0.00000 {?} 4.45620 0.19540 0 {?} 0 1548 {357.HD11} 1.04000 0.02700 0.04600 ++ 0.00000 {?} {329.HG2} 1.55900 0.07100 0.11100 ? 0.00000 {?} {329.CG} 25.89500 0.46000 0.46000 EE 0.00000 {?} 5.35500 0.20050 0 {?} 0 1549 {357.HD11} 1.04100 0.04400 0.07100 ++ 0.00000 {?} {329.HG1} 1.68100 0.09000 0.14400 ? 0.00000 {?} {329.CG} 25.89500 0.44300 0.44300 EE 0.00000 {?} 8.05730 0.18170 0 {?} 0 1550 {329.HE1} 3.10700 0.04800 0.05900 ++ 0.00000 {?} {329.HG1} 1.69100 0.12300 0.16500 ? 0.00000 {?} {329.CG} 25.89500 0.34400 0.34400 EE 0.00000 {?} 3.48160 0.10810 0 {?} 0 1551 {329.HE1} 3.10700 0.03500 0.06600 ? 0.00000 {?} {329.HG2} 1.56200 0.13100 0.13100 ? 0.00000 {?} {329.CG} 25.89500 0.33600 0.33600 EE 0.00000 {?} 2.91960 0.11800 0 {?} 0 1552 {329.HG2} 1.55800 0.04100 0.07400 ? 0.00000 {?} {329.HB1} 2.09100 0.09800 0.16300 ? 0.00000 {?} {329.CB} 31.66600 0.45500 0.45500 EE 0.00000 {?} 13.34060 0.31300 0 {?} 0 1553 {329.HD1} 1.87700 0.04700 0.08900 ? 0.00000 {?} {329.HB1} 2.09700 0.12200 0.19200 ? 0.00000 {?} {329.CB} 31.66600 0.47500 0.47500 EE 0.00000 {?} 28.33250 0.39840 0 {?} 0 1554 {329.HE1} 3.10300 0.05500 0.06900 ++ 0.00000 {?} {329.HB1} 2.10600 0.10900 0.14000 ++ 0.00000 {?} {329.CB} 31.66600 0.33900 0.33900 EE 0.00000 {?} 4.46600 0.12000 0 {?} 0 1555 {329.HA} 4.48300 0.01800 0.07200 ? 0.00000 {?} {329.HB1} 2.09300 0.07000 0.13400 ? 0.00000 {?} {329.CB} 31.66600 0.49100 0.49100 EE 0.00000 {?} 6.78880 0.41590 0 {?} 0 1556 {284.HE1} 7.36600 0.03300 0.06300 ? 0.00000 {?} {284.HB1} 3.30300 0.05900 0.14400 ? 0.00000 {?} {284.CB} 38.74900 0.44300 0.44300 EE 0.00000 {?} 2.71920 0.12930 0 {?} 0 1557 {284.HD1} 7.31500 0.04500 0.09500 ? 0.00000 {?} {284.HA} 4.34900 0.08300 0.16200 ? 0.00000 {?} {284.CA} 61.04700 0.36800 0.36800 EE 0.00000 {?} 7.58190 0.35300 0 {?} 0 1558 {295.HD1} 7.20500 0.08200 0.08200 ? 0.00000 {?} {292.HA} 3.95600 0.10800 0.13100 ? 0.00000 {?} {292.CA} 59.90000 0.32900 0.32900 EE 0.00000 {?} 9.95430 0.23810 0 {?} 0 1559 {283.HA} 3.98200 0.03600 0.05800 ++ 0.00000 {?} {283.HG1} 2.58000 0.08700 0.13700 ? 0.00000 {?} {283.CG} 34.02700 0.38800 0.38800 EE 0.00000 {?} 2.43030 0.10260 0 {?} 0 1560 {283.HG1} 2.57100 0.02900 0.05500 ? 0.00000 {?} {283.HB1} 3.25100 0.10200 0.11600 ++ 0.00000 {?} {283.CB} 34.02700 0.29400 0.29400 EE 0.00000 {?} 1.73860 0.08760 0 {?} 0 1561 {303.HD11} 0.74200 0.05000 0.06100 ? 0.00000 {?} {283.HB1} 3.26400 0.10300 0.09700 ++ 0.00000 {?} {283.CB} 34.02700 0.23900 0.23900 EE 0.00000 {?} 1.14050 0.05050 0 {?} 0 1562 {318.HD2} 3.24300 0.05000 0.06300 ? 0.00000 {?} {394.HB1} 2.64300 0.10000 0.11600 ++ 0.00000 {?} {394.CB} 41.37200 0.34000 0.34000 EE 0.00000 {?} 7.22710 0.23640 0 {?} 0 1563 {318.HD1} 3.30400 0.05600 0.06800 ? 0.00000 {?} {394.HB1} 2.63600 0.10500 0.11300 ++ 0.00000 {?} {394.CB} 41.37200 0.30100 0.30100 EE 0.00000 {?} 5.56240 0.14840 0 {?} 0 1564 {383.HD11} 0.16100 0.07000 0.07700 ++ 0.00000 {?} {383.HB} 1.69500 0.12100 0.13100 ++ 0.00000 {?} {383.CB} 36.65000 0.28500 0.28500 EE 0.00000 {?} 4.38990 0.11670 0 {?} 0 1565 {386.HD11} 0.28500 0.04700 0.07700 ++ 0.00000 {?} {383.HB} 1.70400 0.09800 0.14600 ++ 0.00000 {?} {383.CB} 36.65000 0.39400 0.39400 EE 0.00000 {?} 4.39260 0.14210 0 {?} 0 1566 {383.HD11} 0.15500 0.06400 0.07900 ++ 0.00000 {?} {383.HA} 4.50500 0.10900 0.15200 ++ 0.00000 {?} {383.CA} 53.96400 0.34600 0.34600 EE 0.00000 {?} 3.32050 0.10210 0 {?} 0 1567 {296.HG2} 0.20700 0.07000 0.08900 ++ 0.00000 {?} {296.HB1} 1.48100 0.09500 0.12000 ++ 0.00000 {?} {296.CB} 26.68200 0.35300 0.35300 EE 0.00000 {?} 3.67080 0.11350 0 {?} 0 1568 {296.HG2} 0.19300 0.07200 0.07600 ++ 0.00000 {?} {296.HB2} 0.76200 0.08600 0.09100 ++ 0.00000 {?} {296.CB} 26.68200 0.28300 0.28300 EE 0.00000 {?} 2.27250 0.08480 0 {?} 0 1569 {383.HD11} 0.16300 0.08300 0.07200 ++ 0.00000 {?} {383.HG11} 1.22400 0.14000 0.14000 ++ 0.00000 {?} {383.CG1} 25.63200 0.20500 0.20500 EE 0.00000 {?} 3.27010 0.11900 0 {?} 0 1570 {383.HD11} 0.16200 0.03600 0.04500 ++ 0.00000 {?} {383.HG12} 0.85200 0.07500 0.09300 ? 0.00000 {?} {383.CG1} 25.63000 0.33800 0.33800 EE 0.00000 {?} 1.58500 0.09870 0 {?} 0 1571 {322.HG21} -0.51500 0.04900 0.08600 ++ 0.00000 {?} {322.HA} 4.12700 0.10900 0.18700 ++ 0.00000 {?} {322.CA} 61.24700 0.38700 0.38700 EE 0.00000 {?} 6.98900 0.20840 0 {?} 0 1572 {362.HA} 4.45200 0.03200 0.07700 ? 0.00000 {?} {362.HD11} 0.68600 0.09300 0.14100 ? 0.00000 {?} {362.CD1} 25.18000 0.42500 0.42500 EE 0.00000 {?} 7.02150 0.25580 0 {?} 0 1573 {382.HB2} 1.01500 0.04000 0.06100 ? 0.00000 {?} {382.HA} 4.60600 0.06700 0.10500 ? 0.00000 {?} {382.CA} 52.39000 0.38600 0.38600 EE 0.00000 {?} 3.16020 0.14960 0 {?} 0 1574 {382.HB2} 1.01000 0.03100 0.06700 ? 0.00000 {?} {382.HB1} 1.28500 0.13900 0.16900 ++ 0.00000 {?} {382.CB} 45.30700 0.33600 0.33600 EE 0.00000 {?} 3.96900 0.15470 0 {?} 0 1575 {382.HB2} 1.01900 0.05300 0.06300 ? 0.00000 {?} {382.HD21} 0.06300 0.08200 0.16400 ? 0.00000 {?} {382.CD2} 22.22200 0.42800 0.42800 EE 0.00000 {?} 13.18350 0.30690 0 {?} 0 1576 {382.HA} 4.60900 0.03000 0.07900 ? 0.00000 {?} {382.HG} 0.96900 0.09400 0.13900 ++ 0.00000 {?} {382.CG} 26.41900 0.41600 0.41600 EE 0.00000 {?} 3.22910 0.14490 0 {?} 0 1577 {366.HD1} 3.87900 0.02100 0.04500 ? 0.00000 {?} {365.HB1} 2.16200 0.05800 0.12000 ? 0.00000 {?} {365.CB} 28.78000 0.37600 0.37600 EE 0.00000 {?} 0.43590 0.05730 0 {?} 0 1578 {366.HD2} 3.79900 0.02600 0.06400 ? 0.00000 {?} {366.HB1} 2.35100 0.09400 0.13000 ++ 0.00000 {?} {366.CB} 32.41500 0.40400 0.40400 EE 0.00000 {?} 1.65070 0.08970 0 {?} 0 1579 {366.HD1} 3.87100 0.02900 0.05500 ? 0.00000 {?} {366.HB1} 2.36000 0.10000 0.14000 ++ 0.00000 {?} {366.CB} 32.41500 0.39500 0.39500 EE 0.00000 {?} 2.55740 0.11940 0 {?} 0 1580 {364.HA} 5.20900 0.06200 0.08300 ++ 0.00000 {?} {364.HB1} 3.65500 0.12300 0.16300 ? 0.00000 {?} {364.CB} 65.50600 0.37400 0.37400 EE 0.00000 {?} 5.01950 0.13590 0 {?} 0 1581 {364.HA} 5.20900 0.07200 0.10100 ++ 0.00000 {?} {364.HB2} 3.44500 0.06100 0.15900 ? 0.00000 {?} {364.CB} 65.50600 0.39100 0.39100 EE 0.00000 {?} 4.03390 0.15260 0 {?} 0 1582 {?} 3.95000 0.03900 0.05500 ++ 0.00000 {?} {?} 4.65800 0.06900 0.09900 ? 0.00000 {?} {?} 62.88300 0.35100 0.35100 EE 0.00000 {?} 1.15660 0.06040 0 {?} 0 1583 {?} 4.05100 0.06300 0.08700 ++ 0.00000 {?} {?} 4.66300 0.05000 0.11300 ? 0.00000 {?} {?} 62.88300 0.39200 0.39200 EE 0.00000 {?} 2.64230 0.10400 0 {?} 0 1584 {267.HA} 4.36900 0.03800 0.09100 ? 0.00000 {?} {267.HG21} 1.22400 0.07000 0.17300 ? 0.00000 {?} {267.CG2} 21.17300 0.49400 0.49400 EE 0.00000 {?} 36.05070 0.99520 0 {?} 0 1585 {331.HA} 4.96800 0.04700 0.08300 ++ 0.00000 {?} {331.HB} 3.82000 0.06800 0.13800 ? 0.00000 {?} {331.CB} 71.80200 0.45100 0.45100 EE 0.00000 {?} 5.45350 0.13140 0 {?} 0 1586 {331.HG21} 0.97000 0.09200 0.08700 ++ 0.00000 {?} {330.HA} 4.52400 0.09400 0.08900 ++ 0.00000 {?} {330.CA} 60.78400 0.24300 0.24300 EE 0.00000 {?} 0.97030 0.04480 0 {?} 0 1587 {376.HD21} 0.93700 0.04400 0.05800 ? 0.00000 {?} {377.HA} 4.55000 0.07000 0.13000 ? 0.00000 {?} {377.CA} 62.88300 0.29200 0.29200 EE 0.00000 {?} 1.71600 0.08350 0 {?} 0 1588 {331.HG21} 1.00100 0.07000 0.06900 ++ 0.00000 {?} {330.HB1} 4.49100 0.10300 0.09600 ++ 0.00000 {?} {330.CB} 63.14500 0.24300 0.24300 EE 0.00000 {?} 0.96720 0.04840 0 {?} 0 1589 {345.HE1} 6.61200 0.04700 0.06600 ? 0.00000 {?} {334.HE1} 2.89600 0.11200 0.15200 ++ 0.00000 {?} {334.CE} 41.37200 0.37500 0.37500 EE 0.00000 {?} 2.56770 0.08190 0 {?} 0 1590 {287.HA} 3.93800 0.05500 0.07300 ++ 0.00000 {?} {287.HB1} 2.81200 0.05600 0.10000 ? 0.00000 {?} {287.CB} 38.22400 0.36400 0.36400 EE 0.00000 {?} 3.42000 0.18280 0 {?} 0 1591 {287.HA} 3.93800 0.05700 0.07900 ++ 0.00000 {?} {287.HB2} 2.71900 0.11200 0.11200 ? 0.00000 {?} {287.CB} 38.22400 0.36900 0.36900 EE 0.00000 {?} 6.14570 0.17720 0 {?} 0 1592 {287.HD1} 6.05200 0.07500 0.07500 ++ 0.00000 {?} {287.HB2} 2.72200 0.08500 0.08500 ? 0.00000 {?} {287.CB} 38.22400 0.21100 0.21100 EE 0.00000 {?} 4.27770 0.13310 0 {?} 0 1593 {287.HE1} 6.58100 0.04400 0.04400 ++ 0.00000 {?} {287.HB2} 2.72000 0.07500 0.07500 ++ 0.00000 {?} {287.CB} 38.22400 0.10700 0.10700 EE 0.00000 {?} 0.80210 0.05130 0 {?} 0 1594 {287.HB2} 2.72300 0.08800 0.08800 ? 0.00000 {?} {287.HA} 3.93000 0.08800 0.12100 ++ 0.00000 {?} {287.CA} 60.52200 0.36300 0.36300 EE 0.00000 {?} 6.43230 0.18960 0 {?} 0 1595 {287.HB1} 2.82700 0.04000 0.06500 ? 0.00000 {?} {287.HA} 3.92600 0.04500 0.12900 ? 0.00000 {?} {287.CA} 60.52200 0.36500 0.36500 EE 0.00000 {?} 2.62090 0.18220 0 {?} 0 1596 {287.HD1} 6.04900 0.06500 0.09300 ? 0.00000 {?} {287.HA} 3.92600 0.12800 0.15700 ++ 0.00000 {?} {287.CA} 60.52200 0.32200 0.32200 EE 0.00000 {?} 5.85580 0.14910 0 {?} 0 1597 {287.HE1} 6.58300 0.08000 0.06800 ++ 0.00000 {?} {292.HA} 3.95100 0.17200 0.14300 ++ 0.00000 {?} {292.CA} 59.90000 0.21000 0.21000 EE 0.00000 {?} 2.94660 0.12360 0 {?} 0 1598 {388.HE1} 6.83700 0.03600 0.05500 ++ 0.00000 {?} {311.HD2} 1.26700 0.10500 0.14500 ++ 0.00000 {?} {311.CD} 29.83000 0.40600 0.40600 EE 0.00000 {?} 1.63630 0.06230 0 {?} 0 1599 {388.HE1} 6.84700 0.04500 0.05300 ++ 0.00000 {?} {311.HD1} 1.48700 0.09300 0.11000 ++ 0.00000 {?} {311.CD} 29.83000 0.32200 0.32200 EE 0.00000 {?} 1.01550 0.04600 0 {?} 0 1600 {388.HE1} 6.83900 0.04900 0.05800 ++ 0.00000 {?} {309.HG} 1.37500 0.04700 0.10200 ? 0.00000 {?} {309.CG} 27.46900 0.34300 0.34300 EE 0.00000 {?} 0.62790 0.03720 0 {?} 0 1601 {388.HE1} 6.83700 0.04400 0.06200 ++ 0.00000 {?} {311.HG1} 1.22100 0.06600 0.15300 ? 0.00000 {?} {311.CG} 26.15700 0.38000 0.38000 EE 0.00000 {?} 1.67890 0.07960 0 {?} 0 1602 {388.HD1} 7.14000 0.04900 0.05600 ++ 0.00000 {?} {311.HG1} 1.23000 0.09300 0.10400 ++ 0.00000 {?} {311.CG} 26.15700 0.31100 0.31100 EE 0.00000 {?} 1.65530 0.05630 0 {?} 0 1603 {388.HE1} 6.83900 0.02300 0.05700 ? 0.00000 {?} {309.HD11} 0.78500 0.07000 0.11300 ++ 0.00000 {?} {309.CD1} 26.15700 0.43700 0.43700 EE 0.00000 {?} 1.78550 0.13180 0 {?} 0 1604 {282.HZ} 7.32800 0.01700 0.05600 ? 0.00000 {?} {303.HD11} 0.76200 0.04700 0.09000 ? 0.00000 {?} {303.CD1} 26.15700 0.44200 0.44200 EE 0.00000 {?} 1.59100 0.15600 0 {?} 0 1605 {284.HE1} 7.37600 0.02300 0.06900 ? 0.00000 {?} {280.HD11} 0.95800 0.04000 0.09300 ? 0.00000 {?} {280.CD1} 25.63500 0.43100 0.43100 EE 0.00000 {?} 1.07250 0.10380 0 {?} 0 1606 {317.HE1} 6.92300 0.03300 0.06100 ++ 0.00000 {?} {315.HG1} 1.33800 0.05700 0.10900 ? 0.00000 {?} {315.CG} 25.63200 0.41900 0.41900 EE 0.00000 {?} 1.00970 0.05710 0 {?} 0 1607 {293.HD2} 7.18600 0.04600 0.06400 ++ 0.00000 {?} {294.HG1} 1.15400 0.10100 0.14600 ++ 0.00000 {?} {294.CG} 24.84500 0.39000 0.39000 EE 0.00000 {?} 3.13050 0.12710 0 {?} 0 1608 {?} 7.17300 0.05600 0.07200 ++ 0.00000 {?} {?} 1.26900 0.06000 0.07100 ++ 0.00000 {?} {?} 23.27100 0.32400 0.32400 EE 0.00000 {?} 0.80140 0.04390 0 {?} 0 1609 {299.HG11} 0.68600 0.05600 0.06100 ? 0.00000 {?} {296.HA} 3.03100 0.07800 0.11300 ++ 0.00000 {?} {296.CA} 59.21000 0.35800 0.35800 EE 0.00000 {?} 1.94520 0.06780 0 {?} 0 1610 {283.HB1} 3.24600 0.04800 0.07200 ++ 0.00000 {?} {303.HD11} 0.75700 0.07000 0.11000 ++ 0.00000 {?} {303.CD1} 26.15700 0.43100 0.43100 EE 0.00000 {?} 6.52740 0.24930 0 {?} 0 1611 {283.HB2} 2.45400 0.06300 0.09100 ++ 0.00000 {?} {303.HD11} 0.74800 0.07400 0.13300 ++ 0.00000 {?} {303.CD1} 26.15700 0.41900 0.41900 EE 0.00000 {?} 6.49580 0.19340 0 {?} 0 1612 {360.HD2} 3.28800 0.03200 0.05700 ? 0.00000 {?} {359.HA} 4.55300 0.06400 0.10300 ++ 0.00000 {?} {359.CA} 53.70100 0.42000 0.42000 EE 0.00000 {?} 1.12880 0.06190 0 {?} 0 1613 {280.HD11} 0.94700 0.02200 0.08100 ? 0.00000 {?} {359.HA} 4.54100 0.09500 0.13900 ? 0.00000 {?} {359.CA} 53.96400 0.41800 0.41800 EE 0.00000 {?} 1.94930 0.10890 0 {?} 0 1614 {359.HB1} 2.22600 0.05800 0.09300 ? 0.00000 {?} {359.HA} 4.53900 0.05000 0.10700 ? 0.00000 {?} {359.CA} 53.70100 0.43500 0.43500 EE 0.00000 {?} 2.93750 0.10360 0 {?} 0 1615 {359.HB2} 1.84700 0.05700 0.07700 ? 0.00000 {?} {359.HA} 4.54200 0.06700 0.09900 ++ 0.00000 {?} {359.CA} 53.70100 0.41300 0.41300 EE 0.00000 {?} 2.65830 0.09060 0 {?} 0 1616 {397.HD1} 3.22500 0.03700 0.05900 ++ 0.00000 {?} {376.HG} 2.08800 0.06800 0.10900 ++ 0.00000 {?} {376.CG} 27.46900 0.40800 0.40800 EE 0.00000 {?} 5.12220 0.26270 0 {?} 0 1617 {361.HG21} 0.23200 0.04500 0.05300 ++ 0.00000 {?} {326.HB1} 2.28000 0.07900 0.10500 ++ 0.00000 {?} {326.CB} 35.07600 0.33100 0.33100 EE 0.00000 {?} 0.84040 0.03610 0 {?} 0 1618 {307.HA} 4.90200 0.05400 0.08100 ? 0.00000 {?} {307.HG21} 0.80000 0.05700 0.13300 ++ 0.00000 {?} {307.CG2} 21.43500 0.51200 0.51200 EE 0.00000 {?} 33.81270 0.97930 0 {?} 0 1619 {304.HG21} 0.94700 0.03500 0.07600 ? 0.00000 {?} {320.HA} 5.03300 0.06700 0.16400 ? 0.00000 {?} {320.CA} 55.80000 0.45900 0.45900 EE 0.00000 {?} 3.42710 0.13080 0 {?} 0 1620 {308.HG21} 0.81500 0.01500 0.05700 ? 0.00000 {?} {387.HA} 5.03800 0.06100 0.09500 ++ 0.00000 {?} {387.CA} 57.89900 0.40900 0.40900 EE 0.00000 {?} 0.42610 0.04410 0 {?} 0 1621 {296.HB2} 0.75100 0.05100 0.07000 ++ 0.00000 {?} {293.HA} 4.49500 0.06200 0.09500 ++ 0.00000 {?} {293.CA} 58.16100 0.39200 0.39200 EE 0.00000 {?} 1.19300 0.05670 0 {?} 0 1622 {307.HB} 1.80300 0.04000 0.05100 ++ 0.00000 {?} {307.HA} 4.91700 0.07500 0.10800 ++ 0.00000 {?} {307.CA} 61.30900 0.38700 0.38700 EE 0.00000 {?} 0.73400 0.03340 0 {?} 0 1623 {385.HG2} 2.42100 0.06000 0.09600 ? 0.00000 {?} {280.HA} 4.13200 0.07700 0.15600 ? 0.00000 {?} {280.CA} 57.89900 0.43700 0.43700 EE 0.00000 {?} 6.72550 0.14060 0 {?} 0 1624 {385.HG1} 2.57500 0.03800 0.07300 ? 0.00000 {?} {280.HA} 4.13000 0.06000 0.15900 ? 0.00000 {?} {280.CA} 57.89900 0.41000 0.41000 EE 0.00000 {?} 1.84680 0.09630 0 {?} 0 1625 {274.HB1} 1.65500 0.01700 0.06600 ? 0.00000 {?} {274.HA} 4.42200 0.06800 0.17800 ? 0.00000 {?} {274.CA} 55.01300 0.51300 0.51300 EE 0.00000 {?} 16.80060 1.12940 0 {?} 0 1626 {389.HA} 4.42200 0.04700 0.10100 ++ 0.00000 {?} {389.HB1} 1.68500 0.07500 0.13500 ? 0.00000 {?} {389.CB} 41.89700 0.49400 0.49400 EE 0.00000 {?} 28.83360 0.65050 0 {?} 0 1627 {389.HA} 4.42200 0.06100 0.13200 ++ 0.00000 {?} {389.HB2} 1.60300 0.06500 0.11800 ? 0.00000 {?} {389.CB} 41.89700 0.49400 0.49400 EE 0.00000 {?} 41.46030 0.83400 0 {?} 0 1628 {389.HB1} 1.71500 0.03700 0.08500 ? 0.00000 {?} {389.HD11} 0.66000 0.06900 0.14200 ? 0.00000 {?} {389.CD1} 25.63200 0.50100 0.50100 EE 0.00000 {?} 24.68320 0.68430 0 {?} 0 1629 {383.HG21} 0.72100 0.05900 0.08000 ++ 0.00000 {?} {383.HA} 4.52100 0.05300 0.13200 ? 0.00000 {?} {383.CA} 53.96400 0.37200 0.37200 EE 0.00000 {?} 2.34150 0.11110 0 {?} 0 1630 {397.HG1} 1.69800 0.01500 0.04500 ? 0.00000 {?} {374.HA2} 3.98300 0.06100 0.07200 ? 0.00000 {?} {374.CA} 45.30700 0.32900 0.32900 EE 0.00000 {?} 0.67330 0.07750 0 {?} 0 1631 {397.HA} 4.35800 0.04100 0.07900 ? 0.00000 {?} {374.HA1} 4.06400 0.04300 0.10800 ? 0.00000 {?} {374.CA} 45.30700 0.40900 0.40900 EE 0.00000 {?} 5.85250 0.28240 0 {?} 0 1632 {397.HA} 4.35900 0.05200 0.08100 ? 0.00000 {?} {374.HA2} 4.01400 0.06600 0.10400 ? 0.00000 {?} {374.CA} 45.30700 0.42600 0.42600 EE 0.00000 {?} 9.71540 0.31450 0 {?} 0 1633 {334.HD1} 1.64200 0.05200 0.10500 ? 0.00000 {?} {334.HA} 4.37900 0.10900 0.18300 ? 0.00000 {?} {334.CA} 55.80000 0.51900 0.51900 EE 0.00000 {?} 157.19310 2.28730 0 {?} 0 1634 {271.HD2} 7.19700 0.04700 0.05900 ++ 0.00000 {?} {271.HB1} 3.28000 0.08600 0.11700 ? 0.00000 {?} {271.CB} 29.56700 0.36000 0.36000 EE 0.00000 {?} 2.81720 0.15140 0 {?} 0 1635 {271.HD2} 7.19800 0.04300 0.05900 ++ 0.00000 {?} {271.HB2} 3.13800 0.08200 0.11600 ? 0.00000 {?} {271.CB} 29.56700 0.38700 0.38700 EE 0.00000 {?} 3.49900 0.17230 0 {?} 0 1636 {288.HB1} 3.29600 0.03200 0.09800 ? 0.00000 {?} {288.HB2} 3.07100 0.08600 0.14800 ? 0.00000 {?} {288.CB} 29.04300 0.50400 0.50400 EE 0.00000 {?} 42.84140 1.22160 0 {?} 0 1637 {288.HD2} 7.13100 0.04700 0.04600 ++ 0.00000 {?} {288.HB2} 3.05500 0.09200 0.09200 ++ 0.00000 {?} {288.CB} 29.04300 0.26000 0.26000 EE 0.00000 {?} 2.11190 0.12860 0 {?} 0 1638 {288.HD2} 7.13400 0.04400 0.05400 ++ 0.00000 {?} {288.HB1} 3.29500 0.07400 0.10000 ? 0.00000 {?} {288.CB} 29.04300 0.32800 0.32800 EE 0.00000 {?} 1.62380 0.08390 0 {?} 0 1639 {293.HD2} 7.18800 0.06000 0.08200 ++ 0.00000 {?} {293.HB1} 3.33900 0.08100 0.14300 ? 0.00000 {?} {293.CB} 28.78000 0.36700 0.36700 EE 0.00000 {?} 3.39640 0.12910 0 {?} 0 1640 {293.HD2} 7.18400 0.06000 0.06700 ++ 0.00000 {?} {293.HB2} 3.21400 0.10200 0.10200 ? 0.00000 {?} {293.CB} 28.78000 0.30200 0.30200 EE 0.00000 {?} 3.29050 0.10670 0 {?} 0 1641 {288.HD2} 7.13700 0.06200 0.07500 ++ 0.00000 {?} {288.HA} 4.44500 0.09700 0.12300 ++ 0.00000 {?} {288.CA} 56.58700 0.34300 0.34300 EE 0.00000 {?} 2.44720 0.09060 0 {?} 0 1642 {395.HA} 4.32100 0.02000 0.07100 ? 0.00000 {?} {395.HB2} 1.75800 0.05600 0.11500 ? 0.00000 {?} {395.CB} 32.97700 0.51600 0.51600 EE 0.00000 {?} 36.52710 2.28740 0 {?} 0 1643 {358.HE1} 3.05200 0.03800 0.05000 ++ 0.00000 {?} {358.HB2} 1.99400 0.07100 0.09500 ? 0.00000 {?} {358.CB} 33.76400 0.36400 0.36400 EE 0.00000 {?} 1.46470 0.07180 0 {?} 0 1644 {358.HB1} 2.04500 0.06500 0.07600 ++ 0.00000 {?} {358.HG2} 1.47700 0.09100 0.17000 ? 0.00000 {?} {358.CG} 25.10800 0.32800 0.32800 EE 0.00000 {?} 32.35740 0.81210 0 {?} 0 1645 {348.HA} 4.05300 0.01900 0.08700 ? 0.00000 {?} {348.HB1} 1.90500 0.06400 0.10500 ? 0.00000 {?} {348.CB} 32.97700 0.49700 0.49700 EE 0.00000 {?} 10.84350 0.56540 0 {?} 0 1646 {315.HE1} 2.96400 0.04300 0.06600 ++ 0.00000 {?} {315.HA} 4.52400 0.06500 0.14000 ++ 0.00000 {?} {315.CA} 55.27500 0.42700 0.42700 EE 0.00000 {?} 1.51120 0.07500 0 {?} 0 1647 {315.HE1} 2.97100 0.01900 0.08100 ? 0.00000 {?} {315.HG1} 1.32900 0.11800 0.18700 ? 0.00000 {?} {315.CG} 25.63200 0.48900 0.48900 EE 0.00000 {?} 9.53100 0.38850 0 {?} 0 1648 {315.HE1} 2.97400 0.03300 0.06800 ++ 0.00000 {?} {315.HG2} 1.15100 0.08000 0.18000 ? 0.00000 {?} {315.CG} 25.63200 0.47900 0.47900 EE 0.00000 {?} 10.24750 0.32260 0 {?} 0 1649 {315.HE1} 2.97600 0.05700 0.06700 ++ 0.00000 {?} {315.HD1} 1.65500 0.13500 0.16200 ++ 0.00000 {?} {315.CD} 28.78000 0.32800 0.32800 EE 0.00000 {?} 187.71010 4.55270 0 {?} 0 1650 {315.HD1} 1.64800 0.02400 0.07600 ? 0.00000 {?} {315.HG1} 1.33000 0.09400 0.14500 ? 0.00000 {?} {315.CG} 25.63200 0.51100 0.51100 EE 0.00000 {?} 31.32540 0.94740 0 {?} 0 1651 {315.HD1} 1.64600 0.02200 0.08700 ? 0.00000 {?} {315.HG2} 1.14300 0.07900 0.16700 ? 0.00000 {?} {315.CG} 25.63200 0.51800 0.51800 EE 0.00000 {?} 15.05110 0.61880 0 {?} 0 1652 {311.HG1} 1.25300 0.03400 0.07400 ? 0.00000 {?} {311.HB1} 1.82500 0.05700 0.09000 ? 0.00000 {?} {311.CB} 33.24000 0.48500 0.48500 EE 0.00000 {?} 3.96440 0.16520 0 {?} 0 1653 {311.HA} 4.07500 0.02900 0.06300 ++ 0.00000 {?} {311.HB2} 1.72600 0.06500 0.10300 ? 0.00000 {?} {311.CB} 33.24000 0.49000 0.49000 EE 0.00000 {?} 4.65220 0.18330 0 {?} 0 1654 {311.HB2} 1.72700 0.04700 0.07000 ? 0.00000 {?} {311.HD2} 1.27200 0.08900 0.14900 ++ 0.00000 {?} {311.CD} 29.83000 0.42600 0.42600 EE 0.00000 {?} 5.31910 0.14030 0 {?} 0 1655 {302.HB1} 2.19800 0.04700 0.05300 ++ 0.00000 {?} {303.HD11} 0.74800 0.06300 0.07800 ++ 0.00000 {?} {303.CD1} 26.15700 0.31200 0.31200 EE 0.00000 {?} 1.87400 0.10260 0 {?} 0 1656 {318.HB1} 1.88000 0.05400 0.08500 ++ 0.00000 {?} {318.HG1} 1.36100 0.08400 0.12300 ? 0.00000 {?} {318.CG} 27.73100 0.38100 0.38100 EE 0.00000 {?} 3.67830 0.12120 0 {?} 0 1657 {318.HD2} 3.21400 0.04100 0.05700 ? 0.00000 {?} {318.HG1} 1.36200 0.09100 0.14700 ? 0.00000 {?} {318.CG} 27.73100 0.41000 0.41000 EE 0.00000 {?} 4.77010 0.14310 0 {?} 0 1658 {318.HD1} 3.30500 0.04100 0.06100 ? 0.00000 {?} {318.HG1} 1.36400 0.09800 0.14000 ? 0.00000 {?} {318.CG} 27.73100 0.40800 0.40800 EE 0.00000 {?} 5.21760 0.16060 0 {?} 0 1659 {318.HD1} 3.30000 0.04500 0.06400 ? 0.00000 {?} {318.HB2} 1.63600 0.09400 0.11300 ++ 0.00000 {?} {318.CB} 31.40300 0.33100 0.33100 EE 0.00000 {?} 2.19800 0.09050 0 {?} 0 1660 {326.HG2} 2.13900 0.04300 0.05500 ? 0.00000 {?} {326.HB2} 1.58700 0.04900 0.09800 ? 0.00000 {?} {326.CB} 35.04000 0.35700 0.35700 EE 0.00000 {?} 1.00050 0.07320 0 {?} 0 1661 {326.HB1} 2.28500 0.03100 0.06800 ? 0.00000 {?} {326.HB2} 1.59700 0.07300 0.13900 ? 0.00000 {?} {326.CB} 35.04000 0.39300 0.39300 EE 0.00000 {?} 1.74060 0.08920 0 {?} 0 1662 {326.HG1} 2.43500 0.04700 0.06900 ++ 0.00000 {?} {326.HB2} 1.60200 0.08900 0.13600 ? 0.00000 {?} {326.CB} 35.04000 0.37900 0.37900 EE 0.00000 {?} 1.83770 0.07670 0 {?} 0 1663 {326.HB2} 1.59600 0.05100 0.07400 ++ 0.00000 {?} {326.HB1} 2.28400 0.07900 0.11800 ++ 0.00000 {?} {326.CB} 35.04000 0.37600 0.37600 EE 0.00000 {?} 2.84120 0.10260 0 {?} 0 1664 {326.HB2} 1.61000 0.03500 0.08100 ? 0.00000 {?} {326.HG1} 2.43800 0.06100 0.12600 ? 0.00000 {?} {326.CG} 35.86300 0.44400 0.44400 EE 0.00000 {?} 2.74850 0.14710 0 {?} 0 1665 {326.HB2} 1.61000 0.06100 0.10100 ? 0.00000 {?} {326.HG2} 2.14000 0.08200 0.14300 ? 0.00000 {?} {326.CG} 35.86300 0.45000 0.45000 EE 0.00000 {?} 4.51580 0.09010 0 {?} 0 1666 {338.HB1} 3.86400 0.03400 0.13300 ? 0.00000 {?} {338.HA} 4.38600 0.08100 0.21600 ? 0.00000 {?} {338.CA} 58.94800 0.51600 0.51600 EE 0.00000 {?} 47.29550 1.49960 0 {?} 0 1667 {354.HA} 3.78300 0.04800 0.06200 ? 0.00000 {?} {354.HG11} 1.71400 0.07800 0.10300 ? 0.00000 {?} {354.CG1} 28.58000 0.38700 0.38700 EE 0.00000 {?} 3.00400 0.12800 0 {?} 0 1668 {354.HD11} 0.92100 0.07300 0.08400 ? 0.00000 {?} {354.HG12} 0.59800 0.10300 0.11400 ++ 0.00000 {?} {354.CG1} 28.58000 0.31500 0.31500 EE 0.00000 {?} 3.50080 0.12430 0 {?} 0 1669 {383.HD11} 0.16000 0.07500 0.09700 ? 0.00000 {?} {354.HD11} 0.92700 0.09000 0.15900 ++ 0.00000 {?} {354.CD1} 15.13900 0.41700 0.41700 EE 0.00000 {?} 10.81480 0.24010 0 {?} 0 1670 {304.HG12} 0.78700 0.05900 0.07200 ? 0.00000 {?} {304.HB} 1.88000 0.06200 0.12100 ? 0.00000 {?} {304.CB} 36.65000 0.45900 0.45900 EE 0.00000 {?} 3.89830 0.10700 0 {?} 0 1671 {322.HD11} 0.73400 0.06700 0.06700 ? 0.00000 {?} {304.HB} 1.85100 0.09000 0.13000 ++ 0.00000 {?} {304.CB} 36.65000 0.42900 0.42900 EE 0.00000 {?} 5.03720 0.10580 0 {?} 0 1672 {306.HA} 4.40200 0.03700 0.07100 ? 0.00000 {?} {306.HG} 1.81200 0.08500 0.13500 ? 0.00000 {?} {306.CG} 26.68200 0.41300 0.41300 EE 0.00000 {?} 4.54390 0.14120 0 {?} 0 1673 {306.HD21} 0.80400 0.02500 0.08800 ? 0.00000 {?} {306.HG} 1.82100 0.09600 0.16300 ? 0.00000 {?} {306.CG} 26.68200 0.51300 0.51300 EE 0.00000 {?} 39.80470 1.20270 0 {?} 0 1674 {306.HD11} 0.61800 0.03100 0.06700 ? 0.00000 {?} {306.HG} 1.82900 0.07500 0.11100 ? 0.00000 {?} {306.CG} 26.68200 0.46900 0.46900 EE 0.00000 {?} 6.10120 0.17900 0 {?} 0 1675 {306.HB2} 1.36700 0.03800 0.07600 ++ 0.00000 {?} {306.HG} 1.83400 0.08800 0.14700 ? 0.00000 {?} {306.CG} 26.68200 0.45400 0.45400 EE 0.00000 {?} 6.49210 0.18750 0 {?} 0 1676 {348.HE1} 2.99500 0.03900 0.03900 ? 0.00000 {?} {348.HA} 4.05600 0.10400 0.13400 ++ 0.00000 {?} {348.CA} 58.68600 0.40100 0.40100 EE 0.00000 {?} 2.37600 0.10250 0 {?} 0 1677 {394.HB1} 2.62700 0.01900 0.06700 ? 0.00000 {?} {307.HG21} 0.79900 0.07500 0.12900 ++ 0.00000 {?} {307.CG2} 21.17300 0.42300 0.42300 EE 0.00000 {?} 2.70560 0.20510 0 {?} 0 1678 {387.HB1} 2.77200 0.04500 0.07100 ? 0.00000 {?} {308.HG21} 0.75500 0.08000 0.13000 ++ 0.00000 {?} {308.CG2} 18.02500 0.43200 0.43200 EE 0.00000 {?} 4.67240 0.15880 0 {?} 0 1679 {316.HB} 3.90200 0.01800 0.07200 ? 0.00000 {?} {392.HD11} 0.93300 0.07300 0.10600 ++ 0.00000 {?} {392.CD1} 25.10800 0.42900 0.42900 EE 0.00000 {?} 1.24250 0.08690 0 {?} 0 1680 {384.HG1} 1.46900 0.06100 0.07000 ++ 0.00000 {?} {384.HA} 3.80300 0.12900 0.14600 ++ 0.00000 {?} {384.CA} 67.65000 0.31100 0.31100 EE 0.00000 {?} 2.56980 0.07190 0 {?} 0 1681 {384.HB1} 2.42400 0.04700 0.08700 ? 0.00000 {?} {384.HB2} 1.95800 0.05500 0.15200 ? 0.00000 {?} {384.CB} 31.41000 0.38100 0.38100 EE 0.00000 {?} 3.79260 0.19490 0 {?} 0 1682 {384.HA} 3.80600 0.05200 0.06000 ++ 0.00000 {?} {384.HB2} 1.95200 0.09400 0.11400 ++ 0.00000 {?} {384.CB} 31.44100 0.31500 0.31500 EE 0.00000 {?} 2.55130 0.10390 0 {?} 0 1683 {384.HA} 3.80300 0.05000 0.05500 ++ 0.00000 {?} {384.HB1} 2.42000 0.10100 0.11400 ++ 0.00000 {?} {384.CB} 31.40300 0.29800 0.29800 EE 0.00000 {?} 2.34270 0.09020 0 {?} 0 1684 {279.HG21} 0.96700 0.03900 0.06100 ++ 0.00000 {?} {384.HB1} 2.43800 0.10200 0.16400 ? 0.00000 {?} {384.CB} 31.40300 0.41100 0.41100 EE 0.00000 {?} 7.71530 0.20820 0 {?} 0 1685 {333.HG1} 1.37900 0.03100 0.06700 ? 0.00000 {?} {339.HB1} 1.78400 0.10200 0.14300 ? 0.00000 {?} {339.CB} 32.45300 0.45000 0.45000 EE 0.00000 {?} 10.31540 0.23170 0 {?} 0 1686 {334.HE2} 2.87900 0.04600 0.04600 ? 0.00000 {?} {334.HB1} 1.97800 0.04100 0.07400 ? 0.00000 {?} {334.CB} 33.61200 0.36900 0.36900 EE 0.00000 {?} 1.43100 0.10730 0 {?} 0 1687 {334.HE2} 2.87600 0.04200 0.05400 ? 0.00000 {?} {334.HB2} 1.88600 0.06200 0.07800 ? 0.00000 {?} {334.CB} 33.61200 0.34800 0.34800 EE 0.00000 {?} 1.47410 0.08440 0 {?} 0 1688 {334.HE1} 2.87800 0.05100 0.05100 ? 0.00000 {?} {334.HD1} 1.64000 0.09300 0.19400 ? 0.00000 {?} {334.CD} 29.05000 0.49400 0.49400 EE 0.00000 {?} 15.89870 0.32150 0 {?} 0 1689 {334.HE2} 2.87000 0.05400 0.07700 ? 0.00000 {?} {334.HA} 4.38200 0.08000 0.10500 ++ 0.00000 {?} {334.CA} 55.80000 0.39600 0.39600 EE 0.00000 {?} 1.44150 0.06540 0 {?} 0 1690 {334.HB2} 1.87800 0.04800 0.08900 ? 0.00000 {?} {334.HE2} 2.88100 0.06000 0.13100 ? 0.00000 {?} {334.CE} 41.37200 0.49100 0.49100 EE 0.00000 {?} 6.61410 0.18420 0 {?} 0 1691 {334.HG1} 1.25200 0.03400 0.06300 ? 0.00000 {?} {334.HE2} 2.88400 0.05900 0.13100 ? 0.00000 {?} {334.CE} 41.37200 0.49100 0.49100 EE 0.00000 {?} 2.72330 0.12940 0 {?} 0 1692 {333.HE1} 2.95300 0.03000 0.04000 ++ 0.00000 {?} {333.HB1} 1.68300 0.07500 0.11000 ++ 0.00000 {?} {333.CB} 33.68200 0.38400 0.38400 EE 0.00000 {?} 1.87210 0.11600 0 {?} 0 1693 {337.HA2} 3.58400 0.06700 0.09200 ++ 0.00000 {?} {333.HG1} 1.36400 0.08400 0.14100 ++ 0.00000 {?} {333.CG} 25.10800 0.36200 0.36200 EE 0.00000 {?} 2.63790 0.08940 0 {?} 0 1694 {337.HA2} 3.58600 0.07200 0.10800 ++ 0.00000 {?} {333.HD1} 1.61600 0.05800 0.13100 ++ 0.00000 {?} {333.CD} 29.30500 0.41000 0.41000 EE 0.00000 {?} 4.40200 0.15580 0 {?} 0 1695 {340.HG21} 0.81600 0.06500 0.10200 ++ 0.00000 {?} {334.HE1} 2.89200 0.10700 0.14000 ? 0.00000 {?} {334.CE} 41.37200 0.44600 0.44600 EE 0.00000 {?} 6.17820 0.07860 0 {?} 0 1696 {271.HD2} 7.19900 0.04100 0.05500 ++ 0.00000 {?} {271.HA} 4.70700 0.06300 0.11000 ++ 0.00000 {?} {271.CA} 55.80000 0.39100 0.39100 EE 0.00000 {?} 0.86560 0.05980 0 {?} 0 1697 {324.HE3} 7.94700 0.05100 0.07600 ++ 0.00000 {?} {324.HA} 4.49400 0.10000 0.14600 ++ 0.00000 {?} {324.CA} 58.16100 0.39000 0.39000 EE 0.00000 {?} 4.16730 0.12720 0 {?} 0 1698 {293.HD2} 7.18800 0.04000 0.05500 ++ 0.00000 {?} {293.HA} 4.49500 0.05600 0.14600 ? 0.00000 {?} {293.CA} 58.16100 0.36400 0.36400 EE 0.00000 {?} 0.98850 0.07480 0 {?} 0 1699 {273.HG11} 0.93800 0.04400 0.07700 ? 0.00000 {?} {272.HD1} 1.72400 0.08300 0.16600 ? 0.00000 {?} {272.CD} 29.04300 0.47700 0.47700 EE 0.00000 {?} 15.20040 0.35310 0 {?} 0 1700 {286.HD1} 7.17200 0.07700 0.10200 ? 0.00000 {?} {286.HA} 4.16400 0.05400 0.12100 ? 0.00000 {?} {286.CA} 60.26000 0.43200 0.43200 EE 0.00000 {?} 7.54930 0.25190 0 {?} 0 1701 {299.HG11} 0.67400 0.06600 0.09000 ++ 0.00000 {?} {286.HB1} 3.18400 0.12400 0.12400 ? 0.00000 {?} {286.CB} 39.53600 0.37900 0.37900 EE 0.00000 {?} 4.53960 0.11960 0 {?} 0 1702 {299.HG11} 0.67600 0.06900 0.09300 ? 0.00000 {?} {286.HB2} 2.93200 0.08100 0.12100 ++ 0.00000 {?} {286.CB} 39.53600 0.36400 0.36400 EE 0.00000 {?} 3.92750 0.14400 0 {?} 0 1703 {286.HD1} 7.17800 0.05300 0.08500 ? 0.00000 {?} {286.HB1} 3.17300 0.07100 0.11200 ? 0.00000 {?} {286.CB} 39.53600 0.39900 0.39900 EE 0.00000 {?} 7.62920 0.23690 0 {?} 0 1704 {268.HA} 4.70200 0.02200 0.05700 ? 0.00000 {?} {268.HB2} 2.64800 0.06000 0.11200 ? 0.00000 {?} {268.CB} 41.11000 0.49900 0.49900 EE 0.00000 {?} 14.14760 0.85770 0 {?} 0 1705 {295.HE1} 7.56500 0.09200 0.07700 ++ 0.00000 {?} {286.HB1} 3.17500 0.12600 0.12600 ++ 0.00000 {?} {286.CB} 39.53600 0.17600 0.17600 EE 0.00000 {?} 3.29790 0.10640 0 {?} 0 1706 {295.HE1} 7.56400 0.09300 0.09300 ++ 0.00000 {?} {286.HB2} 2.92400 0.15600 0.15600 ? 0.00000 {?} {286.CB} 39.53600 0.16900 0.16900 EE 0.00000 {?} 5.80940 0.10960 0 {?} 0 1707 {342.HD1} 7.43000 0.05400 0.06800 ? 0.00000 {?} {342.HB2} 3.16300 0.14600 0.14400 ++ 0.00000 {?} {342.CB} 38.22600 0.25700 0.25700 EE 0.00000 {?} 1.66070 0.05870 0 {?} 0 1708 {342.HD1} 7.44000 0.07100 0.07100 ++ 0.00000 {?} {342.HB1} 3.64900 0.12800 0.12800 ++ 0.00000 {?} {342.CB} 38.22600 0.14900 0.14900 EE 0.00000 {?} 1.91440 0.05550 0 {?} 0 1709 {342.HZ} 7.21200 0.06100 0.06600 ++ 0.00000 {?} {342.HA} 4.58100 0.07000 0.07900 ++ 0.00000 {?} {342.CA} 63.93200 0.30200 0.30200 EE 0.00000 {?} 0.89130 0.03530 0 {?} 0 1710 {342.HD1} 7.43800 0.06600 0.09000 ++ 0.00000 {?} {342.HA} 4.57800 0.11000 0.13700 ++ 0.00000 {?} {342.CA} 63.93200 0.34200 0.34200 EE 0.00000 {?} 3.97760 0.10850 0 {?} 0 1711 {389.HB2} 1.58400 0.05400 0.05400 ? 0.00000 {?} {390.HA} 4.60100 0.07800 0.12700 ++ 0.00000 {?} {390.CA} 61.57100 0.37500 0.37500 EE 0.00000 {?} 1.55800 0.07220 0 {?} 0 1712 {291.HG1} 2.33500 0.06100 0.07300 ++ 0.00000 {?} {294.HG1} 1.15700 0.10500 0.12600 ++ 0.00000 {?} {294.CG} 24.84500 0.34100 0.34100 EE 0.00000 {?} 4.40990 0.13820 0 {?} 0 1713 {291.HB1} 2.15300 0.07200 0.09200 ++ 0.00000 {?} {294.HG1} 1.15100 0.08500 0.12300 ? 0.00000 {?} {294.CG} 24.84500 0.34400 0.34400 EE 0.00000 {?} 5.70730 0.16990 0 {?} 0 1714 {294.HE1} 2.96000 0.03700 0.05200 ++ 0.00000 {?} {294.HA} 4.44200 0.04300 0.13000 ? 0.00000 {?} {294.CA} 56.32500 0.34300 0.34300 EE 0.00000 {?} 0.71820 0.05790 0 {?} 0 1715 {295.HD1} 7.20800 0.04300 0.09600 ? 0.00000 {?} {295.HB2} 2.98800 0.10900 0.15200 ? 0.00000 {?} {295.CB} 39.27300 0.39900 0.39900 EE 0.00000 {?} 7.93080 0.21420 0 {?} 0 1716 {295.HE1} 7.56900 0.04900 0.10300 ? 0.00000 {?} {299.HG11} 0.67800 0.09200 0.14200 ++ 0.00000 {?} {299.CG1} 24.15800 0.40300 0.40300 EE 0.00000 {?} 8.83300 0.33290 0 {?} 0 1717 {317.HE1} 6.91300 0.02300 0.07300 ? 0.00000 {?} {308.HG21} 0.75300 0.09900 0.13600 ++ 0.00000 {?} {308.CG2} 18.02500 0.38300 0.38300 EE 0.00000 {?} 1.67530 0.11360 0 {?} 0 1718 {372.HB2} 2.00100 0.05400 0.08100 ? 0.00000 {?} {372.HD1} 3.67500 0.12500 0.17500 ++ 0.00000 {?} {372.CD} 49.76600 0.37000 0.37000 EE 0.00000 {?} 24.48920 0.63590 0 {?} 0 1719 {?} 1.78300 0.05100 0.07700 ? 0.00000 {?} {?} 3.68200 0.11700 0.16400 ++ 0.00000 {?} {?} 49.76600 0.37000 0.37000 EE 0.00000 {?} 2.95080 0.08570 0 {?} 0 1720 {318.HG1} 1.39500 0.06000 0.11000 ? 0.00000 {?} {318.HB1} 1.85900 0.06800 0.12800 ? 0.00000 {?} {318.CB} 31.40300 0.42200 0.42200 EE 0.00000 {?} 4.53370 0.13580 0 {?} 0 1721 {?} 1.44900 0.06500 0.08400 ? 0.00000 {?} {?} 3.22400 0.07400 0.13100 ++ 0.00000 {?} {?} 43.47100 0.42300 0.42300 EE 0.00000 {?} 3.73160 0.08190 0 {?} 0 1722 {375.HG21} 1.23300 0.06700 0.06700 ? 0.00000 {?} {397.HD1} 3.22100 0.06700 0.11400 ++ 0.00000 {?} {397.CD} 43.47100 0.40100 0.40100 EE 0.00000 {?} 4.36990 0.14510 0 {?} 0 1723 {342.HD1} 7.43700 0.05400 0.07000 ? 0.00000 {?} {328.HA} 4.55000 0.10600 0.13600 ++ 0.00000 {?} {328.CA} 66.03100 0.35300 0.35300 EE 0.00000 {?} 3.49780 0.10070 0 {?} 0 1724 {333.HD1} 1.65000 0.07300 0.07500 ++ 0.00000 {?} {337.HA2} 3.57100 0.13000 0.13700 ++ 0.00000 {?} {337.CA} 45.04500 0.28200 0.28200 EE 0.00000 {?} 3.32510 0.08210 0 {?} 0 1725 {294.HA} 4.44800 0.03600 0.07000 ? 0.00000 {?} {297.HB1} 2.08400 0.09100 0.15800 ? 0.00000 {?} {297.CB} 29.74700 0.41500 0.41500 EE 0.00000 {?} 5.65500 0.20140 0 {?} 0 1726 {322.HG21} -0.51900 0.05700 0.06200 ++ 0.00000 {?} {360.HA} 5.16100 0.09100 0.09700 ++ 0.00000 {?} {360.CA} 61.57100 0.28400 0.28400 EE 0.00000 {?} 1.08970 0.04420 0 {?} 0 1727 {360.HD1} 3.65800 0.04900 0.07400 ++ 0.00000 {?} {360.HA} 5.14800 0.05700 0.07800 ++ 0.00000 {?} {360.CA} 61.57100 0.37100 0.37100 EE 0.00000 {?} 0.76300 0.05620 0 {?} 0 1728 {363.HA} 4.58600 0.04100 0.05800 ++ 0.00000 {?} {363.HB} 1.68700 0.06700 0.10000 ++ 0.00000 {?} {363.CB} 34.02700 0.37000 0.37000 EE 0.00000 {?} 1.11760 0.05040 0 {?} 0 1729 {321.HB1} 2.69700 0.05300 0.08100 ++ 0.00000 {?} {363.HG21} 0.89700 0.04100 0.08500 ++ 0.00000 {?} {363.CG2} 21.17300 0.42700 0.42700 EE 0.00000 {?} 3.86310 0.20860 0 {?} 0 1730 {377.HD1} 3.94100 0.03800 0.07900 ? 0.00000 {?} {377.HB1} 2.35600 0.07600 0.14200 ++ 0.00000 {?} {377.CB} 32.45300 0.39900 0.39900 EE 0.00000 {?} 1.59200 0.07310 0 {?} 0 1731 {377.HD1} 3.94400 0.05600 0.06900 ? 0.00000 {?} {377.HB2} 2.04100 0.03700 0.12500 ? 0.00000 {?} {377.CB} 32.45300 0.42100 0.42100 EE 0.00000 {?} 1.81910 0.08680 0 {?} 0 1732 {376.HB1} 1.65700 0.05100 0.11300 ? 0.00000 {?} {377.HB1} 2.36900 0.05500 0.15500 ? 0.00000 {?} {377.CB} 32.45300 0.38700 0.38700 EE 0.00000 {?} 1.46860 0.06750 0 {?} 0 1733 {379.HD2} 3.69100 0.06500 0.07200 ? 0.00000 {?} {379.HB2} 1.81300 0.07200 0.12200 ? 0.00000 {?} {379.CB} 32.45300 0.34200 0.34200 EE 0.00000 {?} 2.04170 0.08500 0 {?} 0 1734 {379.HB1} 1.95900 0.07000 0.07300 ? 0.00000 {?} {379.HD1} 3.84200 0.06900 0.13600 ? 0.00000 {?} {379.CD} 50.81600 0.43300 0.43300 EE 0.00000 {?} 7.10570 0.16100 0 {?} 0 1735 {379.HB1} 1.90700 0.04600 0.07700 ? 0.00000 {?} {379.HD2} 3.65000 0.08200 0.13300 ? 0.00000 {?} {379.CD} 50.81600 0.37900 0.37900 EE 0.00000 {?} 2.10850 0.08570 0 {?} 0 1736 {?} 1.90500 0.04800 0.12100 ? 0.00000 {?} {?} 4.32100 0.08100 0.18200 ? 0.00000 {?} {?} 56.84900 0.50500 0.50500 EE 0.00000 {?} 39.69420 0.79380 0 {?} 0 1737 {?} 1.77200 0.04700 0.09500 ? 0.00000 {?} {?} 4.32100 0.07200 0.18600 ? 0.00000 {?} {?} 56.84900 0.51000 0.51000 EE 0.00000 {?} 45.27920 1.02170 0 {?} 0 1738 {372.HB1} 2.33900 0.03900 0.08100 ++ 0.00000 {?} {372.HG1} 2.06400 0.08100 0.17200 ? 0.00000 {?} {372.CG} 27.20600 0.51300 0.51300 EE 0.00000 {?} 68.44930 1.84880 0 {?} 0 1739 {307.HG21} 0.79600 0.04700 0.06800 ++ 0.00000 {?} {394.HA} 4.70000 0.03800 0.10600 ? 0.00000 {?} {394.CA} 54.22600 0.38700 0.38700 EE 0.00000 {?} 1.29400 0.08010 0 {?} 0 1740 {269.HG21} 0.90600 0.04500 0.05900 ++ 0.00000 {?} {268.HA} 4.70000 0.07700 0.09400 ? 0.00000 {?} {268.CA} 54.22600 0.36900 0.36900 EE 0.00000 {?} 2.22270 0.07690 0 {?} 0 1741 {388.HE1} 6.83700 0.04600 0.06600 ++ 0.00000 {?} {311.HE1} 2.57700 0.09500 0.10900 ++ 0.00000 {?} {311.CE} 41.11000 0.30900 0.30900 EE 0.00000 {?} 1.84350 0.07500 0 {?} 0 1742 {282.HE1} 7.24900 0.05600 0.10800 ? 0.00000 {?} {301.HB1} 1.99200 0.05300 0.13300 ? 0.00000 {?} {301.CB} 32.19000 0.40300 0.40300 EE 0.00000 {?} 1.70680 0.07140 0 {?} 0 1743 {282.HZ} 7.35600 0.04000 0.06300 ? 0.00000 {?} {301.HB1} 1.99500 0.08100 0.11200 ++ 0.00000 {?} {301.CB} 32.19000 0.36400 0.36400 EE 0.00000 {?} 1.27850 0.05580 0 {?} 0 1744 {334.HD1} 1.64900 0.06500 0.07600 ++ 0.00000 {?} {338.HB1} 3.86300 0.09600 0.10600 ++ 0.00000 {?} {338.CB} 63.92000 0.29600 0.29600 EE 0.00000 {?} 3.14880 0.07960 0 {?} 0 1745 {388.HE1} 6.83700 0.03200 0.06400 ++ 0.00000 {?} {311.HA} 4.08300 0.09800 0.13900 ++ 0.00000 {?} {311.CA} 58.42300 0.38300 0.38300 EE 0.00000 {?} 1.43750 0.06420 0 {?} 0 1746 {388.HE1} 6.84700 0.05600 0.06200 ++ 0.00000 {?} {276.HA} 4.60000 0.12000 0.13200 ++ 0.00000 {?} {276.CA} 58.16100 0.29900 0.29900 EE 0.00000 {?} 1.74240 0.05810 0 {?} 0 1747 {388.HD1} 7.14100 0.04600 0.04800 ++ 0.00000 {?} {276.HA} 4.61600 0.04000 0.10200 ? 0.00000 {?} {276.CA} 58.16100 0.27700 0.27700 EE 0.00000 {?} 0.77670 0.05440 0 {?} 0 1748 {388.HB1} 3.16600 0.08100 0.07000 ++ 0.00000 {?} {276.HA} 4.61000 0.13200 0.11500 ++ 0.00000 {?} {276.CA} 58.16100 0.21300 0.21300 EE 0.00000 {?} 2.27040 0.07120 0 {?} 0 1749 {334.HE1} 2.86100 0.04100 0.04800 ? 0.00000 {?} {338.HB1} 3.86600 0.03900 0.09400 ? 0.00000 {?} {338.CB} 63.93200 0.35200 0.35200 EE 0.00000 {?} 0.75560 0.04990 0 {?} 0 1750 {277.HG1} 2.47200 0.05600 0.06100 ++ 0.00000 {?} {281.HB1} 3.17500 0.10300 0.10900 ++ 0.00000 {?} {281.CB} 40.84700 0.29300 0.29300 EE 0.00000 {?} 2.01230 0.08060 0 {?} 0 1751 {277.HG1} 2.47400 0.05400 0.06100 ++ 0.00000 {?} {281.HB2} 2.87300 0.09000 0.11800 ++ 0.00000 {?} {281.CB} 40.84700 0.30300 0.30300 EE 0.00000 {?} 1.39940 0.06480 0 {?} 0 1752 {281.HB1} 3.16700 0.07200 0.08900 ++ 0.00000 {?} {277.HB1} 2.29500 0.03300 0.08300 ? 0.00000 {?} {277.CB} 31.92800 0.35200 0.35200 EE 0.00000 {?} 1.16980 0.09370 0 {?} 0 1753 {281.HB2} 2.88600 0.05700 0.06300 ++ 0.00000 {?} {277.HB1} 2.30100 0.05900 0.08300 ? 0.00000 {?} {277.CB} 31.92800 0.30100 0.30100 EE 0.00000 {?} 1.33710 0.06950 0 {?} 0 1754 {281.HB2} 2.88600 0.06900 0.07500 ++ 0.00000 {?} {277.HB2} 2.21700 0.08400 0.08400 ? 0.00000 {?} {277.CB} 31.92800 0.30700 0.30700 EE 0.00000 {?} 2.47600 0.06680 0 {?} 0 1755 {281.HB1} 3.16100 0.06800 0.07400 ++ 0.00000 {?} {277.HB2} 2.20000 0.07300 0.07900 ? 0.00000 {?} {277.CB} 31.92800 0.31600 0.31600 EE 0.00000 {?} 3.29410 0.09740 0 {?} 0 1756 {389.HD21} 0.64800 0.05100 0.06500 ++ 0.00000 {?} {277.HB1} 2.28600 0.10700 0.13700 ? 0.00000 {?} {277.CB} 31.92800 0.33600 0.33600 EE 0.00000 {?} 2.02390 0.05750 0 {?} 0 1757 {389.HD11} 0.64700 0.06700 0.09400 ++ 0.00000 {?} {277.HB2} 2.20400 0.06000 0.09400 ? 0.00000 {?} {277.CB} 31.92800 0.37800 0.37800 EE 0.00000 {?} 1.22170 0.06620 0 {?} 0 1758 {388.HE1} 6.83300 0.05200 0.07900 ++ 0.00000 {?} {277.HB2} 2.23800 0.05300 0.10000 ? 0.00000 {?} {277.CB} 31.92800 0.38200 0.38200 EE 0.00000 {?} 1.26060 0.06870 0 {?} 0 1759 {388.HD1} 7.14400 0.06800 0.06500 ++ 0.00000 {?} {277.HB2} 2.22900 0.07500 0.07400 ? 0.00000 {?} {277.CB} 31.92800 0.25700 0.25700 EE 0.00000 {?} 0.75930 0.03810 0 {?} 0 1760 {388.HD1} 7.14300 0.06000 0.06000 ? 0.00000 {?} {277.HB1} 2.31500 0.06000 0.08700 ? 0.00000 {?} {277.CB} 31.92800 0.23100 0.23100 EE 0.00000 {?} 0.94650 0.04810 0 {?} 0 1761 {388.HE1} 6.84000 0.05600 0.08500 ++ 0.00000 {?} {277.HB1} 2.31000 0.05000 0.09500 ? 0.00000 {?} {277.CB} 31.92800 0.38200 0.38200 EE 0.00000 {?} 1.51200 0.08130 0 {?} 0 1762 {293.HE1} 8.19000 0.04000 0.06100 ++ 0.00000 {?} {291.HG1} 2.33000 0.08500 0.13400 ++ 0.00000 {?} {291.CG} 36.65000 0.43200 0.43200 EE 0.00000 {?} 2.98170 0.10550 0 {?} 0 1763 {279.HB} 2.21200 0.04900 0.06700 ++ 0.00000 {?} {389.HD21} 0.64500 0.06300 0.09400 ? 0.00000 {?} {389.CD2} 24.15800 0.38800 0.38800 EE 0.00000 {?} 4.15930 0.21680 0 {?} 0 1764 {277.HB1} 2.30700 0.04300 0.04800 ++ 0.00000 {?} {389.HD21} 0.64600 0.06300 0.07400 ++ 0.00000 {?} {389.CD2} 24.15800 0.31000 0.31000 EE 0.00000 {?} 1.44350 0.10650 0 {?} 0 1765 {343.HD21} 0.98100 0.04900 0.07500 ++ 0.00000 {?} {344.HG2} 2.26300 0.05800 0.09700 ? 0.00000 {?} {344.CG} 36.38800 0.39400 0.39400 EE 0.00000 {?} 1.24940 0.07870 0 {?} 0 1766 {343.HD21} 0.98100 0.04600 0.07500 ? 0.00000 {?} {344.HG1} 2.31600 0.02700 0.06100 ? 0.00000 {?} {344.CG} 36.38800 0.39500 0.39500 EE 0.00000 {?} 0.46230 0.07220 0 {?} 0 1767 {388.HD1} 7.15900 0.04800 0.05300 ++ 0.00000 {?} {278.HA} 5.04100 0.07600 0.08800 ++ 0.00000 {?} {278.CA} 60.26000 0.30000 0.30000 EE 0.00000 {?} 0.68990 0.03110 0 {?} 0 1768 {385.HA} 4.00600 0.04200 0.05700 ++ 0.00000 {?} {278.HB} 4.65800 0.06700 0.12700 ? 0.00000 {?} {278.CB} 72.58900 0.34600 0.34600 EE 0.00000 {?} 1.07140 0.05000 0 {?} 0 1769 {282.HB1} 3.47600 0.05500 0.08400 ? 0.00000 {?} {389.HD11} 0.65100 0.06900 0.11100 ++ 0.00000 {?} {389.CD1} 25.27200 0.43200 0.43200 EE 0.00000 {?} 5.12770 0.17670 0 {?} 0 1770 {282.HB1} 3.47500 0.05500 0.06800 ++ 0.00000 {?} {389.HD21} 0.62300 0.07600 0.08800 ++ 0.00000 {?} {389.CD2} 24.32100 0.31100 0.31100 EE 0.00000 {?} 1.62000 0.07500 0 {?} 0 1771 {282.HD1} 7.20400 0.05700 0.06500 ++ 0.00000 {?} {279.HA} 3.60700 0.11100 0.12800 ++ 0.00000 {?} {279.CA} 66.03100 0.31600 0.31600 EE 0.00000 {?} 3.79590 0.11770 0 {?} 0 1772 {328.HB1} 2.47300 0.04500 0.07500 ? 0.00000 {?} {328.HB2} 2.23900 0.06800 0.10300 ++ 0.00000 {?} {328.CB} 30.87000 0.38300 0.38300 EE 0.00000 {?} 1.84970 0.06980 0 {?} 0 1773 {282.HD1} 7.19400 0.05300 0.08400 ? 0.00000 {?} {279.HG21} 0.98000 0.04900 0.14100 ? 0.00000 {?} {279.CG2} 23.27100 0.42200 0.42200 EE 0.00000 {?} 5.15870 0.23060 0 {?} 0 1774 {282.HB1} 3.46900 0.04300 0.05700 ? 0.00000 {?} {279.HG21} 0.98700 0.08900 0.10200 ++ 0.00000 {?} {279.CG2} 23.27100 0.35300 0.35300 EE 0.00000 {?} 1.34480 0.07490 0 {?} 0 1775 {387.HB1} 2.77100 0.04700 0.05600 ++ 0.00000 {?} {279.HG21} 0.99100 0.07500 0.08800 ++ 0.00000 {?} {279.CG2} 23.27100 0.35600 0.35600 EE 0.00000 {?} 0.87980 0.04810 0 {?} 0 1776 {282.HD1} 7.19200 0.05000 0.08900 ? 0.00000 {?} {279.HG11} 0.79700 0.09400 0.09400 ? 0.00000 {?} {279.CG1} 24.66300 0.48600 0.48600 EE 0.00000 {?} 7.62400 0.12630 0 {?} 0 1777 {282.HB1} 3.46700 0.06300 0.06100 ? 0.00000 {?} {279.HG11} 0.80500 0.09100 0.08900 ++ 0.00000 {?} {279.CG1} 24.66300 0.25400 0.25400 EE 0.00000 {?} 1.10230 0.07420 0 {?} 0 1778 {362.HD11} 0.71200 0.02800 0.05000 ? 0.00000 {?} {387.HB1} 2.75800 0.10100 0.10800 ++ 0.00000 {?} {387.CB} 30.61700 0.28100 0.28100 EE 0.00000 {?} 1.61970 0.08390 0 {?} 0 1779 {384.HG1} 1.47300 0.09200 0.09200 ? 0.00000 {?} {279.HG21} 0.98000 0.04700 0.10500 ? 0.00000 {?} {279.CG2} 23.27100 0.43700 0.43700 EE 0.00000 {?} 8.01290 0.17690 0 {?} 0 1780 {303.HD11} 0.74900 0.05200 0.06800 ? 0.00000 {?} {283.HB2} 2.43400 0.11400 0.12000 ++ 0.00000 {?} {283.CB} 34.02700 0.27800 0.27800 EE 0.00000 {?} 2.42240 0.06620 0 {?} 0 1781 {280.HA} 4.12500 0.04900 0.06000 ++ 0.00000 {?} {280.HB1} 1.87300 0.08100 0.10400 ++ 0.00000 {?} {280.CB} 41.37200 0.34700 0.34700 EE 0.00000 {?} 2.26550 0.09610 0 {?} 0 1782 {280.HG} 1.56700 0.05500 0.07600 ++ 0.00000 {?} {280.HB1} 1.88700 0.09000 0.10500 ++ 0.00000 {?} {280.CB} 41.37200 0.33800 0.33800 EE 0.00000 {?} 2.25220 0.08870 0 {?} 0 1783 {286.HB2} 2.91900 0.05800 0.06600 ++ 0.00000 {?} {283.HA} 3.97900 0.09300 0.11300 ? 0.00000 {?} {283.CA} 60.52200 0.31100 0.31100 EE 0.00000 {?} 3.13090 0.10210 0 {?} 0 1784 {385.HG2} 2.42700 0.04200 0.12400 ? 0.00000 {?} {280.HD21} 0.96700 0.06400 0.13100 ? 0.00000 {?} {280.CD2} 23.79600 0.48900 0.48900 EE 0.00000 {?} 13.08740 0.36620 0 {?} 0 1785 {356.HB1} 3.05800 0.02000 0.06900 ? 0.00000 {?} {280.HD11} 0.95400 0.04700 0.10100 ? 0.00000 {?} {280.CD1} 25.63500 0.48700 0.48700 EE 0.00000 {?} 4.04090 0.31930 0 {?} 0 1786 {280.HD21} 0.96000 0.05400 0.07400 ++ 0.00000 {?} {281.HA} 4.44000 0.04800 0.10200 ? 0.00000 {?} {281.CA} 57.89900 0.36300 0.36300 EE 0.00000 {?} 2.05470 0.11180 0 {?} 0 1787 {284.HD1} 7.31400 0.06700 0.07800 ++ 0.00000 {?} {281.HA} 4.44800 0.05600 0.11800 ? 0.00000 {?} {281.CA} 57.89900 0.29200 0.29200 EE 0.00000 {?} 1.99070 0.09970 0 {?} 0 1788 {389.HD11} 0.66200 0.04900 0.08200 ? 0.00000 {?} {282.HA} 4.31300 0.05700 0.12200 ? 0.00000 {?} {282.CA} 61.34700 0.38500 0.38500 EE 0.00000 {?} 2.12470 0.10820 0 {?} 0 1789 {340.HG21} 0.79100 0.04600 0.07600 ++ 0.00000 {?} {345.HA} 4.31100 0.05700 0.11300 ? 0.00000 {?} {345.CA} 61.30900 0.41200 0.41200 EE 0.00000 {?} 1.40880 0.05930 0 {?} 0 1790 {295.HE1} 7.56600 0.05700 0.08700 ++ 0.00000 {?} {287.HA} 3.94900 0.11400 0.15200 ++ 0.00000 {?} {287.CA} 60.52200 0.30600 0.30600 EE 0.00000 {?} 5.72810 0.17360 0 {?} 0 1791 {299.HG21} 0.82600 0.02600 0.05600 ? 0.00000 {?} {283.HA} 3.97600 0.08800 0.09500 ++ 0.00000 {?} {283.CA} 60.52000 0.28500 0.28500 EE 0.00000 {?} 1.09120 0.06830 0 {?} 0 1792 {286.HB1} 3.18900 0.05100 0.05100 ? 0.00000 {?} {283.HA} 3.98400 0.06800 0.11200 ? 0.00000 {?} {283.CA} 60.52200 0.39800 0.39800 EE 0.00000 {?} 4.07060 0.15190 0 {?} 0 1793 {295.HD1} 7.19900 0.04900 0.08000 ? 0.00000 {?} {287.HA} 3.96600 0.06600 0.14900 ? 0.00000 {?} {287.CA} 60.52400 0.40300 0.40300 EE 0.00000 {?} 10.08370 0.34930 0 {?} 0 1794 {283.HA} 3.97800 0.04500 0.06000 ? 0.00000 {?} {286.HB1} 3.18800 0.12800 0.12800 ? 0.00000 {?} {286.CB} 39.53600 0.26900 0.26900 EE 0.00000 {?} 2.27350 0.07600 0 {?} 0 1795 {283.HA} 3.97800 0.06800 0.07800 ++ 0.00000 {?} {286.HB2} 2.92700 0.09800 0.11300 ++ 0.00000 {?} {286.CB} 39.53600 0.32200 0.32200 EE 0.00000 {?} 3.30710 0.08670 0 {?} 0 1796 {385.HG1} 2.56700 0.05400 0.08600 ? 0.00000 {?} {280.HD21} 0.97200 0.05900 0.09200 ++ 0.00000 {?} {280.CD2} 23.79600 0.42700 0.42700 EE 0.00000 {?} 2.98220 0.14160 0 {?} 0 1797 {322.HB} 1.45100 0.08200 0.08200 ? 0.00000 {?} {283.HE1} 1.91900 0.09200 0.09200 ? 0.00000 {?} {283.CE} 17.46200 0.35600 0.35600 EE 0.00000 {?} 2.42360 0.06970 0 {?} 0 1798 {289.HG1} 2.27300 0.03700 0.09400 ? 0.00000 {?} {286.HA} 4.15600 0.06400 0.15300 ? 0.00000 {?} {286.CA} 60.26000 0.42600 0.42600 EE 0.00000 {?} 3.36730 0.16800 0 {?} 0 1799 {286.HA} 4.16400 0.04600 0.08000 ? 0.00000 {?} {299.HG11} 0.67300 0.05900 0.11900 ? 0.00000 {?} {299.CG1} 24.15800 0.42900 0.43000 EE 0.00000 {?} 3.18430 0.15590 0 {?} 0 1800 {295.HE1} 7.56500 0.07000 0.07700 ++ 0.00000 {?} {299.HG21} 0.83300 0.11000 0.12800 ++ 0.00000 {?} {299.CG2} 21.69700 0.30800 0.30800 EE 0.00000 {?} 7.21530 0.21920 0 {?} 0 1801 {290.HG21} 1.21600 0.04100 0.05200 ++ 0.00000 {?} {287.HA} 3.91400 0.03700 0.11300 ? 0.00000 {?} {287.CA} 60.52200 0.33900 0.33900 EE 0.00000 {?} 0.68280 0.06230 0 {?} 0 1802 {295.HB2} 3.01100 0.06400 0.09300 ++ 0.00000 {?} {290.HG21} 1.22900 0.06200 0.12500 ++ 0.00000 {?} {290.CG2} 20.64800 0.42200 0.42200 EE 0.00000 {?} 4.88180 0.18740 0 {?} 0 1803 {286.HA} 4.16900 0.06300 0.08300 ++ 0.00000 {?} {289.HB2} 1.93100 0.08500 0.15100 ? 0.00000 {?} {289.CB} 29.30500 0.36300 0.36300 EE 0.00000 {?} 5.57470 0.15110 0 {?} 0 1804 {289.HG1} 2.27500 0.07700 0.07600 ? 0.00000 {?} {290.HA} 4.49800 0.09200 0.09000 ++ 0.00000 {?} {290.CA} 60.52200 0.25800 0.25800 EE 0.00000 {?} 0.73540 0.03730 0 {?} 0 1805 {290.HG21} 1.23300 0.05700 0.05600 ++ 0.00000 {?} {295.HB1} 3.34000 0.10200 0.09900 ++ 0.00000 {?} {295.CB} 39.27300 0.25400 0.25400 EE 0.00000 {?} 1.11840 0.06420 0 {?} 0 1806 {289.HB2} 1.93100 0.03900 0.05300 ++ 0.00000 {?} {290.HG21} 1.22700 0.05000 0.08800 ++ 0.00000 {?} {290.CG2} 20.64800 0.40800 0.40800 EE 0.00000 {?} 3.98040 0.21140 0 {?} 0 1807 {289.HG1} 2.31100 0.02400 0.06700 ? 0.00000 {?} {290.HG21} 1.22400 0.06200 0.13100 ++ 0.00000 {?} {290.CG2} 20.64800 0.43900 0.43900 EE 0.00000 {?} 2.10490 0.22320 0 {?} 0 1808 {290.HG21} 1.24400 0.04700 0.05500 ++ 0.00000 {?} {298.HB1} 2.31800 0.04000 0.10300 ? 0.00000 {?} {298.CB} 28.78000 0.30900 0.30900 EE 0.00000 {?} 1.36890 0.09810 0 {?} 0 1809 {293.HE1} 8.18800 0.05600 0.06800 ++ 0.00000 {?} {291.HB1} 2.15900 0.08700 0.12100 ++ 0.00000 {?} {291.CB} 30.57900 0.34200 0.34200 EE 0.00000 {?} 2.06900 0.08410 0 {?} 0 1810 {293.HE1} 8.19600 0.10300 0.07200 ++ 0.00000 {?} {291.HB2} 1.80000 0.20000 0.14600 ++ 0.00000 {?} {291.CB} 30.57900 0.16000 0.16000 EE 0.00000 {?} 2.05020 0.07120 0 {?} 0 1811 {296.HA} 3.04600 0.02400 0.04400 ++ 0.00000 {?} {297.HG1} 2.32400 0.04200 0.11600 ? 0.00000 {?} {297.CG} 36.38800 0.42800 0.42800 EE 0.00000 {?} 1.23260 0.12250 0 {?} 0 1812 {292.HA} 3.95900 0.06300 0.07500 ++ 0.00000 {?} {295.HB1} 3.31600 0.10900 0.15200 ? 0.00000 {?} {295.CB} 39.27300 0.33100 0.33100 EE 0.00000 {?} 4.04550 0.10870 0 {?} 0 1813 {292.HA} 3.95800 0.05300 0.06500 ++ 0.00000 {?} {295.HB2} 2.98200 0.05400 0.12000 ? 0.00000 {?} {295.CB} 39.27300 0.34100 0.34100 EE 0.00000 {?} 1.92930 0.11080 0 {?} 0 1814 {295.HZ} 7.28600 0.02300 0.07400 ? 0.00000 {?} {287.HA} 3.95300 0.11300 0.13300 ++ 0.00000 {?} {287.CA} 60.52600 0.33400 0.33400 EE 0.00000 {?} 2.22970 0.14020 0 {?} 0 1815 {287.HE1} 6.58400 0.05400 0.05400 ++ 0.00000 {?} {289.HB1} 2.10500 0.11800 0.15000 ? 0.00000 {?} {289.CB} 29.28300 0.25900 0.25900 EE 0.00000 {?} 1.76780 0.06600 0 {?} 0 1816 {287.HE1} 6.57600 0.05200 0.04700 ++ 0.00000 {?} {289.HB2} 1.94500 0.14600 0.12800 ? 0.00000 {?} {289.CB} 29.28300 0.21900 0.21900 EE 0.00000 {?} 0.68490 0.03900 0 {?} 0 1817 {287.HE1} 6.58300 0.03800 0.05300 ++ 0.00000 {?} {292.HG2} 2.21900 0.04600 0.08200 ? 0.00000 {?} {292.CG} 36.12500 0.39000 0.39000 EE 0.00000 {?} 1.62840 0.10770 0 {?} 0 1818 {287.HE1} 6.58200 0.04700 0.06600 ++ 0.00000 {?} {292.HG1} 2.29100 0.05100 0.09100 ? 0.00000 {?} {292.CG} 36.12500 0.39000 0.39000 EE 0.00000 {?} 2.09110 0.12570 0 {?} 0 1819 {296.HB1} 1.47000 0.05400 0.05400 ++ 0.00000 {?} {293.HA} 4.49200 0.12700 0.12700 ++ 0.00000 {?} {293.CA} 58.16100 0.26100 0.26100 EE 0.00000 {?} 1.18870 0.04820 0 {?} 0 1820 {294.HG1} 1.15400 0.05300 0.06900 ? 0.00000 {?} {291.HG1} 2.33000 0.08400 0.11400 ++ 0.00000 {?} {291.CG} 36.65000 0.36600 0.36600 EE 0.00000 {?} 1.89920 0.08240 0 {?} 0 1821 {294.HG1} 1.14700 0.05800 0.04900 ++ 0.00000 {?} {291.HB1} 2.17200 0.07000 0.06800 ++ 0.00000 {?} {291.CB} 30.87900 0.19500 0.19500 EE 0.00000 {?} 0.86750 0.06970 0 {?} 0 1822 {294.HG1} 1.15200 0.07000 0.07900 ? 0.00000 {?} {291.HB2} 1.76400 0.11100 0.12100 ++ 0.00000 {?} {291.CB} 30.87900 0.30400 0.30400 EE 0.00000 {?} 3.33660 0.08730 0 {?} 0 1823 {348.HG2} 1.44800 0.02700 0.03500 ? 0.00000 {?} {344.HG1} 2.32700 0.07800 0.09300 ++ 0.00000 {?} {344.CG} 36.38000 0.34100 0.34100 EE 0.00000 {?} 0.64880 0.04430 0 {?} 0 1824 {317.HE1} 6.93100 0.02800 0.07500 ? 0.00000 {?} {315.HE1} 2.97100 0.10600 0.16400 ? 0.00000 {?} {315.CE} 41.89700 0.40600 0.40600 EE 0.00000 {?} 2.15220 0.09390 0 {?} 0 1825 {317.HD1} 6.84700 0.04400 0.06600 ++ 0.00000 {?} {315.HE1} 2.97000 0.07000 0.12100 ++ 0.00000 {?} {315.CE} 41.89700 0.39000 0.39000 EE 0.00000 {?} 1.28660 0.05380 0 {?} 0 1826 {293.HD2} 7.18800 0.05500 0.08300 ++ 0.00000 {?} {294.HE1} 2.97400 0.07700 0.13300 ++ 0.00000 {?} {294.CE} 41.89700 0.39000 0.39000 EE 0.00000 {?} 4.11470 0.15080 0 {?} 0 1827 {294.HA} 4.42900 0.07400 0.07400 ? 0.00000 {?} {294.HE1} 2.98100 0.10800 0.10800 ? 0.00000 {?} {294.CE} 41.89700 0.42900 0.42900 EE 0.00000 {?} 16.61590 0.24370 0 {?} 0 1828 {348.HE1} 2.98900 0.02900 0.05500 ++ 0.00000 {?} {344.HG1} 2.33200 0.05500 0.15300 ? 0.00000 {?} {344.CG} 36.38800 0.43500 0.43500 EE 0.00000 {?} 3.36960 0.22820 0 {?} 0 1829 {296.HA} 3.04300 0.04200 0.04900 ++ 0.00000 {?} {297.HG2} 2.22100 0.10100 0.10200 ? 0.00000 {?} {297.CG} 36.38800 0.34500 0.34500 EE 0.00000 {?} 2.93370 0.10500 0 {?} 0 1830 {295.HA} 4.28700 0.04500 0.06100 ++ 0.00000 {?} {298.HB1} 2.29800 0.06100 0.08400 ? 0.00000 {?} {298.CB} 28.78000 0.38100 0.38100 EE 0.00000 {?} 1.56760 0.08770 0 {?} 0 1831 {295.HA} 4.28300 0.06600 0.08800 ++ 0.00000 {?} {298.HB2} 2.24200 0.06700 0.09400 ? 0.00000 {?} {298.CB} 28.78000 0.38100 0.38100 EE 0.00000 {?} 2.13690 0.08850 0 {?} 0 1832 {286.HZ} 7.19200 0.01500 0.05900 ? 0.00000 {?} {298.HB2} 2.22000 0.05500 0.09100 ? 0.00000 {?} {298.CB} 28.78000 0.44400 0.44400 EE 0.00000 {?} 2.55730 0.25430 0 {?} 0 1833 {286.HZ} 7.19400 0.06400 0.06600 ? 0.00000 {?} {298.HB1} 2.31300 0.04800 0.09400 ? 0.00000 {?} {298.CB} 28.78000 0.19000 0.19000 EE 0.00000 {?} 3.42240 0.17290 0 {?} 0 1834 {286.HE1} 7.10800 0.06400 0.06600 ? 0.00000 {?} {298.HB1} 2.30800 0.04200 0.08100 ? 0.00000 {?} {298.CB} 28.78000 0.19000 0.19000 EE 0.00000 {?} 3.25070 0.18820 0 {?} 0 1835 {298.HG1} 2.63400 0.04400 0.05400 ++ 0.00000 {?} {294.HB1} 1.93500 0.10200 0.11200 ? 0.00000 {?} {294.CB} 32.97700 0.34200 0.34200 EE 0.00000 {?} 4.37090 0.16380 0 {?} 0 1836 {299.HA} 3.18900 0.05100 0.05800 ++ 0.00000 {?} {302.HG1} 2.31200 0.08000 0.09200 ++ 0.00000 {?} {302.CG} 35.33800 0.31500 0.31500 EE 0.00000 {?} 1.41160 0.07410 0 {?} 0 1837 {299.HA} 3.20700 0.07400 0.10100 ++ 0.00000 {?} {302.HG2} 2.11400 0.08600 0.12200 ++ 0.00000 {?} {302.CG} 35.33800 0.36700 0.36700 EE 0.00000 {?} 4.86490 0.16000 0 {?} 0 1838 {299.HA} 3.20400 0.04000 0.04900 ++ 0.00000 {?} {302.HB1} 2.20100 0.04500 0.10600 ? 0.00000 {?} {302.CB} 29.83000 0.33300 0.33300 EE 0.00000 {?} 1.60870 0.12020 0 {?} 0 1839 {299.HA} 3.18700 0.04700 0.06100 ? 0.00000 {?} {302.HB2} 1.86900 0.08400 0.09300 ++ 0.00000 {?} {302.CB} 29.83000 0.30200 0.30200 EE 0.00000 {?} 2.77940 0.13180 0 {?} 0 1840 {300.HA} 4.17100 0.02700 0.07100 ? 0.00000 {?} {299.HG21} 0.83000 0.07700 0.12600 ? 0.00000 {?} {299.CG2} 21.69700 0.43800 0.43800 EE 0.00000 {?} 4.84100 0.19660 0 {?} 0 1841 {303.HB2} 1.29900 0.05900 0.05200 ++ 0.00000 {?} {300.HA} 4.16400 0.11800 0.10100 ++ 0.00000 {?} {300.CA} 62.88000 0.22300 0.22300 EE 0.00000 {?} 2.80720 0.14920 0 {?} 0 1842 {303.HD21} 0.61700 0.06800 0.06800 ? 0.00000 {?} {300.HA} 4.16200 0.08000 0.09800 ++ 0.00000 {?} {300.CA} 62.88300 0.29700 0.29700 EE 0.00000 {?} 2.54590 0.08590 0 {?} 0 1843 {311.HG2} 0.78500 0.06800 0.09800 ++ 0.00000 {?} {311.HA} 4.05100 0.05200 0.11700 ? 0.00000 {?} {311.CA} 58.42300 0.42000 0.42000 EE 0.00000 {?} 3.28360 0.11650 0 {?} 0 1844 {301.HA} 4.06100 0.05800 0.06600 ++ 0.00000 {?} {301.HG1} 1.64800 0.09700 0.10800 ? 0.00000 {?} {301.CG} 25.10800 0.31000 0.31000 EE 0.00000 {?} 18.13420 0.51810 0 {?} 0 1845 {303.HG} 1.73300 0.06900 0.08400 ? 0.00000 {?} {302.HA} 4.20000 0.09400 0.11700 ? 0.00000 {?} {302.CA} 57.37400 0.32900 0.32900 EE 0.00000 {?} 2.62740 0.06780 0 {?} 0 1846 {302.HA} 4.19600 0.01900 0.08400 ? 0.00000 {?} {301.HB1} 1.98300 0.06500 0.14600 ? 0.00000 {?} {301.CB} 32.19000 0.51200 0.51200 EE 0.00000 {?} 3.98630 0.22980 0 {?} 0 1847 {282.HE1} 7.20200 0.05800 0.07900 ? 0.00000 {?} {302.HB1} 2.19900 0.07700 0.10300 ++ 0.00000 {?} {302.CB} 29.83000 0.37300 0.37300 EE 0.00000 {?} 4.49650 0.16560 0 {?} 0 1848 {282.HZ} 7.34700 0.04500 0.07600 ? 0.00000 {?} {302.HB1} 2.20300 0.08100 0.10100 ? 0.00000 {?} {302.CB} 29.83000 0.34800 0.34800 EE 0.00000 {?} 2.91390 0.12890 0 {?} 0 1849 {282.HZ} 7.34400 0.05700 0.08200 ? 0.00000 {?} {302.HB2} 1.86500 0.11000 0.13600 ++ 0.00000 {?} {302.CB} 29.83000 0.31400 0.31400 EE 0.00000 {?} 3.31870 0.09280 0 {?} 0 1850 {282.HE1} 7.20100 0.04300 0.07500 ? 0.00000 {?} {302.HB2} 1.87100 0.08400 0.11600 ? 0.00000 {?} {302.CB} 29.83000 0.36300 0.36300 EE 0.00000 {?} 3.39520 0.14470 0 {?} 0 1851 {286.HZ} 7.19900 0.05300 0.07900 ? 0.00000 {?} {302.HG1} 2.30200 0.07100 0.14300 ? 0.00000 {?} {302.CG} 35.60100 0.38200 0.38200 EE 0.00000 {?} 4.24010 0.16890 0 {?} 0 1852 {286.HZ} 7.19700 0.03100 0.08400 ? 0.00000 {?} {302.HG2} 2.08300 0.06800 0.12100 ? 0.00000 {?} {302.CG} 35.60100 0.37800 0.37800 EE 0.00000 {?} 2.34390 0.13350 0 {?} 0 1853 {282.HZ} 7.34400 0.05100 0.06000 ++ 0.00000 {?} {302.HG2} 2.08500 0.07700 0.10100 ++ 0.00000 {?} {302.CG} 35.60100 0.30800 0.30800 EE 0.00000 {?} 2.13640 0.08680 0 {?} 0 1854 {282.HZ} 7.34800 0.04500 0.06600 ? 0.00000 {?} {302.HG1} 2.31700 0.07700 0.08700 ++ 0.00000 {?} {302.CG} 35.60100 0.30900 0.30900 EE 0.00000 {?} 2.15900 0.08730 0 {?} 0 1855 {300.HA} 4.16900 0.05300 0.05500 ++ 0.00000 {?} {303.HB2} 1.31600 0.08600 0.09700 ++ 0.00000 {?} {303.CB} 45.04500 0.30200 0.30200 EE 0.00000 {?} 2.17480 0.07890 0 {?} 0 1856 {362.HD21} 0.53900 0.05400 0.05400 ? 0.00000 {?} {303.HB2} 1.30500 0.09400 0.11500 ++ 0.00000 {?} {303.CB} 45.04500 0.32600 0.32600 EE 0.00000 {?} 2.47320 0.08400 0 {?} 0 1857 {362.HD21} 0.54600 0.04400 0.04400 ? 0.00000 {?} {303.HB1} 1.69600 0.08600 0.08600 ++ 0.00000 {?} {303.CB} 45.04500 0.24200 0.24200 EE 0.00000 {?} 1.47790 0.06130 0 {?} 0 1858 {322.HG21} -0.50400 0.05300 0.05900 ++ 0.00000 {?} {303.HD21} 0.61500 0.08700 0.10000 ++ 0.00000 {?} {303.CD2} 24.84500 0.30800 0.30800 EE 0.00000 {?} 1.06120 0.04430 0 {?} 0 1859 {303.HG} 1.72500 0.04100 0.12500 ? 0.00000 {?} {303.HD21} 0.62300 0.07100 0.15600 ? 0.00000 {?} {303.CD2} 24.84500 0.50800 0.50800 EE 0.00000 {?} 46.65090 1.10670 0 {?} 0 1860 {282.HE1} 7.19500 0.04600 0.09200 ? 0.00000 {?} {303.HD21} 0.62600 0.06200 0.13500 ? 0.00000 {?} {303.CD2} 24.84500 0.48400 0.48400 EE 0.00000 {?} 26.95290 0.73960 0 {?} 0 1861 {282.HZ} 7.34000 0.04900 0.07700 ? 0.00000 {?} {303.HD21} 0.62200 0.07400 0.10000 ++ 0.00000 {?} {303.CD2} 24.84500 0.37700 0.37700 EE 0.00000 {?} 3.69910 0.13660 0 {?} 0 1862 {301.HA} 4.06400 0.05800 0.06400 ++ 0.00000 {?} {304.HB} 1.86600 0.08200 0.09200 ++ 0.00000 {?} {304.CB} 36.65000 0.29700 0.29700 EE 0.00000 {?} 2.16030 0.08340 0 {?} 0 1863 {304.HD11} 0.95200 0.03700 0.08400 ? 0.00000 {?} {300.HA} 4.15800 0.03600 0.13300 ? 0.00000 {?} {300.CA} 62.88000 0.44000 0.44000 EE 0.00000 {?} 8.85590 0.50410 0 {?} 0 1864 {320.HB1} 2.77400 0.05600 0.05900 ++ 0.00000 {?} {304.HD11} 0.93800 0.08900 0.09200 ++ 0.00000 {?} {304.CG2} 16.97500 0.27600 0.27600 EE 0.00000 {?} 2.18300 0.08660 0 {?} 0 1865 {306.HB2} 1.32200 0.02500 0.07100 ? 0.00000 {?} {306.HD11} 0.62200 0.11200 0.11200 ? 0.00000 {?} {306.CD1} 24.32100 0.44300 0.44300 EE 0.00000 {?} 11.30040 0.43850 0 {?} 0 1866 {387.HB1} 2.77200 0.08600 0.10900 ++ 0.00000 {?} {308.HB} 1.98200 0.04200 0.11800 ? 0.00000 {?} {308.CB} 35.07600 0.38500 0.38500 EE 0.00000 {?} 2.37980 0.09300 0 {?} 0 1867 {387.HB2} 2.21200 0.06700 0.10400 ? 0.00000 {?} {308.HB} 1.98600 0.09100 0.13800 ? 0.00000 {?} {308.CB} 35.07600 0.42100 0.42100 EE 0.00000 {?} 8.44040 0.14630 0 {?} 0 1868 {306.HB1} 1.87200 0.08700 0.08700 ? 0.00000 {?} {308.HG11} 0.63600 0.08300 0.10800 ? 0.00000 {?} {308.CG1} 21.69700 0.41900 0.41900 EE 0.00000 {?} 11.00730 0.18460 0 {?} 0 1869 {390.HG21} 1.22300 0.04700 0.07100 ++ 0.00000 {?} {308.HG11} 0.64200 0.07600 0.14600 ? 0.00000 {?} {308.CG1} 21.69700 0.44100 0.44100 EE 0.00000 {?} 13.48420 0.33480 0 {?} 0 1870 {303.HB2} 1.34300 0.05500 0.07900 ? 0.00000 {?} {308.HG11} 0.63700 0.06500 0.10300 ++ 0.00000 {?} {308.CG1} 21.69700 0.39100 0.39100 EE 0.00000 {?} 3.83380 0.15190 0 {?} 0 1871 {382.HD11} 0.09800 0.04200 0.06700 ++ 0.00000 {?} {308.HG11} 0.63800 0.05600 0.09300 ++ 0.00000 {?} {308.CG1} 21.69700 0.39000 0.39000 EE 0.00000 {?} 1.07100 0.06620 0 {?} 0 1872 {316.HB} 3.88900 0.04900 0.04900 ++ 0.00000 {?} {309.HA} 5.31400 0.13700 0.13600 ++ 0.00000 {?} {309.CA} 52.91400 0.26000 0.26000 EE 0.00000 {?} 1.72840 0.07360 0 {?} 0 1873 {309.HD11} 0.78100 0.05700 0.06900 ++ 0.00000 {?} {388.HB1} 3.10400 0.10900 0.13600 ++ 0.00000 {?} {388.CB} 40.06000 0.32300 0.32300 EE 0.00000 {?} 1.88120 0.05820 0 {?} 0 1874 {316.HG21} 1.03300 0.03000 0.08500 ? 0.00000 {?} {309.HD21} 0.74900 0.04700 0.11800 ? 0.00000 {?} {309.CD2} 23.79600 0.51300 0.51300 EE 0.00000 {?} 24.00450 1.28420 0 {?} 0 1875 {298.HG1} 2.66000 0.04000 0.05900 ++ 0.00000 {?} {299.HG11} 0.74200 0.03600 0.05100 ++ 0.00000 {?} {299.CG1} 23.79600 0.41000 0.41000 EE 0.00000 {?} 1.13650 0.06880 0 {?} 0 1876 {388.HB2} 2.83700 0.04700 0.05900 ++ 0.00000 {?} {309.HD21} 0.74400 0.05400 0.06400 ++ 0.00000 {?} {309.CD2} 23.79600 0.31900 0.31900 EE 0.00000 {?} 0.97070 0.04720 0 {?} 0 1877 {388.HB2} 2.84000 0.06900 0.09100 ++ 0.00000 {?} {309.HD11} 0.78800 0.05900 0.08800 ++ 0.00000 {?} {309.CD1} 26.15700 0.39500 0.39500 EE 0.00000 {?} 3.11120 0.13440 0 {?} 0 1878 {388.HB1} 3.09000 0.04200 0.07200 ++ 0.00000 {?} {309.HD11} 0.79100 0.06200 0.11300 ++ 0.00000 {?} {309.CD1} 26.15700 0.42500 0.42500 EE 0.00000 {?} 3.31840 0.16120 0 {?} 0 1879 {316.HB} 3.89200 0.04100 0.06500 ? 0.00000 {?} {309.HD21} 0.74400 0.04300 0.06400 ? 0.00000 {?} {309.CD2} 23.79600 0.41800 0.41800 EE 0.00000 {?} 1.60980 0.08420 0 {?} 0 1880 {317.HD1} 6.83600 0.04900 0.06100 ? 0.00000 {?} {309.HD21} 0.73700 0.09300 0.10700 ++ 0.00000 {?} {309.CD2} 23.79600 0.33000 0.33000 EE 0.00000 {?} 2.16610 0.08670 0 {?} 0 1881 {387.HB1} 2.77000 0.04700 0.05700 ++ 0.00000 {?} {310.HG21} 1.25200 0.12100 0.14700 ++ 0.00000 {?} {310.CG2} 23.27100 0.33200 0.33200 EE 0.00000 {?} 1.74790 0.06380 0 {?} 0 1882 {387.HB2} 2.20800 0.05200 0.06700 ++ 0.00000 {?} {310.HG21} 1.26000 0.07600 0.10100 ++ 0.00000 {?} {310.CG2} 23.27100 0.34400 0.34400 EE 0.00000 {?} 1.32810 0.05430 0 {?} 0 1883 {309.HA} 5.32100 0.06700 0.07200 ++ 0.00000 {?} {310.HG21} 1.26300 0.09300 0.09900 ++ 0.00000 {?} {310.CG2} 23.27100 0.28600 0.28600 EE 0.00000 {?} 1.94920 0.07150 0 {?} 0 1884 {310.HG21} 1.26700 0.06000 0.10300 ++ 0.00000 {?} {387.HA} 5.03800 0.08800 0.19300 ? 0.00000 {?} {387.CA} 57.89900 0.43300 0.43300 EE 0.00000 {?} 4.91620 0.09320 0 {?} 0 1885 {388.HE1} 6.83500 0.06700 0.05700 ++ 0.00000 {?} {311.HB1} 1.80300 0.06400 0.11300 ? 0.00000 {?} {311.CB} 33.24000 0.22400 0.22400 EE 0.00000 {?} 0.96560 0.05430 0 {?} 0 1886 {388.HE1} 6.83500 0.04800 0.04800 ++ 0.00000 {?} {311.HB2} 1.71600 0.10500 0.09000 ? 0.00000 {?} {311.CB} 33.24000 0.19100 0.19100 EE 0.00000 {?} 1.83440 0.09610 0 {?} 0 1887 {308.HG21} 0.76300 0.06400 0.06800 ++ 0.00000 {?} {317.HA} 4.68100 0.09500 0.10400 ++ 0.00000 {?} {317.CA} 56.84900 0.28500 0.28500 EE 0.00000 {?} 1.09150 0.03910 0 {?} 0 1888 {312.HD1} 6.63700 0.06900 0.06900 ? 0.00000 {?} {312.HA} 4.60200 0.08300 0.08300 ++ 0.00000 {?} {312.CA} 56.84900 0.24700 0.24700 EE 0.00000 {?} 0.91030 0.02560 0 {?} 0 1889 {312.HE1} 6.68500 0.04200 0.05800 ? 0.00000 {?} {312.HA} 4.60600 0.08800 0.08800 ++ 0.00000 {?} {312.CA} 56.84900 0.20000 0.20000 EE 0.00000 {?} 0.77480 0.02910 0 {?} 0 1890 {312.HE1} 6.70800 0.04100 0.06200 ? 0.00000 {?} {312.HB1} 3.09400 0.10400 0.09400 ++ 0.00000 {?} {312.CB} 37.43700 0.23000 0.23000 EE 0.00000 {?} 0.67790 0.03470 0 {?} 0 1891 {346.HD1} 7.22600 0.06100 0.08200 ++ 0.00000 {?} {386.HD11} 0.28100 0.07100 0.10400 ++ 0.00000 {?} {386.CD1} 25.89500 0.40000 0.40000 EE 0.00000 {?} 5.23040 0.15480 0 {?} 0 1892 {317.HD1} 6.85600 0.03100 0.04500 ? 0.00000 {?} {315.HD1} 1.65000 0.09700 0.10300 ++ 0.00000 {?} {315.CD} 28.78000 0.28900 0.28900 EE 0.00000 {?} 1.36860 0.06810 0 {?} 0 1893 {317.HD1} 6.84200 0.06000 0.05900 ++ 0.00000 {?} {316.HA} 5.61100 0.11400 0.11300 ++ 0.00000 {?} {316.CA} 58.68600 0.25600 0.25600 EE 0.00000 {?} 1.16880 0.04740 0 {?} 0 1894 {390.HG21} 1.20700 0.07000 0.07800 ++ 0.00000 {?} {316.HB} 3.90100 0.07400 0.08800 ++ 0.00000 {?} {316.CB} 71.74000 0.30900 0.30900 EE 0.00000 {?} 2.63430 0.09150 0 {?} 0 1895 {362.HB1} 1.68900 0.06300 0.08700 ++ 0.00000 {?} {382.HD11} 0.11200 0.07400 0.11800 ++ 0.00000 {?} {382.CD1} 25.10800 0.39900 0.39900 EE 0.00000 {?} 3.28970 0.10590 0 {?} 0 1896 {364.HA} 5.20800 0.05100 0.07300 ++ 0.00000 {?} {382.HD11} 0.11500 0.09200 0.14200 ++ 0.00000 {?} {382.CD1} 25.10800 0.40000 0.40000 EE 0.00000 {?} 2.48110 0.08240 0 {?} 0 1897 {505.H2'} 4.41500 0.06900 0.06900 ? 0.00000 {?} {382.HD21} 0.07100 0.07500 0.10900 ++ 0.00000 {?} {382.CD2} 22.22200 0.42200 0.42200 EE 0.00000 {?} 1.87350 0.04530 0 {?} 0 1898 {317.HD1} 6.84200 0.03300 0.06300 ? 0.00000 {?} {382.HD21} 0.06400 0.06600 0.12000 ++ 0.00000 {?} {382.CD2} 22.22200 0.43100 0.43100 EE 0.00000 {?} 2.16200 0.11060 0 {?} 0 1899 {317.HA} 4.66500 0.04000 0.06400 ++ 0.00000 {?} {308.HG21} 0.75300 0.05900 0.10000 ? 0.00000 {?} {308.CG2} 18.02500 0.42900 0.42900 EE 0.00000 {?} 1.90310 0.10440 0 {?} 0 1900 {317.HB1} 2.92100 0.04600 0.06500 ? 0.00000 {?} {308.HG21} 0.75700 0.07300 0.13400 ++ 0.00000 {?} {308.CG2} 18.02500 0.45000 0.45000 EE 0.00000 {?} 6.79190 0.17950 0 {?} 0 1901 {318.HB2} 1.64500 0.04300 0.11000 ? 0.00000 {?} {318.HG1} 1.36200 0.07800 0.12800 ? 0.00000 {?} {318.CG} 27.73100 0.47400 0.47400 EE 0.00000 {?} 18.77630 0.36610 0 {?} 0 1902 {364.HA} 5.21400 0.06600 0.09700 ++ 0.00000 {?} {319.HA} 3.63600 0.10400 0.15500 ++ 0.00000 {?} {319.CA} 64.19500 0.40600 0.40600 EE 0.00000 {?} 5.43560 0.12830 0 {?} 0 1903 {319.HA} 3.62100 0.04900 0.10900 ++ 0.00000 {?} {319.HB} 2.49500 0.06600 0.10500 ++ 0.00000 {?} {319.CB} 30.87900 0.41900 0.41900 EE 0.00000 {?} 5.27200 0.18810 0 {?} 0 1904 {308.HG11} 0.62700 0.06600 0.06800 ? 0.00000 {?} {319.HB} 2.48600 0.12200 0.15600 ++ 0.00000 {?} {319.CB} 30.87900 0.34200 0.34200 EE 0.00000 {?} 4.07260 0.10840 0 {?} 0 1905 {319.HG21} 0.80800 0.01900 0.06900 ? 0.00000 {?} {362.HD21} 0.53400 0.06000 0.15500 ? 0.00000 {?} {362.CD2} 23.00900 0.51500 0.51500 EE 0.00000 {?} 12.94690 0.79020 0 {?} 0 1906 {?} 2.02200 0.03800 0.10000 ? 0.00000 {?} {?} 0.53400 0.09200 0.13600 ++ 0.00000 {?} {?} 23.00900 0.39500 0.39500 EE 0.00000 {?} 3.54290 0.16590 0 {?} 0 1907 {?} 3.67600 0.06100 0.06800 ++ 0.00000 {?} {?} 0.54700 0.08900 0.10500 ++ 0.00000 {?} {?} 23.00900 0.31300 0.31300 EE 0.00000 {?} 2.80740 0.11900 0 {?} 0 1908 {324.HZ3} 7.29400 0.05600 0.05600 ++ 0.00000 {?} {322.HB} 1.41200 0.10000 0.09200 ++ 0.00000 {?} {322.CB} 40.84700 0.24100 0.24100 EE 0.00000 {?} 0.74090 0.02930 0 {?} 0 1909 {322.HG21} -0.49200 0.05600 0.05200 ++ 0.00000 {?} {304.HD11} 0.96300 0.08100 0.07400 ++ 0.00000 {?} {304.CD1} 13.56500 0.23900 0.23900 EE 0.00000 {?} 0.86800 0.05940 0 {?} 0 1910 {322.HG21} -0.51900 0.09200 0.08200 ? 0.00000 {?} {324.HA} 4.49000 0.13200 0.13200 ++ 0.00000 {?} {324.CA} 58.16100 0.19000 0.19000 EE 0.00000 {?} 2.54700 0.07640 0 {?} 0 1911 {322.HG21} -0.50800 0.08300 0.07800 ++ 0.00000 {?} {362.HA} 4.46100 0.20000 0.18400 ++ 0.00000 {?} {362.CA} 52.91400 0.23300 0.23300 EE 0.00000 {?} 3.03500 0.08990 0 {?} 0 1912 {322.HG21} -0.51000 0.07000 0.06800 ++ 0.00000 {?} {300.HA} 4.16200 0.13600 0.12900 ++ 0.00000 {?} {300.CA} 62.88300 0.24400 0.24400 EE 0.00000 {?} 1.44090 0.06230 0 {?} 0 1913 {361.HB} 1.45500 0.05800 0.06200 ++ 0.00000 {?} {323.HB2} 2.10500 0.11300 0.12000 ++ 0.00000 {?} {323.CB} 40.32300 0.28700 0.28700 EE 0.00000 {?} 1.53880 0.04620 0 {?} 0 1914 {361.HB} 1.45100 0.10300 0.08600 ++ 0.00000 {?} {323.HB1} 2.86700 0.12800 0.11700 ++ 0.00000 {?} {323.CB} 40.32300 0.22400 0.22400 EE 0.00000 {?} 1.81740 0.06450 0 {?} 0 1915 {326.HG1} 2.43900 0.05100 0.06000 ++ 0.00000 {?} {361.HB} 1.46000 0.11400 0.11400 ? 0.00000 {?} {361.CB} 34.55100 0.31200 0.31200 EE 0.00000 {?} 1.83070 0.05080 0 {?} 0 1916 {320.HB1} 2.77600 0.06100 0.07400 ++ 0.00000 {?} {364.HA} 5.21100 0.09600 0.11500 ++ 0.00000 {?} {364.CA} 56.84900 0.32700 0.32700 EE 0.00000 {?} 2.31220 0.07390 0 {?} 0 1917 {319.HG21} 0.74400 0.06300 0.05900 ? 0.00000 {?} {364.HA} 5.20900 0.08500 0.07800 ++ 0.00000 {?} {364.CA} 56.84900 0.24000 0.24000 EE 0.00000 {?} 0.56000 0.04100 0 {?} 0 1918 {382.HD11} 0.10600 0.05000 0.05000 ++ 0.00000 {?} {364.HA} 5.20300 0.09500 0.09400 ++ 0.00000 {?} {364.CA} 56.84900 0.25600 0.25600 EE 0.00000 {?} 0.74010 0.03540 0 {?} 0 1919 {360.HA} 5.17400 0.05500 0.08000 ++ 0.00000 {?} {324.HA} 4.49300 0.07800 0.11300 ++ 0.00000 {?} {324.CA} 58.16100 0.39900 0.39900 EE 0.00000 {?} 2.84000 0.09310 0 {?} 0 1920 {339.HG2} 1.94000 0.05100 0.05800 ++ 0.00000 {?} {333.HA} 4.70700 0.09000 0.11300 ? 0.00000 {?} {333.CA} 54.75100 0.30600 0.30600 EE 0.00000 {?} 2.00350 0.08720 0 {?} 0 1921 {361.HG21} 0.22500 0.04200 0.07400 ++ 0.00000 {?} {326.HB2} 1.60400 0.03300 0.12200 ? 0.00000 {?} {326.CB} 35.07600 0.41600 0.41600 EE 0.00000 {?} 0.89570 0.05130 0 {?} 0 1922 {327.HA} 5.47400 0.02800 0.05500 ? 0.00000 {?} {358.HA} 4.61000 0.09500 0.09500 ? 0.00000 {?} {358.CA} 55.80000 0.33200 0.33200 EE 0.00000 {?} 0.53380 0.03310 0 {?} 0 1923 {327.HB2} 2.81300 0.06500 0.07800 ? 0.00000 {?} {328.HD1} 4.58600 0.05400 0.07900 ? 0.00000 {?} {328.CD} 50.55300 0.31600 0.31600 EE 0.00000 {?} 1.18730 0.05390 0 {?} 0 1924 {327.HB1} 3.14700 0.05700 0.05900 ++ 0.00000 {?} {328.HD1} 4.56800 0.09400 0.09900 ++ 0.00000 {?} {328.CD} 50.55300 0.28300 0.28300 EE 0.00000 {?} 1.22390 0.04990 0 {?} 0 1925 {?} 3.56600 0.03800 0.05100 ++ 0.00000 {?} {?} 4.56100 0.04200 0.07900 ? 0.00000 {?} {?} 50.55300 0.35800 0.35800 EE 0.00000 {?} 0.57140 0.04180 0 {?} 0 1926 {327.HA} 5.48400 0.04800 0.06500 ++ 0.00000 {?} {328.HD1} 4.58300 0.06100 0.15900 ? 0.00000 {?} {328.CD} 50.55300 0.38300 0.38300 EE 0.00000 {?} 1.23890 0.06930 0 {?} 0 1927 {328.HD1} 3.57800 0.04800 0.06600 ++ 0.00000 {?} {327.HB2} 2.80200 0.10500 0.12800 ++ 0.00000 {?} {327.CB} 39.01100 0.36300 0.36300 EE 0.00000 {?} 1.95930 0.07640 0 {?} 0 1928 {327.HA} 5.47600 0.05000 0.06400 ++ 0.00000 {?} {328.HD2} 3.55900 0.12000 0.15800 ++ 0.00000 {?} {328.CD} 50.55300 0.34500 0.34500 EE 0.00000 {?} 1.76140 0.05700 0 {?} 0 1929 {350.HB1} 3.47800 0.05400 0.06800 ++ 0.00000 {?} {352.HG1} 2.38200 0.11700 0.14900 ++ 0.00000 {?} {352.CG} 33.76400 0.34900 0.34900 EE 0.00000 {?} 2.14020 0.06740 0 {?} 0 1930 {343.HD11} 1.04500 0.03300 0.04900 ? 0.00000 {?} {329.HA} 4.48400 0.08400 0.11400 ++ 0.00000 {?} {329.CA} 57.11200 0.38600 0.38600 EE 0.00000 {?} 1.62310 0.09280 0 {?} 0 1931 {341.HB2} 3.94700 0.05300 0.08100 ++ 0.00000 {?} {329.HA} 4.48600 0.10600 0.14100 ++ 0.00000 {?} {329.CA} 57.11200 0.38000 0.38000 EE 0.00000 {?} 2.54690 0.09370 0 {?} 0 1932 {357.HD21} 0.82400 0.04700 0.07700 ? 0.00000 {?} {329.HB1} 2.06900 0.11200 0.17800 ? 0.00000 {?} {329.CB} 31.66600 0.42400 0.42400 EE 0.00000 {?} 4.73100 0.08750 0 {?} 0 1933 {329.HG2} 1.55500 0.02700 0.10200 ? 0.00000 {?} {329.HE1} 3.10900 0.06900 0.13400 ? 0.00000 {?} {329.CE} 41.37200 0.48200 0.48200 EE 0.00000 {?} 7.36990 0.36320 0 {?} 0 1934 {329.HA} 4.48700 0.03800 0.07500 ? 0.00000 {?} {329.HE1} 3.11200 0.03700 0.11400 ? 0.00000 {?} {329.CE} 41.37200 0.43900 0.43900 EE 0.00000 {?} 2.80710 0.17520 0 {?} 0 1935 {329.HD1} 1.87400 0.04600 0.08900 ? 0.00000 {?} {357.HD11} 1.00300 0.06700 0.17300 ? 0.00000 {?} {357.CD1} 25.43200 0.51900 0.51900 EE 0.00000 {?} 84.39690 2.12700 0 {?} 0 1936 {329.HB1} 2.10800 0.04800 0.07400 ? 0.00000 {?} {357.HD21} 0.81200 0.07000 0.07000 ? 0.00000 {?} {357.CD2} 23.27100 0.38800 0.38800 EE 0.00000 {?} 2.48180 0.11300 0 {?} 0 1937 {357.HD21} 0.80200 0.05000 0.07500 ++ 0.00000 {?} {355.HA} 4.48100 0.07200 0.09500 ++ 0.00000 {?} {355.CA} 63.14500 0.36100 0.36100 EE 0.00000 {?} 1.85850 0.07970 0 {?} 0 1938 {339.HG2} 1.92500 0.03900 0.05500 ++ 0.00000 {?} {331.HG21} 0.96700 0.06400 0.11000 ? 0.00000 {?} {331.CG2} 21.17300 0.44000 0.44000 EE 0.00000 {?} 5.88610 0.23960 0 {?} 0 1939 {331.HG21} 0.96400 0.03100 0.07600 ? 0.00000 {?} {339.HG2} 1.93000 0.03900 0.09400 ? 0.00000 {?} {339.CG} 36.91200 0.50100 0.50100 EE 0.00000 {?} 5.58610 0.35320 0 {?} 0 1940 {332.HD1} 6.32000 0.06600 0.06600 ? 0.00000 {?} {332.HA} 4.78200 0.10000 0.13400 ++ 0.00000 {?} {332.CA} 55.01300 0.33600 0.33600 EE 0.00000 {?} 1.69290 0.04700 0 {?} 0 1941 {332.HD1} 6.31400 0.04900 0.04900 ? 0.00000 {?} {332.HB2} 2.65200 0.10100 0.15100 ++ 0.00000 {?} {332.CB} 41.37200 0.38100 0.38100 EE 0.00000 {?} 1.67130 0.05830 0 {?} 0 1942 {338.HB1} 3.84900 0.06000 0.08900 ++ 0.00000 {?} {334.HE1} 2.88400 0.08900 0.11600 ++ 0.00000 {?} {334.CE} 41.37200 0.43300 0.43300 EE 0.00000 {?} 2.85440 0.06370 0 {?} 0 1943 {333.HE1} 2.97100 0.02800 0.09100 ? 0.00000 {?} {333.HD1} 1.64500 0.07300 0.15600 ? 0.00000 {?} {333.CD} 29.30500 0.51900 0.51900 EE 0.00000 {?} 73.15120 2.06950 0 {?} 0 1944 {354.HA} 3.80900 0.05200 0.06800 ++ 0.00000 {?} {386.HD11} 0.28400 0.08500 0.11500 ? 0.00000 {?} {386.CD1} 25.89500 0.36800 0.36800 EE 0.00000 {?} 2.00740 0.07510 0 {?} 0 1945 {346.HB1} 3.05000 0.04800 0.06700 ++ 0.00000 {?} {386.HD11} 0.28100 0.05000 0.08400 ++ 0.00000 {?} {386.CD1} 25.89500 0.38900 0.38900 EE 0.00000 {?} 1.13390 0.06110 0 {?} 0 1946 {346.HB2} 2.92100 0.05300 0.07000 ++ 0.00000 {?} {386.HD11} 0.28300 0.04800 0.07800 ++ 0.00000 {?} {386.CD1} 25.89500 0.38800 0.38800 EE 0.00000 {?} 1.23110 0.06330 0 {?} 0 1947 {352.HG1} 2.37600 0.04400 0.06500 ++ 0.00000 {?} {386.HD11} 0.27900 0.05200 0.10200 ++ 0.00000 {?} {386.CD1} 25.89500 0.42800 0.42800 EE 0.00000 {?} 1.63640 0.08660 0 {?} 0 1948 {333.HD1} 1.64700 0.06900 0.06900 ? 0.00000 {?} {339.HA} 4.99000 0.05900 0.12000 ? 0.00000 {?} {339.CA} 55.01300 0.44400 0.44400 EE 0.00000 {?} 2.18170 0.06380 0 {?} 0 1949 {339.HA} 4.99000 0.04200 0.08200 ++ 0.00000 {?} {333.HG1} 1.35900 0.06800 0.12300 ? 0.00000 {?} {333.CG} 25.10800 0.46400 0.46400 EE 0.00000 {?} 5.09380 0.15660 0 {?} 0 1950 {340.HB} 1.77900 0.08400 0.08400 ? 0.00000 {?} {344.HB2} 2.08900 0.07900 0.12100 ? 0.00000 {?} {344.CB} 29.83000 0.46400 0.46400 EE 0.00000 {?} 11.21970 0.11990 0 {?} 0 1951 {340.HB} 1.77900 0.06100 0.09600 ? 0.00000 {?} {344.HB1} 2.15700 0.02900 0.09300 ? 0.00000 {?} {344.CB} 29.83000 0.45300 0.45300 EE 0.00000 {?} 4.37810 0.19340 0 {?} 0 1952 {319.HG11} 0.81000 0.03400 0.06100 ? 0.00000 {?} {364.HA} 5.20900 0.08300 0.09200 ++ 0.00000 {?} {364.CA} 56.84900 0.28600 0.28600 EE 0.00000 {?} 0.78010 0.04410 0 {?} 0 1953 {342.HB1} 3.68600 0.03700 0.08300 ++ 0.00000 {?} {342.HA} 4.57900 0.03900 0.09600 ? 0.00000 {?} {342.CA} 63.93200 0.45200 0.45200 EE 0.00000 {?} 1.13560 0.07130 0 {?} 0 1954 {357.HD21} 0.85100 0.04200 0.04500 ++ 0.00000 {?} {343.HB1} 1.84300 0.08600 0.09500 ++ 0.00000 {?} {343.CB} 43.73300 0.29900 0.29900 EE 0.00000 {?} 0.75000 0.03370 0 {?} 0 1955 {343.HA} 4.20000 0.04400 0.06200 ++ 0.00000 {?} {354.HG21} 0.81400 0.06800 0.09000 ++ 0.00000 {?} {354.CG2} 18.28700 0.38400 0.38400 EE 0.00000 {?} 1.89400 0.09770 0 {?} 0 1956 {383.HA} 4.55000 0.06000 0.07600 ++ 0.00000 {?} {354.HD11} 0.92900 0.06200 0.11000 ++ 0.00000 {?} {354.CD1} 15.13900 0.41700 0.41700 EE 0.00000 {?} 3.56750 0.14630 0 {?} 0 1957 {383.HA} 4.55500 0.03800 0.07400 ? 0.00000 {?} {354.HG21} 0.81100 0.06600 0.10000 ++ 0.00000 {?} {354.CG2} 18.28700 0.43300 0.43300 EE 0.00000 {?} 3.88450 0.16920 0 {?} 0 1958 {386.HD11} 0.27900 0.04100 0.06600 ? 0.00000 {?} {354.HG21} 0.81300 0.06300 0.10000 ++ 0.00000 {?} {354.CG2} 18.28700 0.38300 0.38300 EE 0.00000 {?} 1.41150 0.08900 0 {?} 0 1959 {383.HD11} 0.15900 0.02400 0.06400 ? 0.00000 {?} {354.HG21} 0.81000 0.03700 0.09600 ? 0.00000 {?} {354.CG2} 18.28700 0.48600 0.48600 EE 0.00000 {?} 1.93880 0.15230 0 {?} 0 1960 {383.HG11} 1.22300 0.04400 0.07200 ++ 0.00000 {?} {354.HD11} 0.93100 0.06100 0.10100 ++ 0.00000 {?} {354.CD1} 15.13900 0.43500 0.43500 EE 0.00000 {?} 2.44190 0.11480 0 {?} 0 1961 {343.HB1} 1.81500 0.02900 0.08800 ? 0.00000 {?} {354.HD11} 0.92000 0.05400 0.07100 ++ 0.00000 {?} {354.CD1} 15.13900 0.38100 0.38100 EE 0.00000 {?} 1.22790 0.12410 0 {?} 0 1962 {340.HG21} 0.80700 0.06100 0.07200 ? 0.00000 {?} {344.HG1} 2.34300 0.03800 0.08100 ? 0.00000 {?} {344.CG} 36.38800 0.34900 0.35000 EE 0.00000 {?} 1.60070 0.09590 0 {?} 0 1963 {312.HE1} 6.69400 0.03600 0.04700 ? 0.00000 {?} {346.HA} 3.81200 0.09900 0.10800 ++ 0.00000 {?} {346.CA} 65.03800 0.29700 0.29700 EE 0.00000 {?} 0.82770 0.03490 0 {?} 0 1964 {386.HD11} 0.28500 0.04800 0.05700 ++ 0.00000 {?} {346.HB2} 2.93200 0.12700 0.14700 ? 0.00000 {?} {346.CB} 37.17500 0.30600 0.30600 EE 0.00000 {?} 1.45020 0.04430 0 {?} 0 1965 {354.HD11} 0.92900 0.03100 0.06000 ? 0.00000 {?} {346.HB2} 2.92900 0.13300 0.13100 ? 0.00000 {?} {346.CB} 37.17500 0.25700 0.25700 EE 0.00000 {?} 1.67740 0.09280 0 {?} 0 1966 {?} 7.19200 0.04300 0.07500 ? 0.00000 {?} {?} 3.20000 0.06600 0.08000 ++ 0.00000 {?} {?} 43.20800 0.31500 0.31500 EE 0.00000 {?} 0.83460 0.04470 0 {?} 0 1967 {?} 7.34800 0.05100 0.06600 ++ 0.00000 {?} {?} 3.18800 0.06300 0.08500 ++ 0.00000 {?} {?} 43.20800 0.36500 0.36500 EE 0.00000 {?} 1.06550 0.05770 0 {?} 0 1968 {?} 7.45900 0.05100 0.07200 ++ 0.00000 {?} {?} 3.19300 0.05000 0.06600 ++ 0.00000 {?} {?} 43.20800 0.37300 0.37300 EE 0.00000 {?} 0.53540 0.03200 0 {?} 0 1969 {350.HD1} 6.93000 0.03900 0.04100 ++ 0.00000 {?} {349.HA} 3.76300 0.07000 0.07100 ++ 0.00000 {?} {349.CA} 56.84900 0.27400 0.27400 EE 0.00000 {?} 0.44900 0.02890 0 {?} 0 1970 {347.HA} 4.15200 0.04500 0.05100 ++ 0.00000 {?} {351.HB1} 3.27100 0.08300 0.10200 ++ 0.00000 {?} {351.CB} 37.43700 0.31500 0.31500 EE 0.00000 {?} 1.16990 0.05350 0 {?} 0 1971 {347.HA} 4.14100 0.04200 0.04600 ++ 0.00000 {?} {351.HB2} 2.80400 0.09000 0.09800 ++ 0.00000 {?} {351.CB} 37.43700 0.29100 0.29100 EE 0.00000 {?} 0.84440 0.03800 0 {?} 0 1972 {386.HD11} 0.28100 0.04200 0.04400 ++ 0.00000 {?} {352.HG1} 2.38300 0.06300 0.06500 ++ 0.00000 {?} {352.CG} 33.50200 0.27100 0.27100 EE 0.00000 {?} 0.38800 0.02690 0 {?} 0 1973 {386.HD11} 0.28200 0.04300 0.04800 ++ 0.00000 {?} {352.HG2} 1.97400 0.07000 0.07700 ++ 0.00000 {?} {352.CG} 33.50200 0.30500 0.30500 EE 0.00000 {?} 0.45310 0.03360 0 {?} 0 1974 {386.HD21} 0.84100 0.05200 0.07200 ++ 0.00000 {?} {352.HG2} 1.97400 0.03800 0.12500 ? 0.00000 {?} {352.CG} 33.50200 0.40100 0.40100 EE 0.00000 {?} 0.95030 0.05610 0 {?} 0 1975 {352.HB1} 2.06600 0.02500 0.07700 ? 0.00000 {?} {386.HD11} 0.28300 0.04100 0.11300 ? 0.00000 {?} {386.CD1} 25.89500 0.49100 0.49100 EE 0.00000 {?} 3.27480 0.21340 0 {?} 0 1976 {386.HB1} 2.07600 0.05200 0.10100 ? 0.00000 {?} {386.HD21} 0.84000 0.03900 0.10200 ? 0.00000 {?} {386.CD2} 22.22200 0.50000 0.50000 EE 0.00000 {?} 7.45850 0.28840 0 {?} 0 1977 {386.HD11} 0.27600 0.03300 0.03800 ++ 0.00000 {?} {352.HB2} 1.68200 0.09000 0.10200 ++ 0.00000 {?} {352.CB} 31.40300 0.31300 0.31300 EE 0.00000 {?} 0.75700 0.04350 0 {?} 0 1978 {386.HD11} 0.28300 0.04700 0.05100 ++ 0.00000 {?} {352.HB1} 2.09100 0.07800 0.08300 ++ 0.00000 {?} {352.CB} 31.40300 0.28400 0.28400 EE 0.00000 {?} 1.17830 0.06090 0 {?} 0 1979 {353.HB1} 1.94800 0.05900 0.08100 ++ 0.00000 {?} {355.HG21} 1.21100 0.07000 0.12600 ++ 0.00000 {?} {355.CG2} 21.43500 0.43600 0.43600 EE 0.00000 {?} 16.50210 0.41530 0 {?} 0 1980 {355.HA} 4.49200 0.02700 0.06300 ? 0.00000 {?} {353.HG1} 2.11800 0.07500 0.11800 ++ 0.00000 {?} {353.CG} 35.33800 0.43800 0.43800 EE 0.00000 {?} 3.74480 0.14630 0 {?} 0 1981 {343.HD11} 1.04600 0.04100 0.06800 ? 0.00000 {?} {353.HG1} 2.12400 0.07000 0.10200 ++ 0.00000 {?} {353.CG} 35.33800 0.37900 0.37900 EE 0.00000 {?} 1.03030 0.06170 0 {?} 0 1982 {386.HD11} 0.28500 0.05000 0.05400 ++ 0.00000 {?} {354.HA} 3.78000 0.10100 0.11500 ++ 0.00000 {?} {354.CA} 61.57100 0.29400 0.29400 EE 0.00000 {?} 1.32510 0.05670 0 {?} 0 1983 {354.HA} 3.78100 0.05600 0.07800 ++ 0.00000 {?} {386.HD21} 0.84300 0.07600 0.11200 ++ 0.00000 {?} {386.CD2} 22.22200 0.43100 0.43100 EE 0.00000 {?} 3.04530 0.09810 0 {?} 0 1984 {386.HD11} 0.28400 0.05500 0.07100 ++ 0.00000 {?} {354.HG11} 1.71400 0.09900 0.12300 ++ 0.00000 {?} {354.CG1} 28.58000 0.33800 0.33800 EE 0.00000 {?} 0.97700 0.05370 0 {?} 0 1985 {386.HD11} 0.28200 0.05100 0.05700 ++ 0.00000 {?} {354.HG12} 0.59600 0.08900 0.11100 ++ 0.00000 {?} {354.CG1} 28.58000 0.31400 0.31400 EE 0.00000 {?} 1.48520 0.05770 0 {?} 0 1986 {354.HG12} 0.60900 0.06800 0.08800 ? 0.00000 {?} {386.HD11} 0.28000 0.07700 0.12200 ++ 0.00000 {?} {386.CD1} 25.89500 0.41200 0.41200 EE 0.00000 {?} 5.74900 0.13530 0 {?} 0 1987 {383.HG21} 0.71600 0.05700 0.08300 ? 0.00000 {?} {386.HD11} 0.28400 0.05400 0.12600 ? 0.00000 {?} {386.CD1} 25.89500 0.44500 0.44500 EE 0.00000 {?} 7.14080 0.25400 0 {?} 0 1988 {386.HD11} 0.27200 0.04500 0.04500 ++ 0.00000 {?} {354.HB} 1.68100 0.07200 0.12200 ? 0.00000 {?} {354.CB} 39.53600 0.26000 0.26000 EE 0.00000 {?} 0.82770 0.04700 0 {?} 0 1989 {328.HD1} 3.57300 0.06700 0.09000 ++ 0.00000 {?} {357.HD21} 0.80800 0.03800 0.08300 ? 0.00000 {?} {357.CD2} 23.27100 0.36600 0.36600 EE 0.00000 {?} 2.42770 0.11440 0 {?} 0 1990 {359.HA} 4.53500 0.05800 0.06800 ? 0.00000 {?} {359.HB1} 2.21900 0.03100 0.08500 ? 0.00000 {?} {359.CB} 29.04300 0.35500 0.35500 EE 0.00000 {?} 0.52260 0.06580 0 {?} 0 1991 {322.HG12} 0.60000 0.04200 0.06000 ++ 0.00000 {?} {362.HA} 4.46500 0.10600 0.13700 ? 0.00000 {?} {362.CA} 52.91400 0.37500 0.37500 EE 0.00000 {?} 2.66760 0.09270 0 {?} 0 1992 {362.HB2} 1.18500 0.06200 0.08500 ? 0.00000 {?} {362.HA} 4.45500 0.08400 0.12200 ++ 0.00000 {?} {362.CA} 52.91400 0.37400 0.37400 EE 0.00000 {?} 3.11530 0.10290 0 {?} 0 1993 {322.HG11} 1.30600 0.05000 0.07500 ? 0.00000 {?} {362.HA} 4.46300 0.08900 0.12600 ? 0.00000 {?} {362.CA} 52.91400 0.37800 0.37800 EE 0.00000 {?} 3.68090 0.16550 0 {?} 0 1994 {362.HG} 1.40100 0.05300 0.07000 ++ 0.00000 {?} {362.HA} 4.46300 0.08500 0.11400 ++ 0.00000 {?} {362.CA} 52.91400 0.36500 0.36500 EE 0.00000 {?} 2.30910 0.08200 0 {?} 0 1995 {382.HD11} 0.11400 0.04800 0.05000 ++ 0.00000 {?} {362.HB2} 1.17300 0.09100 0.09500 ++ 0.00000 {?} {362.CB} 42.15900 0.27600 0.27600 EE 0.00000 {?} 1.10810 0.04950 0 {?} 0 1996 {382.HD11} 0.11000 0.04900 0.06700 ? 0.00000 {?} {362.HB1} 1.69700 0.08900 0.11700 ++ 0.00000 {?} {362.CB} 42.15900 0.33000 0.33000 EE 0.00000 {?} 1.14340 0.05040 0 {?} 0 1997 {382.HD21} 0.06900 0.04900 0.04900 ? 0.00000 {?} {362.HB1} 1.70100 0.07200 0.08500 ++ 0.00000 {?} {362.CB} 42.15900 0.31700 0.31700 EE 0.00000 {?} 1.03150 0.04380 0 {?} 0 1998 {362.HG} 1.40000 0.04300 0.06800 ? 0.00000 {?} {362.HB2} 1.16900 0.12300 0.14800 ++ 0.00000 {?} {362.CB} 42.15900 0.34200 0.34200 EE 0.00000 {?} 2.35810 0.08610 0 {?} 0 1999 {308.HG11} 0.64200 0.04900 0.04900 ? 0.00000 {?} {382.HD11} 0.10200 0.07700 0.13500 ++ 0.00000 {?} {382.CD1} 25.10800 0.42700 0.42700 EE 0.00000 {?} 5.30380 0.15260 0 {?} 0 2000 {319.HG11} 0.81600 0.03600 0.06000 ? 0.00000 {?} {382.HD11} 0.10200 0.05500 0.15400 ? 0.00000 {?} {382.CD1} 25.10800 0.49500 0.49500 EE 0.00000 {?} 6.15140 0.28300 0 {?} 0 2001 {362.HD21} 0.53800 0.04400 0.05100 ? 0.00000 {?} {382.HD11} 0.09500 0.06800 0.08700 ++ 0.00000 {?} {382.CD1} 25.10800 0.33400 0.33400 EE 0.00000 {?} 1.14520 0.06250 0 {?} 0 2002 {362.HD11} 0.75600 0.02700 0.04500 ? 0.00000 {?} {382.HD11} 0.10200 0.05100 0.14100 ? 0.00000 {?} {382.CD1} 25.10800 0.50000 0.50000 EE 0.00000 {?} 6.95100 0.38330 0 {?} 0 2003 {362.HD21} 0.53500 0.06300 0.07200 ? 0.00000 {?} {319.HB} 2.48300 0.07500 0.09200 ++ 0.00000 {?} {319.CB} 30.84100 0.32800 0.32800 EE 0.00000 {?} 1.28940 0.04860 0 {?} 0 2004 {283.HE1} 1.93700 0.05400 0.09000 ? 0.00000 {?} {362.HD11} 0.68200 0.05700 0.08900 ? 0.00000 {?} {362.CD1} 25.18000 0.44800 0.44800 EE 0.00000 {?} 7.02390 0.25450 0 {?} 0 2005 {384.HA} 3.80100 0.03400 0.04300 ++ 0.00000 {?} {362.HD21} 0.54500 0.06600 0.09000 ++ 0.00000 {?} {362.CD2} 23.00900 0.38500 0.38500 EE 0.00000 {?} 0.74290 0.05080 0 {?} 0 2006 {384.HD1} 4.17300 0.09700 0.09700 ? 0.00000 {?} {362.HD11} 0.68300 0.06700 0.13900 ? 0.00000 {?} {362.CD1} 25.18000 0.40600 0.40600 EE 0.00000 {?} 6.55670 0.13800 0 {?} 0 2007 {362.HD21} 0.53600 0.06000 0.06000 ++ 0.00000 {?} {384.HA} 3.80600 0.10800 0.11000 ++ 0.00000 {?} {384.CA} 67.65000 0.26700 0.26700 EE 0.00000 {?} 1.50860 0.06480 0 {?} 0 2008 {360.HG1} 0.77800 0.05100 0.06700 ++ 0.00000 {?} {360.HD1} 3.68600 0.05600 0.08200 ++ 0.00000 {?} {360.CD} 48.45500 0.38200 0.38200 EE 0.00000 {?} 1.00400 0.05430 0 {?} 0 2009 {360.HB2} 0.95500 0.04400 0.04400 ++ 0.00000 {?} {360.HD1} 3.69400 0.05500 0.05600 ++ 0.00000 {?} {360.CD} 48.45500 0.26900 0.26900 EE 0.00000 {?} 0.51510 0.03300 0 {?} 0 2010 {359.HB1} 2.22500 0.05400 0.06900 ++ 0.00000 {?} {360.HD1} 3.69200 0.07000 0.07800 ++ 0.00000 {?} {360.CD} 48.45500 0.31200 0.31200 EE 0.00000 {?} 1.09890 0.03360 0 {?} 0 2011 {360.HD2} 3.21800 0.05100 0.09300 ++ 0.00000 {?} {360.HD1} 3.67100 0.06300 0.09100 ? 0.00000 {?} {360.CD} 48.45500 0.38600 0.38600 EE 0.00000 {?} 1.86600 0.08810 0 {?} 0 2012 {360.HD1} 3.68700 0.04600 0.07100 ? 0.00000 {?} {360.HD2} 3.25600 0.05400 0.12300 ? 0.00000 {?} {360.CD} 48.45500 0.41100 0.41100 EE 0.00000 {?} 1.19180 0.04700 0 {?} 0 2013 {359.HB1} 2.23000 0.09800 0.10900 ++ 0.00000 {?} {360.HD2} 3.24000 0.09000 0.10000 ++ 0.00000 {?} {360.CD} 48.45500 0.28900 0.28900 EE 0.00000 {?} 2.18320 0.05320 0 {?} 0 2014 {360.HG1} 0.77600 0.05100 0.06300 ++ 0.00000 {?} {360.HD2} 3.24700 0.09400 0.11700 ++ 0.00000 {?} {360.CD} 48.45500 0.33500 0.33500 EE 0.00000 {?} 1.60180 0.05720 0 {?} 0 2015 {365.HG1} 2.40600 0.05300 0.07500 ? 0.00000 {?} {363.HG21} 0.90200 0.06500 0.08200 ++ 0.00000 {?} {363.CG2} 21.17300 0.43000 0.43000 EE 0.00000 {?} 7.41540 0.23620 0 {?} 0 2016 {364.HA} 5.21300 0.04300 0.05900 ++ 0.00000 {?} {320.HB2} 2.48400 0.07300 0.12400 ? 0.00000 {?} {320.CB} 43.73300 0.35300 0.35300 EE 0.00000 {?} 1.37400 0.06610 0 {?} 0 2017 {364.HA} 5.20400 0.03700 0.05100 ++ 0.00000 {?} {320.HB1} 2.76900 0.08500 0.11500 ? 0.00000 {?} {320.CB} 43.73300 0.39100 0.39100 EE 0.00000 {?} 1.44510 0.06570 0 {?} 0 2018 {364.HA} 5.21000 0.05300 0.07200 ++ 0.00000 {?} {380.HB1} 1.24700 0.08400 0.11500 ++ 0.00000 {?} {380.CB} 19.83000 0.39100 0.39100 EE 0.00000 {?} 1.75370 0.07150 0 {?} 0 2019 {372.HG1} 2.06700 0.06200 0.08800 ++ 0.00000 {?} {371.HA1} 4.23300 0.06000 0.10500 ? 0.00000 {?} {371.CA} 44.25800 0.42600 0.42600 EE 0.00000 {?} 3.29790 0.10970 0 {?} 0 2020 {372.HG1} 2.08300 0.04500 0.05800 ++ 0.00000 {?} {371.HA2} 4.07600 0.06800 0.11400 ? 0.00000 {?} {371.CA} 44.25800 0.39800 0.39800 EE 0.00000 {?} 3.30000 0.12480 0 {?} 0 2021 {371.HA2} 4.08700 0.04600 0.07900 ? 0.00000 {?} {372.HG1} 2.08200 0.06800 0.14300 ++ 0.00000 {?} {372.CG} 27.20600 0.46800 0.46800 EE 0.00000 {?} 8.46410 0.22400 0 {?} 0 2022 {366.HD1} 3.87500 0.04700 0.06900 ? 0.00000 {?} {366.HB2} 2.03400 0.05700 0.12500 ? 0.00000 {?} {366.CB} 32.45300 0.42700 0.42700 EE 0.00000 {?} 1.75040 0.07510 0 {?} 0 2023 {366.HD2} 3.81600 0.03900 0.03900 ? 0.00000 {?} {365.HB1} 2.16900 0.07000 0.09700 ++ 0.00000 {?} {365.CB} 28.78000 0.40400 0.40400 EE 0.00000 {?} 1.08700 0.04850 0 {?} 0 2024 {379.HD2} 3.67400 0.04900 0.10400 ? 0.00000 {?} {378.HA2} 3.90800 0.08000 0.17500 ? 0.00000 {?} {378.CA} 44.25800 0.48300 0.48300 EE 0.00000 {?} 7.89200 0.17720 0 {?} 0 2025 {?} 2.05400 0.04400 0.06400 ? 0.00000 {?} {?} 3.93100 0.08100 0.11100 ++ 0.00000 {?} {?} 43.99500 0.35900 0.35900 EE 0.00000 {?} 1.06680 0.04210 0 {?} 0 2026 {280.HD21} 0.95100 0.06000 0.08900 ++ 0.00000 {?} {284.HB1} 3.30200 0.08700 0.12500 ++ 0.00000 {?} {284.CB} 38.74900 0.41000 0.41000 EE 0.00000 {?} 4.55990 0.13240 0 {?} 0 2027 {?} 1.04400 0.03500 0.05900 ? 0.00000 {?} {?} 3.22500 0.07200 0.10400 ++ 0.00000 {?} {?} 43.20800 0.39200 0.39200 EE 0.00000 {?} 2.01250 0.12710 0 {?} 0 2028 {363.HG11} 0.79600 0.04900 0.06200 ? 0.00000 {?} {379.HG1} 2.03000 0.05000 0.09700 ? 0.00000 {?} {379.CG} 27.29600 0.41200 0.41200 EE 0.00000 {?} 1.71010 0.08020 0 {?} 0 2029 {382.HD21} 0.09900 0.02200 0.03200 ++ 0.00000 {?} {380.HA} 4.49500 0.09500 0.13000 ++ 0.00000 {?} {380.CA} 51.34000 0.35600 0.35600 EE 0.00000 {?} 0.60590 0.03930 0 {?} 0 2030 {379.HA} 4.55600 0.03500 0.09500 ? 0.00000 {?} {380.HB1} 1.24500 0.06700 0.15500 ? 0.00000 {?} {380.CB} 19.83000 0.45800 0.45800 EE 0.00000 {?} 5.48250 0.21420 0 {?} 0 2031 {342.HE1} 7.08900 0.06200 0.07000 ? 0.00000 {?} {381.HG1} 2.69100 0.07200 0.08700 ++ 0.00000 {?} {381.CG} 32.71500 0.32300 0.32300 EE 0.00000 {?} 1.21950 0.04940 0 {?} 0 2032 {342.HZ} 7.21300 0.03300 0.08600 ? 0.00000 {?} {381.HG1} 2.71600 0.06300 0.09300 ++ 0.00000 {?} {381.CG} 32.71500 0.37600 0.37600 EE 0.00000 {?} 0.62260 0.04030 0 {?} 0 2033 {381.HA} 5.09600 0.05700 0.09100 ? 0.00000 {?} {381.HE1} 2.04000 0.05500 0.09500 ++ 0.00000 {?} {381.CE} 18.12500 0.45500 0.45500 EE 0.00000 {?} 2.28850 0.10060 0 {?} 0 2034 {342.HE1} 7.10900 0.07500 0.07700 ? 0.00000 {?} {381.HE1} 2.04700 0.05600 0.08500 ++ 0.00000 {?} {381.CE} 18.12500 0.38100 0.38100 EE 0.00000 {?} 1.94180 0.08110 0 {?} 0 2035 {342.HZ} 7.21200 0.02900 0.06800 ? 0.00000 {?} {381.HE1} 2.04000 0.05000 0.09000 ? 0.00000 {?} {381.CE} 18.12500 0.43900 0.43900 EE 0.00000 {?} 1.59110 0.12620 0 {?} 0 2036 {312.HE1} 6.73300 0.02300 0.07800 ? 0.00000 {?} {382.HA} 4.58700 0.06900 0.14600 ? 0.00000 {?} {382.CA} 52.39000 0.38500 0.38500 EE 0.00000 {?} 0.74420 0.06460 0 {?} 0 2037 {317.HD1} 6.84500 0.06000 0.06500 ++ 0.00000 {?} {382.HA} 4.59300 0.09200 0.10300 ++ 0.00000 {?} {382.CA} 52.39000 0.29000 0.29000 EE 0.00000 {?} 1.32290 0.04370 0 {?} 0 2038 {362.HB1} 1.69800 0.04400 0.06100 ++ 0.00000 {?} {382.HA} 4.60600 0.06900 0.10500 ? 0.00000 {?} {382.CA} 52.39000 0.38400 0.38400 EE 0.00000 {?} 2.21020 0.09170 0 {?} 0 2039 {362.HD11} 0.70600 0.05700 0.07100 ++ 0.00000 {?} {382.HB2} 1.04100 0.10400 0.12800 ++ 0.00000 {?} {382.CB} 45.30700 0.34400 0.34400 EE 0.00000 {?} 1.91120 0.06560 0 {?} 0 2040 {383.HG21} 0.71900 0.05200 0.06500 ? 0.00000 {?} {386.HA} 4.58600 0.04900 0.10800 ? 0.00000 {?} {386.CA} 52.65000 0.36400 0.36400 EE 0.00000 {?} 1.44580 0.07490 0 {?} 0 2041 {308.HG21} 0.72600 0.06800 0.06600 ++ 0.00000 {?} {382.HD21} 0.05700 0.07800 0.12700 ? 0.00000 {?} {382.CD2} 22.17000 0.25100 0.25100 EE 0.00000 {?} 2.86560 0.11120 0 {?} 0 2042 {383.HD11} 0.15900 0.05400 0.05600 ++ 0.00000 {?} {384.HD1} 4.19100 0.11500 0.15000 ? 0.00000 {?} {384.CD} 52.91400 0.28600 0.28600 EE 0.00000 {?} 1.91270 0.06410 0 {?} 0 2043 {383.HG21} 0.70300 0.06600 0.09300 ++ 0.00000 {?} {384.HD1} 4.19100 0.11300 0.14500 ? 0.00000 {?} {384.CD} 52.91400 0.37300 0.37300 EE 0.00000 {?} 2.79130 0.07100 0 {?} 0 2044 {284.HD1} 7.32300 0.07700 0.07400 ? 0.00000 {?} {280.HD11} 0.96000 0.09800 0.09200 ++ 0.00000 {?} {280.CD1} 25.63500 0.24400 0.24400 EE 0.00000 {?} 4.10880 0.18330 0 {?} 0 2045 {385.HA} 3.99900 0.03600 0.08800 ? 0.00000 {?} {280.HD11} 0.95400 0.05200 0.12700 ? 0.00000 {?} {280.CD1} 25.63500 0.47000 0.47000 EE 0.00000 {?} 4.45220 0.26200 0 {?} 0 2046 {320.HB2} 2.48600 0.04900 0.08000 ? 0.00000 {?} {363.HG21} 0.90600 0.05400 0.09000 ++ 0.00000 {?} {363.CG2} 21.17300 0.39900 0.39900 EE 0.00000 {?} 4.62970 0.18440 0 {?} 0 2047 {308.HB} 1.96300 0.03500 0.04000 ++ 0.00000 {?} {387.HA} 5.02800 0.08200 0.09500 ++ 0.00000 {?} {387.CA} 57.89900 0.30300 0.30300 EE 0.00000 {?} 0.69430 0.04910 0 {?} 0 2048 {312.HE1} 6.73000 0.03700 0.08500 ? 0.00000 {?} {386.HB2} 1.99000 0.13200 0.22200 ? 0.00000 {?} {386.CB} 42.42100 0.42500 0.42500 EE 0.00000 {?} 4.51300 0.10510 0 {?} 0 2049 {312.HE1} 6.71500 0.05200 0.05100 ++ 0.00000 {?} {386.HG} 1.19900 0.10000 0.09800 ++ 0.00000 {?} {386.CG} 27.46900 0.25800 0.25800 EE 0.00000 {?} 0.70980 0.04130 0 {?} 0 2050 {312.HD1} 6.61500 0.11300 0.11300 ++ 0.00000 {?} {386.HD21} 0.83900 0.10100 0.08400 ++ 0.00000 {?} {386.CD2} 21.96000 0.17600 0.17600 EE 0.00000 {?} 2.47290 0.06160 0 {?} 0 2051 {388.HE1} 6.83000 0.03600 0.04200 ++ 0.00000 {?} {388.HB1} 3.08500 0.10100 0.12500 ++ 0.00000 {?} {388.CB} 40.06000 0.30800 0.30800 EE 0.00000 {?} 0.94270 0.04250 0 {?} 0 2052 {388.HE1} 6.83100 0.03800 0.05100 ++ 0.00000 {?} {388.HB2} 2.82200 0.07900 0.09800 ++ 0.00000 {?} {388.CB} 40.06000 0.31900 0.31900 EE 0.00000 {?} 0.56490 0.03550 0 {?} 0 2053 {276.HB1} 3.87400 0.03300 0.06700 ? 0.00000 {?} {389.HD11} 0.66000 0.06200 0.12800 ++ 0.00000 {?} {389.CD1} 25.63200 0.41200 0.41200 EE 0.00000 {?} 1.88730 0.10560 0 {?} 0 2054 {316.HG21} 1.03400 0.04700 0.05900 ++ 0.00000 {?} {390.HB} 4.26400 0.08500 0.11500 ++ 0.00000 {?} {390.CB} 71.27700 0.34600 0.34600 EE 0.00000 {?} 1.44280 0.06640 0 {?} 0 2055 {390.HG21} 1.21500 0.03900 0.10400 ? 0.00000 {?} {316.HG21} 1.04100 0.02700 0.10000 ? 0.00000 {?} {316.CG2} 22.02200 0.51000 0.51000 EE 0.00000 {?} 24.09040 1.64920 0 {?} 0 2056 {390.HB} 4.25400 0.05800 0.06200 ++ 0.00000 {?} {316.HG21} 1.04400 0.09400 0.10300 ? 0.00000 {?} {316.CG2} 22.02200 0.29000 0.29000 EE 0.00000 {?} 2.15060 0.06860 0 {?} 0 2057 {282.HA} 4.32600 0.04300 0.07000 ? 0.00000 {?} {389.HD11} 0.65800 0.05100 0.09300 ? 0.00000 {?} {389.CD1} 25.27300 0.44300 0.44300 EE 0.00000 {?} 2.52590 0.14340 0 {?} 0 2058 {274.HG} 1.65200 0.06600 0.07500 ? 0.00000 {?} {273.HA} 4.09700 0.07000 0.10000 ? 0.00000 {?} {273.CA} 62.35800 0.36600 0.36600 EE 0.00000 {?} 3.11080 0.11450 0 {?} 0 2059 {273.HB} 2.06000 0.03800 0.10300 ? 0.00000 {?} {273.HG21} 0.95600 0.06300 0.19200 ? 0.00000 {?} {273.CG2} 20.64800 0.51800 0.51800 EE 0.00000 {?} 82.66610 2.54710 0 {?} 0 2060 {374.HA2} 3.97000 0.03600 0.07800 ? 0.00000 {?} {397.HB1} 1.85000 0.09700 0.14800 ? 0.00000 {?} {397.CB} 31.10200 0.44100 0.44100 EE 0.00000 {?} 6.13490 0.17060 0 {?} 0 2061 {397.HB1} 1.88700 0.04600 0.06300 ++ 0.00000 {?} {374.HA1} 4.05300 0.07700 0.09600 ? 0.00000 {?} {374.CA} 45.30700 0.37200 0.37200 EE 0.00000 {?} 2.19690 0.08750 0 {?} 0 2062 {374.HA2} 3.97400 0.06100 0.08500 ++ 0.00000 {?} {397.HD1} 3.22300 0.10600 0.17500 ++ 0.00000 {?} {397.CD} 43.20800 0.42400 0.42400 EE 0.00000 {?} 24.82820 0.50390 0 {?} 0 2063 {375.HG21} 1.23400 0.06600 0.06300 ++ 0.00000 {?} {374.HA2} 3.98900 0.07400 0.07100 ++ 0.00000 {?} {374.CA} 45.30700 0.24400 0.24400 EE 0.00000 {?} 1.40680 0.10460 0 {?} 0 2064 {272.HB1} 1.80900 0.03600 0.04800 ? 0.00000 {?} {273.HA} 4.10800 0.08000 0.08300 ++ 0.00000 {?} {273.CA} 62.35800 0.27600 0.27600 EE 0.00000 {?} 1.09520 0.05980 0 {?} 0 2065 {?} 0.81000 0.06100 0.06100 ? 0.00000 {?} {?} 4.11200 0.09400 0.11900 ? 0.00000 {?} {?} 62.35800 0.35700 0.35700 EE 0.00000 {?} 2.72880 0.08590 0 {?} 0 2066 {277.HG1} 2.47800 0.05000 0.05600 ++ 0.00000 {?} {276.HA} 4.61100 0.07700 0.08600 ++ 0.00000 {?} {276.CA} 58.16100 0.30600 0.30600 EE 0.00000 {?} 0.85300 0.03910 0 {?} 0 2067 {283.HE1} 1.92700 0.02200 0.07900 ? 0.00000 {?} {299.HG11} 0.67000 0.05500 0.11300 ? 0.00000 {?} {299.CG1} 24.15800 0.43900 0.43900 EE 0.00000 {?} 3.07920 0.31090 0 {?} 0 2068 {286.HE1} 7.10800 0.04100 0.05500 ? 0.00000 {?} {298.HG1} 2.62800 0.07100 0.09700 ? 0.00000 {?} {298.CG} 34.28900 0.37600 0.37600 EE 0.00000 {?} 1.35800 0.06910 0 {?} 0 2069 {286.HE1} 7.11200 0.02000 0.04500 ? 0.00000 {?} {298.HG2} 2.47200 0.07200 0.11800 ? 0.00000 {?} {298.CG} 34.28900 0.41400 0.41400 EE 0.00000 {?} 0.92400 0.08390 0 {?} 0 2070 {283.HB1} 3.25900 0.02700 0.06700 ++ 0.00000 {?} {279.HG21} 0.97800 0.04100 0.09700 ++ 0.00000 {?} {279.CG2} 23.27100 0.45900 0.45900 EE 0.00000 {?} 2.69510 0.17530 0 {?} 0 2071 {279.HG21} 0.96100 0.05800 0.07200 ++ 0.00000 {?} {283.HB2} 2.43400 0.06500 0.10100 ? 0.00000 {?} {283.CB} 34.02700 0.32400 0.32400 EE 0.00000 {?} 2.31300 0.08560 0 {?} 0 2072 {295.HZ} 7.20200 0.05200 0.06300 ? 0.00000 {?} {283.HE1} 1.92900 0.09700 0.10400 ++ 0.00000 {?} {283.CE} 17.46200 0.28500 0.28500 EE 0.00000 {?} 5.94610 0.19050 0 {?} 0 2073 {282.HE1} 7.19800 0.05800 0.06400 ++ 0.00000 {?} {302.HA} 4.20200 0.14000 0.14600 ++ 0.00000 {?} {302.CA} 57.37400 0.27800 0.27800 EE 0.00000 {?} 2.67270 0.06810 0 {?} 0 2074 {282.HZ} 7.34400 0.07800 0.07800 ++ 0.00000 {?} {302.HA} 4.20500 0.14300 0.14300 ++ 0.00000 {?} {302.CA} 57.37400 0.26300 0.26300 EE 0.00000 {?} 2.84480 0.07170 0 {?} 0 2075 {282.HE1} 7.20000 0.05900 0.06900 ++ 0.00000 {?} {303.HG} 1.73000 0.14800 0.16900 ++ 0.00000 {?} {303.CG} 27.20600 0.32600 0.32600 EE 0.00000 {?} 6.16260 0.14940 0 {?} 0 2076 {295.HZ} 7.27500 0.03800 0.09000 ? 0.00000 {?} {299.HB} 1.74400 0.09900 0.12700 ++ 0.00000 {?} {299.CB} 31.14100 0.36600 0.36600 EE 0.00000 {?} 2.54060 0.09410 0 {?} 0 2077 {286.HD1} 7.18900 0.06600 0.06600 ++ 0.00000 {?} {299.HB} 1.74400 0.14300 0.11700 ++ 0.00000 {?} {299.CB} 31.14100 0.18600 0.18600 EE 0.00000 {?} 7.65910 0.23390 0 {?} 0 2078 {303.HD21} 0.61800 0.04700 0.04500 ? 0.00000 {?} {283.HB1} 3.25300 0.08400 0.08400 ++ 0.00000 {?} {283.CB} 34.02700 0.24800 0.24800 EE 0.00000 {?} 0.62710 0.03740 0 {?} 0 2079 {283.HB1} 3.21800 0.05000 0.06200 ++ 0.00000 {?} {303.HD21} 0.63100 0.05600 0.10000 ? 0.00000 {?} {303.CD2} 24.84500 0.38400 0.38400 EE 0.00000 {?} 4.67590 0.30320 0 {?} 0 2080 {283.HB2} 2.46100 0.06600 0.09600 ++ 0.00000 {?} {303.HD21} 0.63000 0.05800 0.13500 ? 0.00000 {?} {303.CD2} 24.84500 0.42500 0.42500 EE 0.00000 {?} 5.73370 0.18090 0 {?} 0 2081 {282.HD1} 7.19300 0.06900 0.06700 ? 0.00000 {?} {285.HB1} 2.79500 0.05500 0.08600 ? 0.00000 {?} {285.CB} 38.22400 0.25500 0.25500 EE 0.00000 {?} 1.65820 0.08840 0 {?} 0 2082 {282.HD1} 7.19600 0.06800 0.06900 ++ 0.00000 {?} {285.HB2} 2.68700 0.11300 0.11300 ? 0.00000 {?} {285.CB} 38.22400 0.26800 0.26800 EE 0.00000 {?} 3.08210 0.06830 0 {?} 0 2083 {286.HD1} 7.20500 0.05400 0.08600 ? 0.00000 {?} {290.HG21} 1.22400 0.07900 0.16200 ++ 0.00000 {?} {290.CG2} 20.70000 0.48500 0.48500 EE 0.00000 {?} 26.40860 0.54410 0 {?} 0 2084 {288.HB1} 3.30300 0.07000 0.07800 ++ 0.00000 {?} {289.HG1} 2.26300 0.11500 0.13300 ++ 0.00000 {?} {289.CG} 33.50200 0.31000 0.31000 EE 0.00000 {?} 1.53760 0.07600 0 {?} 0 2085 {288.HB2} 3.05000 0.04400 0.04700 ++ 0.00000 {?} {289.HG1} 2.26600 0.09800 0.11000 ++ 0.00000 {?} {289.CG} 33.50200 0.29900 0.29900 EE 0.00000 {?} 1.14240 0.04740 0 {?} 0 2086 {348.HG1} 1.55100 0.05100 0.06300 ? 0.00000 {?} {344.HG2} 2.27400 0.06400 0.08100 ++ 0.00000 {?} {344.CG} 36.38800 0.34500 0.34500 EE 0.00000 {?} 2.05740 0.10930 0 {?} 0 2087 {293.HD2} 7.19300 0.07500 0.07900 ++ 0.00000 {?} {292.HB2} 2.02700 0.10400 0.14500 ? 0.00000 {?} {292.CB} 29.83000 0.29300 0.29300 EE 0.00000 {?} 3.87980 0.08650 0 {?} 0 2088 {302.HA} 4.20000 0.07200 0.08000 ++ 0.00000 {?} {299.HA} 3.19000 0.10100 0.11200 ++ 0.00000 {?} {299.CA} 65.40000 0.29800 0.29800 EE 0.00000 {?} 2.07540 0.06310 0 {?} 0 2089 {286.HE1} 7.10800 0.04100 0.05800 ? 0.00000 {?} {299.HA} 3.19200 0.09600 0.10700 ++ 0.00000 {?} {299.CA} 65.44000 0.31000 0.31000 EE 0.00000 {?} 2.12730 0.09190 0 {?} 0 2090 {286.HZ} 7.20100 0.03500 0.06300 ? 0.00000 {?} {298.HA} 4.08900 0.09000 0.12200 ? 0.00000 {?} {298.CA} 58.94800 0.39100 0.39100 EE 0.00000 {?} 1.86740 0.08600 0 {?} 0 2091 {286.HE1} 7.13000 0.04400 0.05300 ++ 0.00000 {?} {298.HA} 4.08300 0.12300 0.13700 ++ 0.00000 {?} {298.CA} 58.94800 0.32200 0.32200 EE 0.00000 {?} 2.20430 0.06490 0 {?} 0 2092 {297.HB2} 2.03900 0.02300 0.06400 ? 0.00000 {?} {298.HG2} 2.47900 0.06100 0.10000 ? 0.00000 {?} {298.CG} 34.39100 0.42300 0.42300 EE 0.00000 {?} 1.21530 0.12740 0 {?} 0 2093 {297.HB2} 2.03400 0.02600 0.06300 ? 0.00000 {?} {298.HG1} 2.63000 0.08300 0.12200 ? 0.00000 {?} {298.CG} 34.39100 0.34900 0.34900 EE 0.00000 {?} 1.13820 0.07200 0 {?} 0 2094 {294.HG1} 1.16900 0.07100 0.06200 ++ 0.00000 {?} {298.HG1} 2.62900 0.10400 0.09300 ++ 0.00000 {?} {298.CG} 34.39100 0.23100 0.23100 EE 0.00000 {?} 0.94450 0.04410 0 {?} 0 2095 {295.HZ} 7.27300 0.06700 0.06900 ? 0.00000 {?} {283.HB2} 2.46000 0.12200 0.12200 ? 0.00000 {?} {283.CB} 34.02900 0.27200 0.27200 EE 0.00000 {?} 4.70600 0.10460 0 {?} 0 2096 {?} 7.32300 0.04300 0.06000 ? 0.00000 {?} {?} 2.64100 0.08400 0.13200 ? 0.00000 {?} {?} 34.28900 0.33000 0.33000 EE 0.00000 {?} 1.70260 0.06110 0 {?} 0 2097 {295.HD1} 7.19300 0.07200 0.07200 ++ 0.00000 {?} {299.HG21} 0.83100 0.19100 0.14900 ++ 0.00000 {?} {299.CG2} 21.69700 0.16700 0.16700 EE 0.00000 {?} 19.01860 0.44170 0 {?} 0 2098 {293.HD2} 7.19400 0.05800 0.06700 ++ 0.00000 {?} {294.HD1} 1.68500 0.12200 0.14200 ++ 0.00000 {?} {294.CD} 28.98000 0.31400 0.31400 EE 0.00000 {?} 3.65670 0.08720 0 {?} 0 2099 {303.HD11} 0.79100 0.07000 0.07300 ++ 0.00000 {?} {302.HA} 4.18400 0.10700 0.16400 ? 0.00000 {?} {302.CA} 57.37400 0.28000 0.28000 EE 0.00000 {?} 1.89220 0.05300 0 {?} 0 2100 {286.HE1} 7.10900 0.07400 0.07400 ++ 0.00000 {?} {302.HG1} 2.31200 0.11900 0.11900 ++ 0.00000 {?} {302.CG} 35.60100 0.14200 0.14200 EE 0.00000 {?} 3.08900 0.08710 0 {?} 0 2101 {286.HE1} 7.11100 0.06500 0.06500 ++ 0.00000 {?} {302.HG2} 2.08100 0.13400 0.13400 ++ 0.00000 {?} {302.CG} 35.60100 0.14200 0.14200 EE 0.00000 {?} 3.06490 0.08650 0 {?} 0 2102 {304.HD11} 0.95600 0.03700 0.07600 ? 0.00000 {?} {322.HG11} 1.27800 0.09300 0.11200 ? 0.00000 {?} {322.CG1} 27.20600 0.42200 0.42200 EE 0.00000 {?} 6.27310 0.21480 0 {?} 0 2103 {304.HD11} 0.96700 0.06300 0.07800 ? 0.00000 {?} {322.HB} 1.42200 0.11300 0.14300 ++ 0.00000 {?} {322.CB} 40.84700 0.32900 0.32900 EE 0.00000 {?} 4.27370 0.11250 0 {?} 0 2104 {303.HA} 4.25300 0.04700 0.05700 ++ 0.00000 {?} {306.HB1} 1.87700 0.11600 0.16400 ++ 0.00000 {?} {306.CB} 41.89700 0.34200 0.34200 EE 0.00000 {?} 1.71860 0.06510 0 {?} 0 2105 {395.HD1} 1.72200 0.05100 0.07000 ++ 0.00000 {?} {393.HB} 4.22400 0.07200 0.09400 ++ 0.00000 {?} {393.CB} 70.75300 0.35600 0.35600 EE 0.00000 {?} 1.73390 0.08110 0 {?} 0 2106 {303.HA} 4.25400 0.03800 0.11300 ? 0.00000 {?} {306.HD11} 0.61800 0.07700 0.15600 ? 0.00000 {?} {306.CD1} 24.32100 0.48600 0.48600 EE 0.00000 {?} 14.59590 0.42110 0 {?} 0 2107 {308.HA} 5.29600 0.04800 0.06700 ++ 0.00000 {?} {389.HD21} 0.63000 0.11500 0.11500 ? 0.00000 {?} {389.CD2} 24.32800 0.40900 0.40900 EE 0.00000 {?} 4.52940 0.11400 0 {?} 0 2108 {308.HA} 5.29800 0.04200 0.05600 ++ 0.00000 {?} {319.HG11} 0.82800 0.07100 0.09100 ? 0.00000 {?} {319.CG1} 22.48400 0.35800 0.35800 EE 0.00000 {?} 1.35650 0.06570 0 {?} 0 2109 {390.HG21} 1.20400 0.04400 0.05000 ++ 0.00000 {?} {308.HB} 1.98200 0.11900 0.14600 ? 0.00000 {?} {308.CB} 35.07600 0.31600 0.31600 EE 0.00000 {?} 1.93800 0.04480 0 {?} 0 2110 {390.HG21} 1.20900 0.04000 0.05800 ++ 0.00000 {?} {309.HB2} 1.34500 0.06700 0.08900 ? 0.00000 {?} {309.CB} 46.35600 0.44700 0.44700 EE 0.00000 {?} 2.48680 0.13210 0 {?} 0 2111 {309.HG} 1.32800 0.04600 0.05800 ? 0.00000 {?} {314.HA} 4.43700 0.10600 0.12500 ++ 0.00000 {?} {314.CA} 53.96400 0.30100 0.30100 EE 0.00000 {?} 3.19640 0.18160 0 {?} 0 2112 {311.HD1} 1.48900 0.04000 0.07300 ? 0.00000 {?} {311.HG2} 0.77600 0.06400 0.14200 ? 0.00000 {?} {311.CG} 26.15700 0.47900 0.47900 EE 0.00000 {?} 13.05610 0.39830 0 {?} 0 2113 {388.HD1} 7.16600 0.06500 0.06500 ? 0.00000 {?} {311.HA} 4.08400 0.11400 0.10500 ++ 0.00000 {?} {311.CA} 58.42300 0.23700 0.23700 EE 0.00000 {?} 1.59410 0.05250 0 {?} 0 2114 {314.HA} 4.43300 0.04800 0.05800 ++ 0.00000 {?} {311.HA} 4.05300 0.08200 0.10200 ++ 0.00000 {?} {311.CA} 58.16100 0.34700 0.34700 EE 0.00000 {?} 1.21530 0.05280 0 {?} 0 2115 {316.HG21} 1.04000 0.03800 0.05300 ? 0.00000 {?} {315.HA} 4.49800 0.05600 0.10800 ? 0.00000 {?} {315.CA} 55.01300 0.39100 0.39100 EE 0.00000 {?} 0.76600 0.05120 0 {?} 0 2116 {345.HD1} 6.68900 0.03300 0.05600 ? 0.00000 {?} {334.HE1} 2.88900 0.10700 0.14000 ++ 0.00000 {?} {334.CE} 41.37200 0.36100 0.36100 EE 0.00000 {?} 1.01710 0.04550 0 {?} 0 2117 {316.HA} 5.62400 0.05200 0.05000 ++ 0.00000 {?} {309.HB1} 1.68400 0.10300 0.10000 ++ 0.00000 {?} {309.CB} 46.35600 0.25500 0.25500 EE 0.00000 {?} 0.74070 0.04300 0 {?} 0 2118 {316.HA} 5.60800 0.04400 0.06200 ? 0.00000 {?} {390.HG21} 1.20400 0.04700 0.07400 ? 0.00000 {?} {390.CG2} 21.60500 0.36600 0.36600 EE 0.00000 {?} 0.77940 0.05780 0 {?} 0 2119 {380.HB1} 1.24600 0.03000 0.03200 ++ 0.00000 {?} {317.HB1} 2.91800 0.14100 0.15200 ++ 0.00000 {?} {317.CB} 43.20800 0.28300 0.28300 EE 0.00000 {?} 1.18850 0.03970 0 {?} 0 2120 {380.HB1} 1.26300 0.07100 0.07500 ++ 0.00000 {?} {317.HB2} 2.24400 0.15500 0.16100 ++ 0.00000 {?} {317.CB} 43.20800 0.27400 0.27400 EE 0.00000 {?} 3.57870 0.08790 0 {?} 0 2121 {317.HB2} 2.20000 0.05500 0.06000 ++ 0.00000 {?} {380.HB1} 1.24400 0.07300 0.07800 ? 0.00000 {?} {380.CB} 19.83000 0.29300 0.29300 EE 0.00000 {?} 0.88900 0.03850 0 {?} 0 2122 {318.HD2} 3.21800 0.03700 0.05400 ? 0.00000 {?} {307.HG21} 0.80000 0.06100 0.09000 ? 0.00000 {?} {307.CG2} 21.17300 0.42500 0.42500 EE 0.00000 {?} 3.97670 0.19590 0 {?} 0 2123 {318.HD1} 3.30800 0.03500 0.05000 ? 0.00000 {?} {307.HG21} 0.78400 0.05700 0.08400 ++ 0.00000 {?} {307.CG2} 21.17300 0.37600 0.37600 EE 0.00000 {?} 0.85460 0.07520 0 {?} 0 2124 {304.HG12} 0.80700 0.02900 0.07400 ? 0.00000 {?} {322.HB} 1.41300 0.05500 0.10200 ? 0.00000 {?} {322.CB} 40.84700 0.47500 0.47500 EE 0.00000 {?} 1.60540 0.07790 0 {?} 0 2125 {324.HE3} 7.94100 0.06800 0.06900 ++ 0.00000 {?} {324.HB1} 3.63300 0.12900 0.12900 ++ 0.00000 {?} {324.CB} 28.78000 0.26500 0.26500 EE 0.00000 {?} 3.03560 0.08160 0 {?} 0 2126 {333.HB1} 1.73400 0.01500 0.06400 ? 0.00000 {?} {333.HA} 4.71800 0.06100 0.13400 ? 0.00000 {?} {333.CA} 54.75100 0.41800 0.41800 EE 0.00000 {?} 1.43420 0.13740 0 {?} 0 2127 {326.HB2} 1.59600 0.02300 0.06600 ? 0.00000 {?} {326.HA} 4.72200 0.06300 0.13200 ? 0.00000 {?} {326.CA} 55.01300 0.49000 0.49000 EE 0.00000 {?} 1.95630 0.10580 0 {?} 0 2128 {?} 4.53800 0.04600 0.06500 ++ 0.00000 {?} {?} 2.28200 0.07300 0.09800 ? 0.00000 {?} {?} 35.04000 0.38400 0.38400 EE 0.00000 {?} 1.03060 0.04480 0 {?} 0 2129 {358.HA} 4.59800 0.03600 0.09800 ? 0.00000 {?} {327.HB2} 2.79800 0.09500 0.13800 ? 0.00000 {?} {327.CB} 39.01100 0.45800 0.45800 EE 0.00000 {?} 3.29030 0.09270 0 {?} 0 2130 {358.HA} 4.58500 0.03300 0.08100 ? 0.00000 {?} {327.HB1} 3.14800 0.05700 0.12500 ? 0.00000 {?} {327.CB} 39.01100 0.46100 0.46100 EE 0.00000 {?} 3.36910 0.15200 0 {?} 0 2131 {341.HA} 5.11800 0.04600 0.06500 ++ 0.00000 {?} {329.HA} 4.48600 0.08400 0.11400 ++ 0.00000 {?} {329.CA} 57.11200 0.37600 0.37600 EE 0.00000 {?} 1.19100 0.05600 0 {?} 0 2132 {339.HG1} 2.06500 0.02400 0.05000 ? 0.00000 {?} {333.HB1} 1.68100 0.06800 0.10300 ++ 0.00000 {?} {333.CB} 33.76400 0.39900 0.39900 EE 0.00000 {?} 0.48030 0.03460 0 {?} 0 2133 {339.HG2} 1.94000 0.01800 0.06400 ? 0.00000 {?} {333.HB1} 1.67800 0.04600 0.10100 ? 0.00000 {?} {333.CB} 33.76400 0.49800 0.49800 EE 0.00000 {?} 2.04670 0.17660 0 {?} 0 2134 {358.HD1} 1.76000 0.03900 0.05900 ? 0.00000 {?} {358.HB2} 1.92100 0.03700 0.13700 ? 0.00000 {?} {358.CB} 33.76400 0.50500 0.50500 EE 0.00000 {?} 15.88200 0.59160 0 {?} 0 2135 {350.HE1} 6.81300 0.04800 0.06200 ? 0.00000 {?} {349.HB1} 1.15000 0.07000 0.06600 ++ 0.00000 {?} {349.CB} 28.30600 0.24000 0.24000 EE 0.00000 {?} 0.73830 0.04950 0 {?} 0 2136 {346.HD1} 7.21900 0.06200 0.07000 ? 0.00000 {?} {346.HB2} 2.91100 0.09700 0.12000 ? 0.00000 {?} {346.CB} 37.17500 0.33500 0.33500 EE 0.00000 {?} 2.35520 0.07030 0 {?} 0 2137 {386.HD21} 0.84400 0.03500 0.06600 ? 0.00000 {?} {352.HA} 4.55100 0.06200 0.09200 ++ 0.00000 {?} {352.CA} 53.43900 0.37200 0.37200 EE 0.00000 {?} 0.73020 0.05870 0 {?} 0 2138 {386.HD21} 0.82100 0.02000 0.06500 ? 0.00000 {?} {352.HG1} 2.41700 0.09100 0.12800 ? 0.00000 {?} {352.CG} 33.50200 0.39100 0.39100 EE 0.00000 {?} 2.16150 0.14820 0 {?} 0 2139 {329.HE1} 3.10500 0.04500 0.04900 ++ 0.00000 {?} {357.HB1} 1.77700 0.08800 0.10000 ? 0.00000 {?} {357.CB} 40.58500 0.30500 0.30500 EE 0.00000 {?} 0.86380 0.04070 0 {?} 0 2140 {362.HA} 4.46900 0.03500 0.04300 ++ 0.00000 {?} {322.HG12} 0.61800 0.06500 0.08200 ++ 0.00000 {?} {322.CG1} 27.20600 0.35100 0.35100 EE 0.00000 {?} 0.69450 0.05170 0 {?} 0 2141 {322.HG21} -0.51300 0.08500 0.09100 ++ 0.00000 {?} {299.HG21} 0.82700 0.11300 0.12500 ++ 0.00000 {?} {299.CG2} 21.69700 0.30000 0.30000 EE 0.00000 {?} 2.94610 0.09050 0 {?} 0 2142 {322.HG21} -0.51600 0.06000 0.07800 ++ 0.00000 {?} {303.HD11} 0.76200 0.15300 0.18600 ++ 0.00000 {?} {303.CD1} 26.41900 0.32500 0.32500 EE 0.00000 {?} 3.96320 0.09840 0 {?} 0 2143 {381.HE1} 2.06600 0.04200 0.08800 ? 0.00000 {?} {363.HG11} 0.77800 0.07000 0.13200 ? 0.00000 {?} {363.CG1} 20.12300 0.49400 0.49400 EE 0.00000 {?} 20.86680 0.51670 0 {?} 0 2144 {364.HA} 5.20800 0.04000 0.06100 ++ 0.00000 {?} {319.HG11} 0.82100 0.07500 0.10800 ++ 0.00000 {?} {319.CG1} 22.48400 0.38000 0.38000 EE 0.00000 {?} 1.35090 0.06070 0 {?} 0 2145 {376.HD11} 0.92800 0.05600 0.06700 ++ 0.00000 {?} {375.HA} 4.38600 0.06900 0.13000 ? 0.00000 {?} {375.CA} 61.57100 0.34200 0.34200 EE 0.00000 {?} 1.63530 0.06370 0 {?} 0 2146 {?} 1.68400 0.02400 0.06800 ? 0.00000 {?} {?} 4.34800 0.10200 0.12100 ++ 0.00000 {?} {?} 61.57100 0.32100 0.32100 EE 0.00000 {?} 0.96100 0.08050 0 {?} 0 2147 {397.HA} 4.36100 0.02500 0.04400 ++ 0.00000 {?} {376.HA} 4.69700 0.05500 0.10100 ++ 0.00000 {?} {376.CA} 52.85200 0.41900 0.41900 EE 0.00000 {?} 0.63790 0.05900 0 {?} 0 2148 {354.HA} 3.77700 0.02800 0.07200 ? 0.00000 {?} {343.HD11} 1.03500 0.07800 0.13100 ++ 0.00000 {?} {343.CD1} 25.54800 0.44100 0.44100 EE 0.00000 {?} 2.52330 0.11010 0 {?} 0 2149 {376.HB1} 1.63900 0.07800 0.07800 ? 0.00000 {?} {377.HA} 4.56400 0.10900 0.13000 ++ 0.00000 {?} {377.CA} 62.88300 0.33700 0.33700 EE 0.00000 {?} 2.14040 0.06890 0 {?} 0 2150 {342.HZ} 7.21900 0.05500 0.05500 ++ 0.00000 {?} {381.HG2} 2.41100 0.14100 0.14100 ? 0.00000 {?} {381.CG} 32.71500 0.26600 0.26600 EE 0.00000 {?} 2.28690 0.05940 0 {?} 0 2151 {?} 0.92200 0.02600 0.07400 ? 0.00000 {?} {?} 0.16200 0.04600 0.11400 ? 0.00000 {?} {?} 7.79400 0.50000 0.50000 EE 0.00000 {?} 3.31630 0.22220 0 {?} 0 2152 {383.HA} 4.51700 0.05600 0.08600 ++ 0.00000 {?} {384.HD1} 4.18300 0.09900 0.16100 ++ 0.00000 {?} {384.CD} 52.91400 0.42000 0.42000 EE 0.00000 {?} 3.77980 0.07750 0 {?} 0 2153 {384.HG1} 1.45900 0.07300 0.07400 ++ 0.00000 {?} {384.HD1} 4.18100 0.11100 0.11400 ++ 0.00000 {?} {384.CD} 52.91400 0.26800 0.26800 EE 0.00000 {?} 1.91800 0.04290 0 {?} 0 2154 {362.HD11} 0.70200 0.06600 0.09000 ? 0.00000 {?} {384.HB2} 1.96100 0.04400 0.14200 ? 0.00000 {?} {384.CB} 31.40300 0.39500 0.39500 EE 0.00000 {?} 1.48140 0.07050 0 {?} 0 2155 {383.HG12} 0.83500 0.04400 0.08400 ? 0.00000 {?} {385.HB1} 2.67300 0.10100 0.12200 ? 0.00000 {?} {385.CB} 32.19000 0.32500 0.32500 EE 0.00000 {?} 1.78640 0.06160 0 {?} 0 2156 {324.HA} 4.50800 0.05600 0.08800 ? 0.00000 {?} {360.HA} 5.16800 0.09800 0.14100 ? 0.00000 {?} {360.CA} 61.57100 0.42100 0.42100 EE 0.00000 {?} 5.07640 0.10980 0 {?} 0 2157 {354.HD11} 0.92900 0.06700 0.08400 ++ 0.00000 {?} {386.HD11} 0.28200 0.10000 0.12100 ++ 0.00000 {?} {386.CD1} 25.89500 0.32600 0.32600 EE 0.00000 {?} 13.84630 0.38070 0 {?} 0 2158 {308.HG11} 0.62400 0.03600 0.03600 ? 0.00000 {?} {387.HA} 5.04300 0.08600 0.10500 ? 0.00000 {?} {387.CA} 57.89900 0.24500 0.24500 EE 0.00000 {?} 0.60700 0.03100 0 {?} 0 2159 {279.HG21} 0.98000 0.04900 0.05100 ++ 0.00000 {?} {387.HB1} 2.76200 0.10600 0.10800 ++ 0.00000 {?} {387.CB} 30.61700 0.27100 0.27100 EE 0.00000 {?} 1.16470 0.05200 0 {?} 0 2160 {359.HA} 4.53600 0.05800 0.08100 ++ 0.00000 {?} {360.HD1} 3.68600 0.09600 0.16500 ? 0.00000 {?} {360.CD} 48.45500 0.40500 0.40500 EE 0.00000 {?} 4.28580 0.10820 0 {?} 0 2161 {359.HA} 4.53500 0.05400 0.07000 ? 0.00000 {?} {360.HD2} 3.25600 0.11000 0.14300 ++ 0.00000 {?} {360.CD} 48.45500 0.36600 0.36600 EE 0.00000 {?} 2.48050 0.07940 0 {?} 0 2162 {327.HA} 5.47900 0.04700 0.06200 ++ 0.00000 {?} {360.HA} 5.16300 0.08400 0.11900 ++ 0.00000 {?} {360.CA} 61.57100 0.34300 0.34300 EE 0.00000 {?} 1.50480 0.06530 0 {?} 0 2163 {390.HB} 4.25100 0.08800 0.08800 ? 0.00000 {?} {307.HG21} 0.80100 0.03600 0.10800 ? 0.00000 {?} {307.CG2} 21.43500 0.40700 0.40700 EE 0.00000 {?} 3.28370 0.12060 0 {?} 0 2164 {393.HG21} 1.21000 0.04500 0.06500 ++ 0.00000 {?} {392.HB1} 1.71800 0.07000 0.12500 ? 0.00000 {?} {392.CB} 42.52800 0.38900 0.38900 EE 0.00000 {?} 2.95290 0.13230 0 {?} 0 2165 {393.HG21} 1.23500 0.04100 0.06100 ++ 0.00000 {?} {392.HB2} 1.56800 0.09500 0.12300 ? 0.00000 {?} {392.CB} 42.52400 0.39500 0.39500 EE 0.00000 {?} 2.62220 0.08790 0 {?} 0 2166 {307.HB} 1.82500 0.06800 0.07400 ++ 0.00000 {?} {393.HA} 4.60700 0.12400 0.13600 ++ 0.00000 {?} {393.CA} 61.04700 0.30200 0.30200 EE 0.00000 {?} 2.58170 0.07050 0 {?} 0 2167 {374.HA1} 4.07200 0.06200 0.05400 ? 0.00000 {?} {397.HB1} 1.85300 0.17900 0.16400 ++ 0.00000 {?} {397.CB} 31.10200 0.24500 0.24500 EE 0.00000 {?} 4.63100 0.16010 0 {?} 0 2168 {?} 4.35600 0.06700 0.09200 ? 0.00000 {?} {?} 2.03900 0.07600 0.12700 ++ 0.00000 {?} {?} 27.46900 0.45100 0.45100 EE 0.00000 {?} 8.21170 0.15320 0 {?} 0 2169 {360.HA} 5.17100 0.06000 0.07000 ++ 0.00000 {?} {327.HA} 5.47600 0.10100 0.11100 ++ 0.00000 {?} {327.CA} 52.39000 0.30000 0.30000 EE 0.00000 {?} 2.05700 0.07210 0 {?} 0 2170 {360.HD1} 3.68800 0.04900 0.08000 ++ 0.00000 {?} {359.HA} 4.55100 0.07000 0.11500 ? 0.00000 {?} {359.CA} 53.70100 0.42200 0.42200 EE 0.00000 {?} 3.79750 0.15950 0 {?} 0 2171 {301.HG1} 1.64200 0.03800 0.04900 ++ 0.00000 {?} {301.HA} 4.05100 0.10200 0.13400 ? 0.00000 {?} {301.CA} 58.68600 0.34900 0.34900 EE 0.00000 {?} 12.42680 0.48350 0 {?} 0 2172 {270.HA} 4.40600 0.05500 0.06200 ++ 0.00000 {?} {269.HG21} 0.94800 0.11100 0.12200 ++ 0.00000 {?} {269.CG2} 19.99600 0.32200 0.32200 EE 0.00000 {?} 3.15810 0.11840 0 {?} 0 2173 {274.HD11} 0.93600 0.04700 0.05600 ++ 0.00000 {?} {271.HA} 4.71000 0.10800 0.13600 ++ 0.00000 {?} {271.CA} 55.80000 0.33300 0.33300 EE 0.00000 {?} 1.26540 0.05570 0 {?} 0 2174 {271.HD2} 7.19300 0.05500 0.06800 ++ 0.00000 {?} {274.HD11} 0.93300 0.05200 0.08100 ? 0.00000 {?} {274.CD1} 25.10000 0.30500 0.30500 EE 0.00000 {?} 1.76600 0.10060 0 {?} 0 2175 {273.HA} 4.10500 0.03500 0.05500 ? 0.00000 {?} {274.HB2} 1.62700 0.12500 0.15500 ++ 0.00000 {?} {274.CB} 42.15900 0.37700 0.37700 EE 0.00000 {?} 1.08190 0.04880 0 {?} 0 2176 {274.HD21} 0.89000 0.01700 0.05400 ? 0.00000 {?} {274.HB2} 1.62000 0.07300 0.13100 ? 0.00000 {?} {274.CB} 42.15900 0.51900 0.51900 EE 0.00000 {?} 20.91080 1.36010 0 {?} 0 2177 {279.HA} 3.60700 0.05200 0.05500 ++ 0.00000 {?} {387.HB2} 2.22600 0.10000 0.10900 ++ 0.00000 {?} {387.CB} 30.61700 0.28800 0.28800 EE 0.00000 {?} 2.24110 0.09190 0 {?} 0 2178 {279.HG21} 0.97500 0.02000 0.06800 ? 0.00000 {?} {389.HD21} 0.63400 0.04600 0.09500 ? 0.00000 {?} {389.CD2} 24.15800 0.46900 0.46900 EE 0.00000 {?} 6.27780 0.60660 0 {?} 0 2179 {362.HD21} 0.54400 0.06300 0.06300 ? 0.00000 {?} {279.HG11} 0.80100 0.07300 0.10200 ++ 0.00000 {?} {279.CG1} 24.66300 0.38200 0.38200 EE 0.00000 {?} 6.97230 0.21050 0 {?} 0 2180 {?} 2.21100 0.04100 0.09700 ? 0.00000 {?} {?} 0.96800 0.07100 0.13100 ++ 0.00000 {?} {?} 23.79600 0.48200 0.48200 EE 0.00000 {?} 14.86710 0.37620 0 {?} 0 2181 {286.HD1} 7.21400 0.06800 0.07600 ? 0.00000 {?} {290.HB} 3.97000 0.08900 0.09500 ++ 0.00000 {?} {290.CB} 70.22800 0.29200 0.29200 EE 0.00000 {?} 2.38300 0.07300 0 {?} 0 2182 {287.HD1} 6.05300 0.05800 0.07100 ? 0.00000 {?} {287.HB1} 2.81800 0.08100 0.09700 ? 0.00000 {?} {287.CB} 38.22400 0.30600 0.30600 EE 0.00000 {?} 4.29920 0.14970 0 {?} 0 2183 {287.HE1} 6.58000 0.05100 0.05100 ++ 0.00000 {?} {287.HB1} 2.83000 0.06400 0.09700 ? 0.00000 {?} {287.CB} 38.22400 0.26100 0.26100 EE 0.00000 {?} 1.30320 0.07810 0 {?} 0 2184 {294.HB2} 1.68700 0.05500 0.11200 ? 0.00000 {?} {294.HA} 4.43800 0.03800 0.14100 ? 0.00000 {?} {294.CA} 56.23700 0.49000 0.49000 EE 0.00000 {?} 26.68750 0.99490 0 {?} 0 2185 {290.HA} 4.52700 0.04900 0.06000 ? 0.00000 {?} {289.HG1} 2.25700 0.11500 0.14800 ? 0.00000 {?} {289.CG} 33.50200 0.37500 0.37500 EE 0.00000 {?} 2.97050 0.07260 0 {?} 0 2186 {289.HB1} 2.11800 0.05500 0.06300 ++ 0.00000 {?} {290.HG21} 1.21600 0.08400 0.09600 ++ 0.00000 {?} {290.CG2} 20.64800 0.29800 0.29800 EE 0.00000 {?} 4.53610 0.19000 0 {?} 0 2187 {344.HG1} 2.33800 0.04200 0.07000 ? 0.00000 {?} {348.HG1} 1.55500 0.03600 0.09600 ? 0.00000 {?} {348.CG} 25.37000 0.40500 0.40500 EE 0.00000 {?} 3.63370 0.22010 0 {?} 0 2188 {344.HG1} 2.33500 0.03500 0.04000 ++ 0.00000 {?} {348.HG2} 1.48100 0.07400 0.07400 ? 0.00000 {?} {348.CG} 25.37000 0.32300 0.32300 EE 0.00000 {?} 2.54390 0.14980 0 {?} 0 2189 {344.HG2} 2.25600 0.04200 0.05100 ? 0.00000 {?} {348.HG1} 1.55500 0.06900 0.10000 ? 0.00000 {?} {348.CG} 25.37000 0.31400 0.31400 EE 0.00000 {?} 4.52850 0.19290 0 {?} 0 2190 {344.HG2} 2.25600 0.05300 0.04700 ++ 0.00000 {?} {348.HG2} 1.48500 0.08700 0.08700 ? 0.00000 {?} {348.CG} 25.37000 0.22100 0.22100 EE 0.00000 {?} 3.25480 0.15970 0 {?} 0 2191 {344.HG2} 2.25700 0.04000 0.05700 ? 0.00000 {?} {348.HD1} 1.70400 0.06500 0.09700 ++ 0.00000 {?} {348.CD} 28.78000 0.41800 0.41800 EE 0.00000 {?} 11.16170 0.52140 0 {?} 0 2192 {343.HG} 1.68200 0.02400 0.05600 ? 0.00000 {?} {344.HB2} 2.08200 0.09100 0.11800 ? 0.00000 {?} {344.CB} 29.83000 0.44700 0.44700 EE 0.00000 {?} 3.14280 0.13430 0 {?} 0 2193 {293.HE1} 8.19000 0.05000 0.06500 ++ 0.00000 {?} {294.HE1} 2.97100 0.09400 0.12000 ++ 0.00000 {?} {294.CE} 41.89700 0.37900 0.37900 EE 0.00000 {?} 2.35770 0.09770 0 {?} 0 2194 {292.HA} 3.97600 0.05700 0.06600 ++ 0.00000 {?} {295.HA} 4.28400 0.10500 0.12200 ++ 0.00000 {?} {295.CA} 61.30900 0.31000 0.31000 EE 0.00000 {?} 1.70280 0.05950 0 {?} 0 2195 {295.HD1} 7.22000 0.03200 0.08100 ? 0.00000 {?} {296.HG1} 1.69400 0.09900 0.11000 ++ 0.00000 {?} {296.CG} 32.45300 0.30100 0.30100 EE 0.00000 {?} 2.04550 0.09570 0 {?} 0 2196 {295.HD1} 7.22600 0.07200 0.07100 ++ 0.00000 {?} {296.HG2} 0.20700 0.10300 0.10100 ++ 0.00000 {?} {296.CG} 32.45300 0.25500 0.25500 EE 0.00000 {?} 1.09410 0.04670 0 {?} 0 2197 {299.HB} 1.75200 0.04700 0.05900 ++ 0.00000 {?} {298.HG2} 2.48700 0.05900 0.09300 ? 0.00000 {?} {298.CG} 34.39100 0.38800 0.38800 EE 0.00000 {?} 0.98860 0.05730 0 {?} 0 2198 {322.HD11} 0.74400 0.08000 0.06800 ++ 0.00000 {?} {304.HG11} 1.76700 0.16000 0.13500 ++ 0.00000 {?} {304.CG1} 29.83000 0.20400 0.20400 EE 0.00000 {?} 6.00870 0.22970 0 {?} 0 2199 {306.HD21} 0.79300 0.02500 0.10500 ? 0.00000 {?} {306.HD11} 0.62500 0.07800 0.16500 ? 0.00000 {?} {306.CD1} 24.32100 0.51800 0.51800 EE 0.00000 {?} 95.33780 3.13790 0 {?} 0 2200 {390.HA} 4.62100 0.05700 0.08200 ++ 0.00000 {?} {308.HA} 5.28400 0.04700 0.14300 ? 0.00000 {?} {308.CA} 58.16100 0.40500 0.40500 EE 0.00000 {?} 1.08580 0.04600 0 {?} 0 2201 {308.HA} 5.29600 0.09400 0.09600 ++ 0.00000 {?} {279.HG11} 0.80200 0.06800 0.12700 ? 0.00000 {?} {279.CG1} 24.66300 0.27400 0.27400 EE 0.00000 {?} 4.18900 0.12660 0 {?} 0 2202 {364.HA} 5.20000 0.05000 0.06600 ++ 0.00000 {?} {320.HA} 5.01700 0.07300 0.08800 ? 0.00000 {?} {320.CA} 55.80000 0.35500 0.35500 EE 0.00000 {?} 1.36870 0.05580 0 {?} 0 2203 {379.HA} 4.54500 0.03100 0.07600 ? 0.00000 {?} {365.HA} 4.73500 0.05900 0.13300 ? 0.00000 {?} {365.CA} 53.43900 0.51900 0.51900 EE 0.00000 {?} 2.21110 0.08680 0 {?} 0 2204 {393.HG21} 1.20200 0.03200 0.05900 ? 0.00000 {?} {392.HA} 4.58100 0.09500 0.14100 ++ 0.00000 {?} {392.CA} 54.75100 0.37900 0.37900 EE 0.00000 {?} 1.15160 0.06390 0 {?} 0 2205 {274.HA} 4.40900 0.04200 0.06400 ++ 0.00000 {?} {273.HA} 4.10400 0.09200 0.16600 ++ 0.00000 {?} {273.CA} 62.35800 0.40800 0.40800 EE 0.00000 {?} 7.89690 0.24300 0 {?} 0 2206 {279.HG11} 0.80400 0.02900 0.08500 ? 0.00000 {?} {389.HA} 4.39700 0.07800 0.15700 ? 0.00000 {?} {389.CA} 55.80000 0.50400 0.50400 EE 0.00000 {?} 22.81830 0.65450 0 {?} 0 2207 {389.HA} 4.43500 0.05000 0.07100 ++ 0.00000 {?} {279.HG11} 0.80400 0.04800 0.08600 ? 0.00000 {?} {279.CG1} 24.66300 0.43700 0.43700 EE 0.00000 {?} 3.96910 0.13810 0 {?} 0 2208 {278.HB} 4.69000 0.05300 0.08200 ++ 0.00000 {?} {279.HG11} 0.80500 0.06000 0.08600 ? 0.00000 {?} {279.CG1} 24.66300 0.40500 0.40500 EE 0.00000 {?} 1.44500 0.06940 0 {?} 0 2209 {397.HG1} 1.70000 0.05100 0.06300 ++ 0.00000 {?} {374.HA1} 4.05300 0.08100 0.09500 ? 0.00000 {?} {374.CA} 45.30700 0.34300 0.34300 EE 0.00000 {?} 1.76730 0.06410 0 {?} 0 2210 {290.HG21} 1.23900 0.03100 0.07400 ++ 0.00000 {?} {295.HA} 4.28900 0.06900 0.17200 ? 0.00000 {?} {295.CA} 61.30900 0.51000 0.51000 EE 0.00000 {?} 12.17550 0.32810 0 {?} 0 2211 {298.HB1} 2.30300 0.04000 0.04900 ? 0.00000 {?} {295.HA} 4.27600 0.08300 0.07500 ++ 0.00000 {?} {295.CA} 61.30900 0.22300 0.22300 EE 0.00000 {?} 0.69950 0.04790 0 {?} 0 2212 {298.HB2} 2.25100 0.06500 0.06800 ? 0.00000 {?} {295.HA} 4.27700 0.08700 0.09400 ++ 0.00000 {?} {295.CA} 61.30900 0.28900 0.28900 EE 0.00000 {?} 1.43960 0.05110 0 {?} 0 2213 {324.HZ2} 7.11900 0.04800 0.06800 ? 0.00000 {?} {296.HG2} 0.22800 0.08200 0.08200 ++ 0.00000 {?} {296.CG} 32.45300 0.23100 0.23100 EE 0.00000 {?} 0.68100 0.03190 0 {?} 0 2214 {324.HD1} 7.28100 0.03900 0.04800 ? 0.00000 {?} {324.HA} 4.49900 0.15300 0.15700 ++ 0.00000 {?} {324.CA} 58.16100 0.27400 0.27400 EE 0.00000 {?} 2.14680 0.06250 0 {?} 0 2215 {282.HD1} 7.19500 0.05900 0.05000 ++ 0.00000 {?} {279.HB} 2.17800 0.15300 0.13600 ++ 0.00000 {?} {279.CB} 30.61700 0.22700 0.22700 EE 0.00000 {?} 1.29650 0.06110 0 {?} 0 2216 {384.HA} 3.81000 0.05700 0.06300 ++ 0.00000 {?} {387.HB1} 2.77300 0.10200 0.11500 ++ 0.00000 {?} {387.CB} 30.61700 0.30600 0.30600 EE 0.00000 {?} 1.40850 0.06190 0 {?} 0 2217 {283.HE1} 1.91500 0.04400 0.04700 ++ 0.00000 {?} {283.HA} 3.98300 0.06000 0.06600 ++ 0.00000 {?} {283.CA} 60.52200 0.29500 0.29500 EE 0.00000 {?} 0.60690 0.04210 0 {?} 0 2218 {322.HD11} 0.70600 0.02400 0.06000 ? 0.00000 {?} {283.HE1} 1.92400 0.07300 0.11800 ++ 0.00000 {?} {283.CE} 17.46200 0.43100 0.43100 EE 0.00000 {?} 17.57310 1.07660 0 {?} 0 2219 {295.HE1} 7.56900 0.02600 0.05400 ? 0.00000 {?} {287.HB2} 2.72000 0.06200 0.11500 ? 0.00000 {?} {287.CB} 38.22400 0.34800 0.34800 EE 0.00000 {?} 0.61120 0.05920 0 {?} 0 2220 {?} 1.69500 0.05200 0.07400 ++ 0.00000 {?} {?} 1.22300 0.08200 0.11900 ++ 0.00000 {?} {?} 20.64800 0.41300 0.41300 EE 0.00000 {?} 6.18540 0.21760 0 {?} 0 2221 {327.HB2} 2.79100 0.02900 0.06800 ? 0.00000 {?} {358.HA} 4.60100 0.05500 0.11300 ? 0.00000 {?} {358.CA} 55.53800 0.47000 0.47000 EE 0.00000 {?} 3.32050 0.17650 0 {?} 0 2222 {327.HB1} 3.14100 0.03400 0.07200 ++ 0.00000 {?} {358.HA} 4.59800 0.03200 0.09700 ? 0.00000 {?} {358.CA} 55.53800 0.48500 0.48500 EE 0.00000 {?} 0.87590 0.07760 0 {?} 0 2223 {328.HD1} 3.57600 0.05800 0.05800 ++ 0.00000 {?} {357.HA} 4.29000 0.08000 0.07500 ++ 0.00000 {?} {357.CA} 55.01300 0.24000 0.24000 EE 0.00000 {?} 1.24450 0.06930 0 {?} 0 2224 {328.HD1} 4.57500 0.06900 0.06900 ? 0.00000 {?} {328.HD2} 3.55900 0.09300 0.12700 ? 0.00000 {?} {328.CD} 50.55300 0.41100 0.41100 EE 0.00000 {?} 3.95160 0.08070 0 {?} 0 2225 {357.HA} 4.26900 0.03300 0.06600 ? 0.00000 {?} {357.HG} 1.78300 0.09200 0.15900 ? 0.00000 {?} {357.CG} 27.20600 0.48400 0.48400 EE 0.00000 {?} 9.34810 0.25600 0 {?} 0 2226 {357.HD21} 0.80600 0.01600 0.07000 ? 0.00000 {?} {357.HG} 1.79400 0.08900 0.15700 ? 0.00000 {?} {357.CG} 27.20600 0.50900 0.50900 EE 0.00000 {?} 16.54320 1.09530 0 {?} 0 2227 {329.HA} 4.47700 0.05100 0.06500 ? 0.00000 {?} {357.HD21} 0.79800 0.12700 0.12700 ? 0.00000 {?} {357.CD2} 23.27100 0.36400 0.36400 EE 0.00000 {?} 12.22260 0.29130 0 {?} 0 2228 {383.HG11} 1.20900 0.05400 0.05400 ? 0.00000 {?} {354.HG21} 0.80600 0.04200 0.06500 ++ 0.00000 {?} {354.CG2} 18.28700 0.36300 0.36300 EE 0.00000 {?} 1.27890 0.08610 0 {?} 0 2229 {343.HA} 4.20900 0.04200 0.04700 ++ 0.00000 {?} {354.HB} 1.66800 0.11300 0.12100 ++ 0.00000 {?} {354.CB} 39.53600 0.29900 0.29900 EE 0.00000 {?} 1.55460 0.07440 0 {?} 0 2230 {?} 0.81200 0.03600 0.07300 ++ 0.00000 {?} {?} 2.85800 0.08500 0.11600 ++ 0.00000 {?} {?} 29.30500 0.36500 0.36500 EE 0.00000 {?} 1.22250 0.06010 0 {?} 0 2231 {?} 1.64300 0.02900 0.03400 ? 0.00000 {?} {?} 2.85800 0.02300 0.07600 ? 0.00000 {?} {?} 29.30500 0.35100 0.35100 EE 0.00000 {?} 0.16740 0.03780 0 {?} 0 2232 {352.HA} 4.54800 0.04300 0.06300 ++ 0.00000 {?} {352.HB2} 1.72600 0.14000 0.18900 ? 0.00000 {?} {352.CB} 31.40300 0.42500 0.42500 EE 0.00000 {?} 8.23170 0.14670 0 {?} 0 2233 {386.HD21} 0.82800 0.04100 0.09500 ? 0.00000 {?} {352.HB1} 2.08200 0.06000 0.10600 ? 0.00000 {?} {352.CB} 31.40300 0.42500 0.42500 EE 0.00000 {?} 2.18520 0.11440 0 {?} 0 2234 {344.HB1} 2.15700 0.02500 0.05200 ? 0.00000 {?} {348.HD1} 1.69500 0.04700 0.10300 ? 0.00000 {?} {348.CD} 28.78000 0.38800 0.38800 EE 0.00000 {?} 8.94780 0.75280 0 {?} 0 2235 {348.HD1} 1.69100 0.02100 0.06600 ? 0.00000 {?} {344.HG1} 2.33300 0.03700 0.09300 ? 0.00000 {?} {344.CG} 36.38800 0.50900 0.50900 EE 0.00000 {?} 3.49510 0.36030 0 {?} 0 2236 {328.HB2} 2.20400 0.05100 0.07000 ? 0.00000 {?} {383.HG21} 0.71400 0.07300 0.08700 ++ 0.00000 {?} {383.CG2} 16.97500 0.31700 0.31700 EE 0.00000 {?} 2.15490 0.08490 0 {?} 0 2237 {342.HA} 4.57100 0.04000 0.05200 ++ 0.00000 {?} {345.HB1} 3.28500 0.06700 0.10600 ? 0.00000 {?} {345.CB} 39.27300 0.39700 0.39700 EE 0.00000 {?} 1.11080 0.05180 0 {?} 0 2238 {295.HD1} 7.20400 0.07400 0.07400 ? 0.00000 {?} {290.HA} 4.47200 0.09500 0.11500 ? 0.00000 {?} {290.CA} 60.78400 0.28700 0.28700 EE 0.00000 {?} 2.13870 0.05550 0 {?} 0 2239 {?} 1.66900 0.05000 0.04900 ++ 0.00000 {?} {?} 4.57200 0.07800 0.07600 ++ 0.00000 {?} {?} 66.03100 0.25100 0.25100 EE 0.00000 {?} 0.42400 0.03610 0 {?} 0 2240 {328.HG2} 1.96600 0.05600 0.07800 ? 0.00000 {?} {383.HG21} 0.71300 0.09000 0.10800 ++ 0.00000 {?} {383.CG2} 16.97500 0.32400 0.32400 EE 0.00000 {?} 3.44630 0.11610 0 {?} 0 2241 {?} 2.40400 0.05000 0.05400 ++ 0.00000 {?} {?} 0.16900 0.08800 0.09500 ++ 0.00000 {?} {?} 7.79400 0.28800 0.28800 EE 0.00000 {?} 0.87790 0.03790 0 {?} 0 2242 {328.HB2} 2.19400 0.04500 0.05800 ? 0.00000 {?} {357.HD21} 0.81200 0.06600 0.09100 ++ 0.00000 {?} {357.CD2} 23.27100 0.31900 0.31900 EE 0.00000 {?} 1.61120 0.07570 0 {?} 0 2243 {328.HD1} 4.56400 0.07700 0.06600 ++ 0.00000 {?} {327.HA} 5.48500 0.13400 0.13400 ++ 0.00000 {?} {327.CA} 52.39000 0.20800 0.20800 EE 0.00000 {?} 3.83740 0.12640 0 {?} 0 2244 {328.HA} 4.51900 0.01700 0.09100 ? 0.00000 {?} {383.HD11} 0.16300 0.06200 0.14800 ? 0.00000 {?} {383.CD1} 7.70800 0.48600 0.48600 EE 0.00000 {?} 3.98060 0.31160 0 {?} 0 2245 {320.HA} 5.02900 0.03100 0.08300 ? 0.00000 {?} {304.HD11} 0.96700 0.10500 0.14400 ++ 0.00000 {?} {304.CD1} 13.47800 0.36500 0.36500 EE 0.00000 {?} 2.36670 0.10930 0 {?} 0 2246 {342.HB2} 3.14000 0.03900 0.05700 ? 0.00000 {?} {354.HD11} 0.92700 0.03900 0.12100 ? 0.00000 {?} {354.CD1} 15.05100 0.32800 0.32800 EE 0.00000 {?} 0.98000 0.08080 0 {?} 0 2247 {321.HA} 4.75800 0.05400 0.06600 ++ 0.00000 {?} {322.HD11} 0.72100 0.09600 0.11000 ++ 0.00000 {?} {322.CD1} 15.31300 0.34000 0.34000 EE 0.00000 {?} 2.74420 0.10050 0 {?} 0 2248 {324.HH2} 6.78100 0.01500 0.04400 ? 0.00000 {?} {322.HD11} 0.71300 0.07300 0.08300 ++ 0.00000 {?} {322.CD1} 15.31300 0.30000 0.30000 EE 0.00000 {?} 0.39100 0.04410 0 {?} 0 2249 {303.HD11} 0.80300 0.00900 0.08800 ? 0.00000 {?} {322.HG21} -0.51400 0.06600 0.13800 ? 0.00000 {?} {322.CG2} 16.28600 0.46600 0.46600 EE 0.00000 {?} 2.92480 0.33790 0 {?} 0 2250 {360.HA} 5.16800 0.06300 0.08900 ++ 0.00000 {?} {322.HG21} -0.51300 0.09400 0.15200 ? 0.00000 {?} {322.CG2} 16.10000 0.40100 0.40100 EE 0.00000 {?} 3.39570 0.10970 0 {?} 0 2251 {321.HA} 4.73300 0.03600 0.08400 ? 0.00000 {?} {304.HG21} 0.94700 0.07400 0.14000 ++ 0.00000 {?} {304.CG2} 16.88700 0.44800 0.44800 EE 0.00000 {?} 3.55540 0.15710 0 {?} 0 2252 {384.HA} 3.78700 0.05600 0.06400 ++ 0.00000 {?} {383.HG21} 0.71700 0.10200 0.12100 ? 0.00000 {?} {383.CG2} 16.88700 0.31900 0.31900 EE 0.00000 {?} 2.17810 0.08730 0 {?} 0 2253 {383.HA} 4.51900 0.07700 0.07700 ? 0.00000 {?} {383.HG21} 0.70600 0.06400 0.11400 ++ 0.00000 {?} {383.CG2} 16.88700 0.44300 0.44300 EE 0.00000 {?} 10.11790 0.22760 0 {?} 0 2254 {312.HD1} 6.63900 0.03800 0.05700 ++ 0.00000 {?} {383.HG21} 0.70900 0.04200 0.09000 ? 0.00000 {?} {383.CG2} 16.88700 0.39100 0.39100 EE 0.00000 {?} 0.64300 0.04340 0 {?} 0 2255 {342.HD1} 7.43000 0.04800 0.05800 ++ 0.00000 {?} {383.HG21} 0.70200 0.08300 0.11000 ++ 0.00000 {?} {383.CG2} 16.88700 0.32500 0.32500 EE 0.00000 {?} 0.95650 0.04170 0 {?} 0 2256 {295.HE1} 7.56100 0.03800 0.10800 ? 0.00000 {?} {283.HE1} 1.92300 0.06900 0.13000 ++ 0.00000 {?} {283.CE} 17.41100 0.42300 0.42300 EE 0.00000 {?} 3.27570 0.16580 0 {?} 0 2257 {355.HA} 4.48800 0.04800 0.07300 ? 0.00000 {?} {354.HG21} 0.81400 0.07700 0.12000 ++ 0.00000 {?} {354.CG2} 18.19800 0.40800 0.40800 EE 0.00000 {?} 2.32620 0.09090 0 {?} 0 2258 {357.HA} 4.28100 0.04900 0.06200 ? 0.00000 {?} {354.HG21} 0.82500 0.07200 0.08900 ++ 0.00000 {?} {354.CG2} 18.19800 0.36400 0.36400 EE 0.00000 {?} 1.25810 0.06400 0 {?} 0 2259 {362.HA} 4.47900 0.03800 0.09700 ? 0.00000 {?} {363.HG11} 0.77300 0.05200 0.12800 ++ 0.00000 {?} {363.CG1} 20.03300 0.48200 0.48200 EE 0.00000 {?} 6.54670 0.26270 0 {?} 0 2260 {323.HA} 4.87900 0.04800 0.06900 ? 0.00000 {?} {363.HG11} 0.76600 0.08000 0.12700 ++ 0.00000 {?} {363.CG1} 20.03300 0.43200 0.43200 EE 0.00000 {?} 10.86220 0.48340 0 {?} 0 2261 {321.HA} 4.73900 0.04400 0.05900 ? 0.00000 {?} {363.HG11} 0.77200 0.06800 0.10000 ++ 0.00000 {?} {363.CG1} 20.03300 0.37800 0.37800 EE 0.00000 {?} 2.79550 0.12700 0 {?} 0 2262 {295.HE1} 7.57400 0.05800 0.08700 ++ 0.00000 {?} {290.HG21} 1.21800 0.08600 0.11900 ++ 0.00000 {?} {290.CG2} 20.72000 0.39100 0.39100 EE 0.00000 {?} 2.96830 0.10810 0 {?} 0 2263 {286.HE1} 7.10600 0.05700 0.05700 ? 0.00000 {?} {286.HA} 4.16400 0.11000 0.11000 ++ 0.00000 {?} {286.CA} 60.15600 0.26400 0.26400 EE 0.00000 {?} 1.93670 0.05880 0 {?} 0 2264 {289.HB2} 1.92800 0.05800 0.05800 ? 0.00000 {?} {286.HA} 4.16400 0.06200 0.09000 ++ 0.00000 {?} {286.CA} 59.89400 0.40900 0.40900 EE 0.00000 {?} 2.21610 0.09630 0 {?} 0 2265 {320.HB1} 2.75600 0.03800 0.07600 ? 0.00000 {?} {363.HG21} 0.90000 0.05700 0.09500 ++ 0.00000 {?} {363.CG2} 21.08200 0.40000 0.40000 EE 0.00000 {?} 2.05320 0.12110 0 {?} 0 2266 {269.HN} 8.31800 0.05800 0.07500 ++ 0.00000 {?} {269.HG11} 0.93300 0.10400 0.13700 ++ 0.00000 {?} {269.CG1} 21.08200 0.35100 0.35100 EE 0.00000 {?} 2.17860 0.07590 0 {?} 0 2267 {306.HA} 4.39600 0.03000 0.07700 ? 0.00000 {?} {307.HG21} 0.80500 0.03900 0.09700 ? 0.00000 {?} {307.CG2} 21.34500 0.45700 0.45700 EE 0.00000 {?} 2.45970 0.15930 0 {?} 0 2268 {307.HA} 4.92200 0.05100 0.09100 ? 0.00000 {?} {308.HG11} 0.64100 0.08400 0.12000 ? 0.00000 {?} {308.CG1} 21.60700 0.39000 0.39000 EE 0.00000 {?} 2.57440 0.09670 0 {?} 0 2269 {390.HB} 4.24000 0.02700 0.07400 ? 0.00000 {?} {390.HG21} 1.21800 0.05700 0.17700 ? 0.00000 {?} {390.CG2} 21.69000 0.51900 0.51900 EE 0.00000 {?} 64.95980 3.61530 0 {?} 0 2270 {317.HD1} 6.84900 0.06400 0.08700 ++ 0.00000 {?} {316.HG21} 1.03700 0.07300 0.10600 ++ 0.00000 {?} {316.CG2} 22.03100 0.35500 0.35500 EE 0.00000 {?} 2.24560 0.07280 0 {?} 0 2271 {505.H5'} 4.27700 0.03200 0.08300 ? 0.00000 {?} {382.HD21} 0.05300 0.07600 0.12300 ++ 0.00000 {?} {382.CD2} 22.13100 0.39100 0.39100 EE 0.00000 {?} 1.02860 0.05650 0 {?} 0 2272 {364.HB2} 3.44100 0.05200 0.05600 ++ 0.00000 {?} {382.HD21} 0.08100 0.08600 0.09500 ++ 0.00000 {?} {382.CD2} 22.13100 0.29800 0.29800 EE 0.00000 {?} 1.09080 0.05000 0 {?} 0 2273 {315.HA} 4.52200 0.03900 0.08800 ? 0.00000 {?} {316.HG21} 1.04800 0.06300 0.10100 ++ 0.00000 {?} {316.CG2} 22.03100 0.41300 0.41300 EE 0.00000 {?} 2.91300 0.13960 0 {?} 0 2274 {?} 4.59700 0.02600 0.04700 ? 0.00000 {?} {?} 1.04700 0.05000 0.09000 ? 0.00000 {?} {?} 22.03100 0.39200 0.39200 EE 0.00000 {?} 0.84270 0.07670 0 {?} 0 2275 {304.HA} 3.56900 0.02900 0.08600 ? 0.00000 {?} {319.HG21} 0.74300 0.03700 0.09900 ? 0.00000 {?} {319.CG2} 22.52600 0.49600 0.49600 EE 0.00000 {?} 8.13550 0.55160 0 {?} 0 2276 {321.HA} 4.74800 0.05100 0.07300 ++ 0.00000 {?} {319.HG21} 0.74900 0.07400 0.15000 ++ 0.00000 {?} {319.CG2} 22.48600 0.42500 0.42500 EE 0.00000 {?} 3.52460 0.10630 0 {?} 0 2277 {320.HA} 5.02000 0.05600 0.07400 ++ 0.00000 {?} {319.HG21} 0.74900 0.05500 0.11800 ++ 0.00000 {?} {319.CG2} 22.48600 0.38500 0.38500 EE 0.00000 {?} 1.53960 0.08770 0 {?} 0 2278 {?} 4.49800 0.08100 0.10700 ? 0.00000 {?} {?} 3.94600 0.04900 0.14200 ? 0.00000 {?} {?} 65.40000 0.35300 0.35300 EE 0.00000 {?} 1.73420 0.06510 0 {?} 0 2279 {360.HA} 5.17200 0.04200 0.06000 ++ 0.00000 {?} {360.HB1} 1.65900 0.09100 0.12800 ? 0.00000 {?} {360.CB} 32.62100 0.37700 0.37700 EE 0.00000 {?} 1.68640 0.06690 0 {?} 0 2280 {360.HA} 5.17600 0.07000 0.08100 ++ 0.00000 {?} {360.HB2} 0.99700 0.12900 0.20500 ? 0.00000 {?} {360.CB} 32.62100 0.33400 0.33400 EE 0.00000 {?} 3.74620 0.09400 0 {?} 0 2281 {322.HG21} -0.51700 0.06100 0.07100 ++ 0.00000 {?} {360.HB2} 0.99500 0.07600 0.12500 ? 0.00000 {?} {360.CB} 32.62100 0.33100 0.33100 EE 0.00000 {?} 1.56860 0.05680 0 {?} 0 2282 {324.HA} 4.49400 0.05300 0.05900 ++ 0.00000 {?} {360.HB2} 0.99200 0.07200 0.09500 ? 0.00000 {?} {360.CB} 32.62100 0.29700 0.29700 EE 0.00000 {?} 1.55190 0.06900 0 {?} 0 2283 {360.HB2} 0.95000 0.05400 0.05700 ++ 0.00000 {?} {360.HD2} 3.25600 0.09400 0.09900 ++ 0.00000 {?} {360.CD} 48.35500 0.28300 0.28300 EE 0.00000 {?} 1.13890 0.04800 0 {?} 0 2284 {324.HH2} 6.78100 0.05700 0.07000 ++ 0.00000 {?} {296.HA} 3.02000 0.07400 0.08900 ++ 0.00000 {?} {296.CA} 59.10700 0.34000 0.34000 EE 0.00000 {?} 1.06700 0.03700 0 {?} 0 2285 {295.HD1} 7.20100 0.05300 0.05200 ++ 0.00000 {?} {296.HA} 3.02800 0.12100 0.11900 ++ 0.00000 {?} {296.CA} 59.10700 0.25900 0.25900 EE 0.00000 {?} 1.20230 0.06380 0 {?} 0 2286 {382.HD11} 0.09900 0.08300 0.09400 ? 0.00000 {?} {362.HD21} 0.53600 0.09500 0.10700 ++ 0.00000 {?} {362.CD2} 22.91800 0.31300 0.31300 EE 0.00000 {?} 2.36270 0.06500 0 {?} 0 2287 {279.HG11} 0.79700 0.06100 0.08900 ? 0.00000 {?} {279.HG21} 0.97700 0.07100 0.15600 ? 0.00000 {?} {279.CG2} 23.18000 0.51600 0.51600 EE 0.00000 {?} 101.99520 1.91530 0 {?} 0 2288 {314.HA} 4.50700 0.05600 0.09000 ? 0.00000 {?} {309.HD21} 0.74500 0.05800 0.08200 ++ 0.00000 {?} {309.CD2} 23.70500 0.39600 0.39600 EE 0.00000 {?} 4.24560 0.17210 0 {?} 0 2289 {324.HH2} 6.77800 0.08100 0.11800 ++ 0.00000 {?} {299.HG11} 0.67200 0.06000 0.08800 ++ 0.00000 {?} {299.CG1} 24.15900 0.40200 0.40200 EE 0.00000 {?} 2.82740 0.09340 0 {?} 0 2290 {282.HB2} 3.27900 0.05100 0.07500 ++ 0.00000 {?} {389.HD21} 0.63500 0.04200 0.10500 ? 0.00000 {?} {389.CD2} 24.22900 0.43300 0.43300 EE 0.00000 {?} 3.43760 0.16750 0 {?} 0 2291 {283.HE1} 1.92200 0.03400 0.08000 ? 0.00000 {?} {303.HD21} 0.62500 0.06700 0.12100 ? 0.00000 {?} {303.CD2} 24.75400 0.48800 0.48800 EE 0.00000 {?} 9.93440 0.28240 0 {?} 0 2292 {282.HB2} 3.29700 0.04300 0.07000 ? 0.00000 {?} {303.HD21} 0.63500 0.06500 0.09000 ++ 0.00000 {?} {303.CD2} 24.75400 0.43400 0.43400 EE 0.00000 {?} 3.29320 0.15620 0 {?} 0 2293 {282.HB1} 3.48100 0.03900 0.07800 ? 0.00000 {?} {303.HD21} 0.63000 0.06400 0.09200 ++ 0.00000 {?} {303.CD2} 24.75400 0.42400 0.42400 EE 0.00000 {?} 1.61430 0.09160 0 {?} 0 2294 {279.HA} 3.60700 0.02300 0.07300 ? 0.00000 {?} {303.HD21} 0.63100 0.03900 0.09700 ? 0.00000 {?} {303.CD2} 24.75400 0.46300 0.46300 EE 0.00000 {?} 2.53440 0.17070 0 {?} 0 2295 {291.HB2} 1.77200 0.03100 0.08700 ? 0.00000 {?} {294.HG1} 1.15200 0.07100 0.13500 ? 0.00000 {?} {294.CG} 24.75400 0.47300 0.47300 EE 0.00000 {?} 8.60630 0.24580 0 {?} 0 2296 {328.HD1} 3.63400 0.03200 0.06200 ? 0.00000 {?} {328.HG1} 1.99900 0.06600 0.10100 ? 0.00000 {?} {328.CG} 24.75400 0.40200 0.40200 EE 0.00000 {?} 2.03670 0.12510 0 {?} 0 2297 {387.HB1} 2.77100 0.03700 0.04400 ++ 0.00000 {?} {362.HD11} 0.69100 0.06500 0.07800 ? 0.00000 {?} {362.CD1} 25.17800 0.33400 0.33400 EE 0.00000 {?} 1.09330 0.07820 0 {?} 0 2298 {301.HD1} 1.75900 0.02400 0.07500 ? 0.00000 {?} {301.HG1} 1.64000 0.05800 0.10900 ? 0.00000 {?} {301.CG} 25.01600 0.51500 0.51500 EE 0.00000 {?} 29.66770 1.85120 0 {?} 0 2299 {302.HA} 4.18000 0.02900 0.06800 ? 0.00000 {?} {301.HG1} 1.64700 0.04800 0.11300 ? 0.00000 {?} {301.CG} 25.01600 0.38900 0.38900 EE 0.00000 {?} 1.30020 0.11180 0 {?} 0 2300 {337.HA1} 4.39300 0.02800 0.06800 ? 0.00000 {?} {333.HG1} 1.36500 0.09600 0.12800 ? 0.00000 {?} {333.CG} 25.01600 0.40600 0.40600 EE 0.00000 {?} 3.78340 0.16210 0 {?} 0 2301 {342.HD1} 7.43300 0.04400 0.07200 ++ 0.00000 {?} {357.HD11} 1.01400 0.07400 0.11900 ++ 0.00000 {?} {357.CD1} 25.63000 0.40200 0.40200 EE 0.00000 {?} 1.80580 0.06120 0 {?} 0 2302 {317.HE1} 6.91900 0.05500 0.05600 ++ 0.00000 {?} {315.HG2} 1.14900 0.09300 0.09900 ++ 0.00000 {?} {315.CG} 25.54000 0.28200 0.28200 EE 0.00000 {?} 1.58770 0.06040 0 {?} 0 2303 {333.HA} 4.72000 0.05500 0.07100 ? 0.00000 {?} {333.HE1} 2.93600 0.06400 0.10900 ++ 0.00000 {?} {333.CE} 41.79900 0.40800 0.40800 EE 0.00000 {?} 1.34300 0.06310 0 {?} 0 2304 {?} 4.85300 0.02200 0.06600 ? 0.00000 {?} {?} 2.98700 0.06400 0.13600 ? 0.00000 {?} {?} 41.79900 0.47800 0.47800 EE 0.00000 {?} 27.97050 1.64310 0 {?} 0 2305 {?} 4.40500 0.06600 0.06600 ? 0.00000 {?} {?} 1.01400 0.04800 0.12700 ? 0.00000 {?} {?} 25.54000 0.44900 0.44900 EE 0.00000 {?} 6.95090 0.21080 0 {?} 0 2306 {?} 2.87800 0.06700 0.07700 ++ 0.00000 {?} {?} 1.02600 0.08600 0.10700 ? 0.00000 {?} {?} 25.54000 0.31400 0.31400 EE 0.00000 {?} 1.82900 0.07180 0 {?} 0 2307 {277.HB1} 2.29900 0.04400 0.05400 ++ 0.00000 {?} {389.HD11} 0.65300 0.07500 0.08900 ++ 0.00000 {?} {389.CD1} 25.27800 0.35200 0.35200 EE 0.00000 {?} 1.68630 0.07330 0 {?} 0 2308 {282.HZ} 7.34800 0.02300 0.06000 ? 0.00000 {?} {389.HD21} 0.65900 0.09600 0.10300 ++ 0.00000 {?} {389.CD1} 25.54000 0.29500 0.29500 EE 0.00000 {?} 0.87200 0.05840 0 {?} 0 2309 {343.HG} 1.66800 0.09900 0.12500 ? 0.00000 {?} {357.HD11} 1.00300 0.08300 0.15900 ? 0.00000 {?} {357.CD1} 25.54000 0.51900 0.51900 EE 0.00000 {?} 295.23981 3.41320 0 {?} 0 2310 {343.HB2} 1.57100 0.02000 0.06100 ? 0.00000 {?} {357.HD11} 0.99400 0.07100 0.11000 ? 0.00000 {?} {357.CD1} 25.54000 0.51600 0.51600 EE 0.00000 {?} 38.75680 2.08150 0 {?} 0 2311 {329.HG1} 1.69200 0.05900 0.10500 ? 0.00000 {?} {329.HG2} 1.55900 0.04700 0.11700 ? 0.00000 {?} {329.CG} 25.80300 0.51500 0.51500 EE 0.00000 {?} 59.23660 1.71920 0 {?} 0 2312 {362.HD21} 0.54700 0.01400 0.07400 ? 0.00000 {?} {303.HD11} 0.74200 0.07300 0.16200 ? 0.00000 {?} {303.CD1} 26.06500 0.50300 0.50300 EE 0.00000 {?} 9.15500 0.63210 0 {?} 0 2313 {316.HG21} 1.03300 0.02300 0.07000 ? 0.00000 {?} {309.HD11} 0.78000 0.05000 0.13500 ? 0.00000 {?} {309.CD1} 26.06500 0.51100 0.51100 EE 0.00000 {?} 9.54120 0.58080 0 {?} 0 2314 {300.HA} 4.16900 0.04400 0.08100 ? 0.00000 {?} {303.HD11} 0.75600 0.07100 0.13000 ++ 0.00000 {?} {303.CD1} 26.06500 0.47200 0.47200 EE 0.00000 {?} 10.40820 0.27370 0 {?} 0 2315 {?} 4.60000 0.02300 0.06400 ? 0.00000 {?} {?} 0.77600 0.06400 0.09800 ++ 0.00000 {?} {?} 26.06500 0.40800 0.40800 EE 0.00000 {?} 1.47590 0.15130 0 {?} 0 2316 {314.HA} 4.50800 0.02500 0.07200 ? 0.00000 {?} {309.HD11} 0.78100 0.04700 0.10000 ++ 0.00000 {?} {309.CD1} 26.22700 0.48700 0.48700 EE 0.00000 {?} 1.63250 0.10660 0 {?} 0 2317 {283.HA} 3.99200 0.05700 0.05700 ? 0.00000 {?} {303.HD11} 0.77100 0.05800 0.08000 ++ 0.00000 {?} {303.CD1} 26.06500 0.37100 0.37100 EE 0.00000 {?} 1.06920 0.06360 0 {?} 0 2318 {388.HD1} 7.14300 0.03700 0.05100 ? 0.00000 {?} {309.HD11} 0.78800 0.06200 0.10500 ++ 0.00000 {?} {309.CD1} 26.06500 0.39200 0.39200 EE 0.00000 {?} 5.47910 0.32900 0 {?} 0 2319 {278.HG21} 0.96100 0.03700 0.06200 ? 0.00000 {?} {311.HG1} 1.22100 0.05700 0.11300 ? 0.00000 {?} {311.CG} 26.06500 0.41200 0.41200 EE 0.00000 {?} 1.33410 0.06740 0 {?} 0 2320 {?} 7.32000 0.03100 0.06400 ? 0.00000 {?} {?} 1.56400 0.13400 0.20600 ++ 0.00000 {?} {?} 26.58900 0.39000 0.39000 EE 0.00000 {?} 3.17010 0.12320 0 {?} 0 2321 {351.HA} 4.92200 0.04200 0.05700 ? 0.00000 {?} {347.HG2} 1.67200 0.07700 0.10600 ++ 0.00000 {?} {347.CG} 26.85200 0.36000 0.36000 EE 0.00000 {?} 1.15770 0.07260 0 {?} 0 2322 {351.HA} 4.93700 0.04200 0.04800 ++ 0.00000 {?} {347.HG1} 1.78600 0.06400 0.08100 ++ 0.00000 {?} {347.CG} 26.85200 0.34700 0.34700 EE 0.00000 {?} 0.95730 0.06860 0 {?} 0 2323 {322.HB} 1.41000 0.03100 0.07800 ? 0.00000 {?} {322.HG11} 1.28000 0.08100 0.11800 ++ 0.00000 {?} {322.CG1} 27.11400 0.47800 0.47800 EE 0.00000 {?} 7.65790 0.26500 0 {?} 0 2324 {362.HA} 4.45800 0.06000 0.06600 ++ 0.00000 {?} {322.HG11} 1.30400 0.07200 0.08100 ++ 0.00000 {?} {322.CG1} 27.11400 0.29900 0.29900 EE 0.00000 {?} 1.15180 0.04620 0 {?} 0 2325 {298.HG2} 2.47500 0.01600 0.06700 ? 0.00000 {?} {298.HB1} 2.29100 0.06000 0.13600 ? 0.00000 {?} {298.CB} 28.68700 0.49800 0.49800 EE 0.00000 {?} 6.76790 0.50940 0 {?} 0 2326 {298.HG1} 2.63300 0.02800 0.05300 ++ 0.00000 {?} {298.HB2} 2.21800 0.05000 0.10700 ? 0.00000 {?} {298.CB} 28.68700 0.49200 0.49200 EE 0.00000 {?} 5.19950 0.29060 0 {?} 0 2327 {365.HA} 4.75300 0.06500 0.07400 ? 0.00000 {?} {365.HB1} 2.11600 0.06100 0.06800 ++ 0.00000 {?} {365.CB} 28.68700 0.29800 0.29800 EE 0.00000 {?} 2.04300 0.08920 0 {?} 0 2328 {354.HA} 3.78400 0.04000 0.10300 ++ 0.00000 {?} {354.HG12} 0.63200 0.07600 0.12300 ? 0.00000 {?} {354.CG1} 28.58700 0.45600 0.45600 EE 0.00000 {?} 8.72470 0.23510 0 {?} 0 2329 {?} 4.58700 0.04100 0.05500 ++ 0.00000 {?} {?} 2.87000 0.07600 0.11100 ++ 0.00000 {?} {?} 29.21200 0.38500 0.38500 EE 0.00000 {?} 1.40130 0.06660 0 {?} 0 2330 {?} 1.81400 0.05900 0.07500 ++ 0.00000 {?} {?} 2.86400 0.08400 0.11600 ++ 0.00000 {?} {?} 29.30400 0.38400 0.38400 EE 0.00000 {?} 1.83130 0.05590 0 {?} 0 2331 {?} 3.38600 0.03900 0.05500 ++ 0.00000 {?} {?} 3.14500 0.05100 0.11200 ? 0.00000 {?} {?} 29.73600 0.40100 0.40100 EE 0.00000 {?} 1.34040 0.07270 0 {?} 0 2332 {324.HZ2} 7.12200 0.03200 0.06000 ? 0.00000 {?} {300.HA} 4.16300 0.04700 0.10200 ? 0.00000 {?} {300.CA} 62.88000 0.32900 0.32900 EE 0.00000 {?} 0.44780 0.04510 0 {?} 0 2333 {282.HZ} 7.34200 0.04000 0.05100 ? 0.00000 {?} {299.HA} 3.19300 0.09000 0.12300 ++ 0.00000 {?} {299.CA} 65.40000 0.35200 0.35200 EE 0.00000 {?} 1.09350 0.04450 0 {?} 0 2334 {?} 4.42000 0.01000 0.05400 ? 0.00000 {?} {?} 4.24300 0.06400 0.09400 ++ 0.00000 {?} {?} 70.97000 0.43800 0.43800 EE 0.00000 {?} 1.09920 0.17910 0 {?} 0 2335 {?} 1.10300 0.06700 0.06800 ? 0.00000 {?} {?} 4.20600 0.12700 0.15100 ++ 0.00000 {?} {?} 70.38300 0.32100 0.32100 EE 0.00000 {?} 3.66830 0.09380 0 {?} 0 2336 {310.HA} 4.89200 0.05600 0.07900 ++ 0.00000 {?} {310.HB} 3.38800 0.09700 0.16600 ++ 0.00000 {?} {310.CB} 68.81000 0.38200 0.38200 EE 0.00000 {?} 7.12790 0.21840 0 {?} 0 2337 {282.HA} 4.31900 0.03900 0.04700 ++ 0.00000 {?} {279.HA} 3.60500 0.09500 0.13000 ++ 0.00000 {?} {279.CA} 65.92500 0.33200 0.33200 EE 0.00000 {?} 1.68000 0.07370 0 {?} 0 2338 {317.HD1} 6.85800 0.06200 0.09300 ? 0.00000 {?} {364.HB1} 3.63900 0.08000 0.11900 ++ 0.00000 {?} {364.CB} 65.40000 0.37000 0.37000 EE 0.00000 {?} 1.79700 0.05420 0 {?} 0 2339 {317.HD1} 6.83500 0.06800 0.07400 ++ 0.00000 {?} {364.HB2} 3.44500 0.10000 0.11100 ++ 0.00000 {?} {364.CB} 65.40000 0.29400 0.29400 EE 0.00000 {?} 2.40290 0.06400 0 {?} 0 2340 {319.HG21} 0.74000 0.04500 0.08600 ? 0.00000 {?} {304.HA} 3.56400 0.08500 0.15100 ? 0.00000 {?} {304.CA} 64.61400 0.49000 0.49000 EE 0.00000 {?} 18.62940 0.42880 0 {?} 0 2341 {304.HG12} 0.81500 0.02400 0.08000 ? 0.00000 {?} {304.HA} 3.56100 0.06400 0.11300 ? 0.00000 {?} {304.CA} 64.61400 0.45900 0.45900 EE 0.00000 {?} 5.07640 0.30120 0 {?} 0 2342 {319.HB} 2.48400 0.05400 0.08600 ++ 0.00000 {?} {304.HA} 3.56600 0.09100 0.13400 ? 0.00000 {?} {304.CA} 64.61400 0.42200 0.42200 EE 0.00000 {?} 6.50280 0.15790 0 {?} 0 2343 {?} 7.10100 0.04900 0.05600 ++ 0.00000 {?} {?} 4.56800 0.08800 0.09400 ++ 0.00000 {?} {?} 63.04000 0.28700 0.28700 EE 0.00000 {?} 1.06950 0.04290 0 {?} 0 2344 {317.HD1} 6.83800 0.06400 0.06200 ++ 0.00000 {?} {379.HA} 4.54700 0.09000 0.08600 ++ 0.00000 {?} {379.CA} 63.04000 0.25500 0.25500 EE 0.00000 {?} 0.87740 0.05180 0 {?} 0 2345 {299.HG21} 0.88000 0.06300 0.08100 ++ 0.00000 {?} {290.HB} 3.97100 0.14000 0.19100 ? 0.00000 {?} {290.CB} 70.22800 0.39500 0.39500 EE 0.00000 {?} 4.79510 0.09420 0 {?} 0 2346 {?} 2.02200 0.01300 0.06300 ? 0.00000 {?} {?} 3.79900 0.09900 0.12900 ++ 0.00000 {?} {?} 67.60500 0.36200 0.36200 EE 0.00000 {?} 0.73020 0.07510 0 {?} 0 2347 {384.HD1} 4.14100 0.06400 0.06700 ? 0.00000 {?} {384.HA} 3.80500 0.09100 0.09500 ++ 0.00000 {?} {384.CA} 67.60500 0.27800 0.27800 EE 0.00000 {?} 1.42380 0.04950 0 {?} 0 2348 {?} 2.86500 0.05800 0.05800 ++ 0.00000 {?} {?} 4.55200 0.08900 0.08900 ++ 0.00000 {?} {?} 66.03100 0.26200 0.26200 EE 0.00000 {?} 1.04330 0.04640 0 {?} 0 2349 {389.HG} 1.48700 0.05300 0.07400 ? 0.00000 {?} {279.HA} 3.59500 0.10100 0.09200 ++ 0.00000 {?} {279.CA} 66.03100 0.23900 0.23900 EE 0.00000 {?} 0.88970 0.04270 0 {?} 0 2350 {?} 2.46400 0.06400 0.06200 ++ 0.00000 {?} {?} 3.18400 0.10100 0.09800 ++ 0.00000 {?} {?} 65.50600 0.25700 0.25700 EE 0.00000 {?} 0.92460 0.04550 0 {?} 0 2351 {?} 1.75700 0.07100 0.06900 ++ 0.00000 {?} {?} 3.86000 0.06800 0.06700 ++ 0.00000 {?} {?} 63.95000 0.25700 0.25700 EE 0.00000 {?} 0.93030 0.05710 0 {?} 0 2352 {?} 0.74100 0.03400 0.07000 ? 0.00000 {?} {?} 3.88400 0.09200 0.11100 ++ 0.00000 {?} {?} 63.67000 0.32000 0.32000 EE 0.00000 {?} 1.16600 0.05960 0 {?} 0 2353 {324.HE3} 7.94200 0.05000 0.05500 ++ 0.00000 {?} {360.HA} 5.15900 0.11500 0.12700 ++ 0.00000 {?} {360.CA} 61.57100 0.29600 0.29600 EE 0.00000 {?} 1.44570 0.05330 0 {?} 0 2354 {308.HA} 5.29300 0.05200 0.06000 ++ 0.00000 {?} {390.HA} 4.60400 0.08600 0.09400 ++ 0.00000 {?} {390.CA} 61.57100 0.29100 0.29100 EE 0.00000 {?} 1.15640 0.05220 0 {?} 0 2355 {383.HG21} 0.71800 0.03200 0.07100 ? 0.00000 {?} {354.HA} 3.77700 0.07600 0.10200 ++ 0.00000 {?} {354.CA} 61.57100 0.38000 0.38000 EE 0.00000 {?} 1.46160 0.08430 0 {?} 0 2356 {343.HD11} 1.04500 0.04300 0.06400 ? 0.00000 {?} {354.HA} 3.77800 0.10400 0.11900 ++ 0.00000 {?} {354.CA} 61.57100 0.31900 0.31900 EE 0.00000 {?} 1.35780 0.05920 0 {?} 0 2357 {354.HG21} 0.79700 0.02400 0.06900 ? 0.00000 {?} {354.HA} 3.77500 0.06300 0.14700 ? 0.00000 {?} {354.CA} 61.57100 0.49000 0.49000 EE 0.00000 {?} 4.71920 0.27360 0 {?} 0 2358 {295.HE1} 7.55900 0.04100 0.06700 ? 0.00000 {?} {284.HA} 4.33400 0.06600 0.12500 ? 0.00000 {?} {284.CA} 61.04700 0.33200 0.33200 EE 0.00000 {?} 1.22590 0.06330 0 {?} 0 2359 {342.HE1} 7.10900 0.06700 0.06900 ? 0.00000 {?} {330.HB1} 4.51500 0.08600 0.09000 ++ 0.00000 {?} {330.CA} 60.78400 0.28000 0.28000 EE 0.00000 {?} 1.43120 0.04990 0 {?} 0 2360 {295.HE1} 7.55500 0.08000 0.08300 ++ 0.00000 {?} {286.HA} 4.17100 0.11900 0.12500 ++ 0.00000 {?} {286.CA} 60.26000 0.27700 0.27700 EE 0.00000 {?} 2.37370 0.04930 0 {?} 0 2361 {299.HG11} 0.68300 0.04100 0.04900 ++ 0.00000 {?} {286.HA} 4.14600 0.07200 0.10800 ? 0.00000 {?} {286.CA} 60.26000 0.34100 0.34100 EE 0.00000 {?} 1.32890 0.06630 0 {?} 0 2362 {?} 8.92000 0.04900 0.11300 ? 0.00000 {?} {?} 3.91300 0.08700 0.12200 ++ 0.00000 {?} {?} 71.69400 0.42900 0.42900 EE 0.00000 {?} 0.20870 0.00050 0 {?} 0 2363 {?} 2.89000 0.05000 0.05000 ++ 0.00000 {?} {?} 0.16400 0.09600 0.09500 ++ 0.00000 {?} {?} 7.79400 0.25900 0.25900 EE 0.00000 {?} 0.89100 0.04590 0 {?} 0 2364 {319.HB} 2.47900 0.03900 0.04200 ++ 0.00000 {?} {304.HD11} 0.95700 0.07800 0.08500 ++ 0.00000 {?} {304.CD1} 13.56500 0.29600 0.29600 EE 0.00000 {?} 0.79900 0.05350 0 {?} 0 2365 {312.HE1} 6.73900 0.04500 0.06600 ? 0.00000 {?} {354.HD11} 0.92900 0.07700 0.07700 ++ 0.00000 {?} {354.CD1} 15.13900 0.26500 0.26500 EE 0.00000 {?} 1.06110 0.04700 0 {?} 0 2366 {?} 7.43200 0.05800 0.06000 ++ 0.00000 {?} {?} 0.92700 0.11500 0.12100 ++ 0.00000 {?} {?} 15.13900 0.27900 0.27900 EE 0.00000 {?} 1.49260 0.04970 0 {?} 0 2367 {324.HB2} 3.02000 0.06100 0.06700 ++ 0.00000 {?} {322.HG21} -0.50900 0.04400 0.10500 ? 0.00000 {?} {322.CG2} 16.18800 0.30500 0.30500 EE 0.00000 {?} 0.99220 0.05560 0 {?} 0 2368 {324.HH2} 6.77600 0.04700 0.04700 ++ 0.00000 {?} {322.HG21} -0.51100 0.07000 0.05300 ++ 0.00000 {?} {322.CG2} 16.18800 0.17700 0.17700 EE 0.00000 {?} 0.48710 0.03510 0 {?} 0 2369 {324.HE3} 7.94100 0.05700 0.06700 ++ 0.00000 {?} {322.HG21} -0.51700 0.08200 0.09600 ++ 0.00000 {?} {322.CG2} 16.18800 0.31700 0.31700 EE 0.00000 {?} 1.41830 0.05890 0 {?} 0 2370 {?} 0.91200 0.06300 0.08000 ++ 0.00000 {?} {?} 2.12000 0.07300 0.10700 ++ 0.00000 {?} {?} 16.97500 0.37300 0.37300 EE 0.00000 {?} 2.02360 0.08050 0 {?} 0 2371 {396.HB2} 2.56300 0.03300 0.06700 ? 0.00000 {?} {396.HE1} 2.11700 0.06400 0.15600 ? 0.00000 {?} {396.CE} 16.97500 0.47000 0.47000 EE 0.00000 {?} 4.62750 0.22180 0 {?} 0 2372 {?} 2.41700 0.05300 0.09700 ? 0.00000 {?} {?} 2.11900 0.05800 0.14700 ? 0.00000 {?} {?} 16.97500 0.48900 0.48900 EE 0.00000 {?} 11.45070 0.34500 0 {?} 0 2373 {300.HA} 4.16300 0.04400 0.04900 ++ 0.00000 {?} {304.HG21} 0.94700 0.06600 0.07800 ++ 0.00000 {?} {304.CG2} 16.97500 0.31500 0.31500 EE 0.00000 {?} 0.97440 0.05820 0 {?} 0 2374 {312.HE1} 6.72700 0.05400 0.05200 ++ 0.00000 {?} {383.HG21} 0.71500 0.09900 0.09600 ++ 0.00000 {?} {383.CG2} 16.97500 0.25300 0.25300 EE 0.00000 {?} 0.80670 0.04500 0 {?} 0 2375 {324.HE3} 7.94800 0.06400 0.08800 ++ 0.00000 {?} {283.HE1} 1.91800 0.08800 0.11900 ++ 0.00000 {?} {283.CE} 17.50000 0.39100 0.39100 EE 0.00000 {?} 2.83170 0.09110 0 {?} 0 2376 {360.HA} 5.16600 0.04900 0.04900 ++ 0.00000 {?} {283.HE1} 1.92900 0.08400 0.08300 ++ 0.00000 {?} {283.CE} 17.50000 0.26100 0.26100 EE 0.00000 {?} 0.67880 0.04630 0 {?} 0 2377 {323.HB1} 2.86100 0.06800 0.08800 ? 0.00000 {?} {381.HE1} 2.04600 0.06600 0.09700 ++ 0.00000 {?} {381.CE} 18.02500 0.41400 0.41400 EE 0.00000 {?} 3.69560 0.11030 0 {?} 0 2378 {361.HG21} 0.22800 0.08700 0.09100 ? 0.00000 {?} {381.HE1} 2.04700 0.06300 0.09500 ++ 0.00000 {?} {381.CE} 18.02500 0.40400 0.40400 EE 0.00000 {?} 3.44020 0.10090 0 {?} 0 2379 {387.HA} 5.04800 0.04000 0.05200 ++ 0.00000 {?} {308.HG21} 0.74200 0.09300 0.11900 ++ 0.00000 {?} {308.CG2} 18.02500 0.36400 0.36400 EE 0.00000 {?} 1.72530 0.07610 0 {?} 0 2380 {336.HA} 4.51500 0.02300 0.05200 ? 0.00000 {?} {335.HB1} 1.52400 0.07900 0.09800 ++ 0.00000 {?} {335.CB} 18.28700 0.35900 0.35900 EE 0.00000 {?} 0.85520 0.07310 0 {?} 0 2381 {329.HB1} 2.12600 0.04600 0.06300 ? 0.00000 {?} {354.HG21} 0.81100 0.04200 0.09400 ? 0.00000 {?} {354.CG2} 18.28700 0.37100 0.37100 EE 0.00000 {?} 1.18820 0.07930 0 {?} 0 2382 {332.HE1} 6.47600 0.05700 0.06700 ++ 0.00000 {?} {340.HG21} 0.80600 0.09000 0.10600 ++ 0.00000 {?} {340.CG2} 20.38600 0.32000 0.32000 EE 0.00000 {?} 1.55950 0.05950 0 {?} 0 2383 {345.HE1} 6.61900 0.06200 0.08500 ? 0.00000 {?} {340.HG21} 0.80800 0.09400 0.11300 ++ 0.00000 {?} {340.CG2} 20.38600 0.35000 0.35000 EE 0.00000 {?} 2.26060 0.06980 0 {?} 0 2384 {345.HD1} 6.71800 0.05100 0.07900 ? 0.00000 {?} {340.HG21} 0.81300 0.09000 0.11600 ++ 0.00000 {?} {340.CG2} 20.38600 0.33200 0.33200 EE 0.00000 {?} 1.74620 0.06340 0 {?} 0 2385 {345.HA} 4.30600 0.06100 0.09000 ? 0.00000 {?} {340.HG21} 0.81900 0.13300 0.15000 ? 0.00000 {?} {340.CG2} 20.38600 0.40600 0.40600 EE 0.00000 {?} 5.61350 0.10290 0 {?} 0 2386 {340.HB} 1.76000 0.05300 0.12100 ? 0.00000 {?} {340.HG21} 0.81800 0.07000 0.14100 ? 0.00000 {?} {340.CG2} 20.38600 0.50300 0.50300 EE 0.00000 {?} 28.35980 0.55250 0 {?} 0 2387 {344.HB2} 2.06700 0.02400 0.07100 ? 0.00000 {?} {340.HG21} 0.79800 0.04800 0.10700 ? 0.00000 {?} {340.CG2} 20.38600 0.49800 0.49800 EE 0.00000 {?} 6.27520 0.45020 0 {?} 0 2388 {344.HB1} 2.15900 0.05300 0.08300 ? 0.00000 {?} {340.HG21} 0.81100 0.05000 0.10900 ? 0.00000 {?} {340.CG2} 20.38600 0.47800 0.47800 EE 0.00000 {?} 7.43230 0.25900 0 {?} 0 2389 {334.HD1} 1.63900 0.08100 0.10700 ? 0.00000 {?} {340.HG11} 0.44900 0.09000 0.15400 ? 0.00000 {?} {340.CG1} 20.64800 0.44600 0.44600 EE 0.00000 {?} 9.34330 0.15490 0 {?} 0 2390 {334.HB1} 2.06100 0.07000 0.09200 ++ 0.00000 {?} {340.HG11} 0.44700 0.09700 0.11700 ++ 0.00000 {?} {340.CG1} 20.64800 0.33500 0.33500 EE 0.00000 {?} 2.13220 0.06440 0 {?} 0 2391 {334.HE1} 2.92700 0.07300 0.08500 ++ 0.00000 {?} {340.HG11} 0.45400 0.08000 0.09800 ++ 0.00000 {?} {340.CG1} 20.64800 0.32100 0.32100 EE 0.00000 {?} 2.06380 0.05990 0 {?} 0 2392 {334.HA} 4.36300 0.05600 0.06900 ? 0.00000 {?} {340.HG11} 0.45600 0.08700 0.08400 ++ 0.00000 {?} {340.CG1} 20.64800 0.25300 0.25300 EE 0.00000 {?} 0.74350 0.04490 0 {?} 0 2393 {345.HA} 4.29500 0.05500 0.05800 ? 0.00000 {?} {340.HG11} 0.45200 0.08600 0.09900 ++ 0.00000 {?} {340.CG1} 20.64800 0.28500 0.28500 EE 0.00000 {?} 1.20480 0.05090 0 {?} 0 2394 {345.HE1} 6.63100 0.06300 0.07700 ? 0.00000 {?} {340.HG11} 0.45400 0.10100 0.11800 ++ 0.00000 {?} {340.CG1} 20.64800 0.31200 0.31200 EE 0.00000 {?} 1.97350 0.05750 0 {?} 0 2395 {332.HE1} 6.46200 0.07700 0.08800 ++ 0.00000 {?} {340.HG11} 0.46000 0.10300 0.11300 ++ 0.00000 {?} {340.CG1} 20.64800 0.30800 0.30800 EE 0.00000 {?} 2.33500 0.05620 0 {?} 0 2396 {332.HD1} 6.31800 0.05800 0.05400 ++ 0.00000 {?} {340.HG11} 0.48000 0.12200 0.11700 ++ 0.00000 {?} {340.CG1} 20.64800 0.24400 0.24400 EE 0.00000 {?} 0.92470 0.04350 0 {?} 0 2397 {?} 7.31700 0.07400 0.14100 ? 0.00000 {?} {?} 0.93100 0.11100 0.23600 ? 0.00000 {?} {?} 20.91000 0.42300 0.42300 EE 0.00000 {?} 8.14790 0.11950 0 {?} 0 2398 {394.HB1} 2.63400 0.06200 0.09100 ? 0.00000 {?} {393.HG21} 1.21100 0.07100 0.10100 ++ 0.00000 {?} {393.CG2} 21.43500 0.41000 0.41000 EE 0.00000 {?} 2.94000 0.10610 0 {?} 0 2399 {394.HB2} 2.56300 0.04500 0.05800 ? 0.00000 {?} {393.HG21} 1.20500 0.06500 0.09100 ++ 0.00000 {?} {393.CG2} 21.43500 0.37700 0.37700 EE 0.00000 {?} 1.37870 0.08260 0 {?} 0 2400 {388.HD1} 7.18000 0.09200 0.11800 ++ 0.00000 {?} {390.HG21} 1.22000 0.08600 0.11200 ? 0.00000 {?} {390.CG2} 21.69700 0.33900 0.33900 EE 0.00000 {?} 2.62810 0.06560 0 {?} 0 2401 {303.HB1} 1.71300 0.08200 0.10700 ? 0.00000 {?} {308.HG11} 0.63700 0.08600 0.11300 ? 0.00000 {?} {308.CG1} 21.69700 0.37100 0.37100 EE 0.00000 {?} 3.07980 0.07970 0 {?} 0 2402 {361.HB} 1.45300 0.05100 0.11600 ? 0.00000 {?} {361.HG21} 0.23000 0.08000 0.14500 ? 0.00000 {?} {361.CG2} 21.69700 0.45900 0.45900 EE 0.00000 {?} 7.73450 0.18660 0 {?} 0 2403 {381.HG2} 2.41200 0.07100 0.07900 ++ 0.00000 {?} {361.HG11} 0.43300 0.04900 0.11000 ? 0.00000 {?} {361.CG1} 21.69700 0.30200 0.30200 EE 0.00000 {?} 1.06440 0.05480 0 {?} 0 2404 {326.HB2} 1.60200 0.04300 0.05200 ++ 0.00000 {?} {361.HG21} 0.23800 0.08600 0.10400 ++ 0.00000 {?} {361.CG2} 21.69700 0.33400 0.33400 EE 0.00000 {?} 1.70990 0.07450 0 {?} 0 2405 {361.HA} 4.03600 0.09000 0.10700 ++ 0.00000 {?} {361.HG11} 0.43000 0.08300 0.10900 ++ 0.00000 {?} {361.CG1} 21.69700 0.34600 0.34600 EE 0.00000 {?} 2.77440 0.06840 0 {?} 0 2406 {361.HA} 4.02200 0.07400 0.07400 ? 0.00000 {?} {361.HG21} 0.23100 0.10800 0.12000 ? 0.00000 {?} {361.CG2} 21.69700 0.29400 0.29400 EE 0.00000 {?} 2.35020 0.05290 0 {?} 0 2407 {383.HA} 4.53100 0.09800 0.11300 ? 0.00000 {?} {361.HG11} 0.43200 0.04700 0.12300 ? 0.00000 {?} {361.CG1} 21.69700 0.31900 0.31900 EE 0.00000 {?} 1.77890 0.05920 0 {?} 0 2408 {383.HA} 4.55100 0.04200 0.07000 ++ 0.00000 {?} {361.HG21} 0.22800 0.07500 0.11800 ? 0.00000 {?} {361.CG2} 21.69700 0.37700 0.37700 EE 0.00000 {?} 1.82200 0.08280 0 {?} 0 2409 {342.HE1} 7.08800 0.07400 0.07700 ? 0.00000 {?} {361.HG11} 0.41900 0.09700 0.10600 ++ 0.00000 {?} {361.CG1} 21.69700 0.28600 0.28600 EE 0.00000 {?} 1.75890 0.05100 0 {?} 0 2410 {342.HZ} 7.20300 0.03800 0.08700 ? 0.00000 {?} {361.HG11} 0.43900 0.07800 0.10300 ++ 0.00000 {?} {361.CG1} 21.69700 0.35400 0.35400 EE 0.00000 {?} 1.31360 0.07130 0 {?} 0 2411 {342.HE1} 7.11600 0.07200 0.07400 ++ 0.00000 {?} {361.HG21} 0.26100 0.10200 0.12700 ? 0.00000 {?} {361.CG2} 21.69700 0.27100 0.27100 EE 0.00000 {?} 1.69330 0.04810 0 {?} 0 2412 {362.HB1} 1.69500 0.07200 0.07900 ++ 0.00000 {?} {382.HD21} 0.05900 0.11100 0.12000 ++ 0.00000 {?} {382.CD2} 22.22200 0.30400 0.30400 EE 0.00000 {?} 2.05700 0.05520 0 {?} 0 2413 {364.HA} 5.20800 0.05700 0.07400 ? 0.00000 {?} {319.HG21} 0.75800 0.13200 0.16400 ? 0.00000 {?} {319.CG2} 22.48400 0.38100 0.38100 EE 0.00000 {?} 3.33560 0.08470 0 {?} 0 2414 {382.HD11} 0.09700 0.04400 0.07400 ++ 0.00000 {?} {319.HG21} 0.75600 0.06600 0.10400 ++ 0.00000 {?} {319.CG2} 22.48400 0.44700 0.44700 EE 0.00000 {?} 3.06830 0.10750 0 {?} 0 2415 {382.HD11} 0.09800 0.06100 0.10300 ++ 0.00000 {?} {319.HG11} 0.81400 0.05300 0.08400 ++ 0.00000 {?} {319.CG1} 22.48400 0.44700 0.44700 EE 0.00000 {?} 4.13180 0.15760 0 {?} 0 2416 {363.HA} 4.62000 0.02200 0.06600 ? 0.00000 {?} {362.HD21} 0.54300 0.06700 0.09600 ++ 0.00000 {?} {362.CD2} 23.00900 0.38400 0.38400 EE 0.00000 {?} 0.95020 0.08690 0 {?} 0 2417 {319.HB} 2.45600 0.09300 0.12400 ++ 0.00000 {?} {362.HD21} 0.53000 0.08300 0.12600 ++ 0.00000 {?} {362.CD2} 23.00900 0.37200 0.37200 EE 0.00000 {?} 3.31290 0.07980 0 {?} 0 2418 {387.HB2} 2.20200 0.05900 0.08000 ++ 0.00000 {?} {362.HD21} 0.52700 0.07900 0.10900 ++ 0.00000 {?} {362.CD2} 23.00900 0.37800 0.37800 EE 0.00000 {?} 1.90780 0.08340 0 {?} 0 2419 {382.HA} 4.60500 0.02200 0.08000 ? 0.00000 {?} {362.HD11} 0.68400 0.09100 0.15100 ++ 0.00000 {?} {362.CD1} 25.17000 0.43300 0.43300 EE 0.00000 {?} 2.10900 0.12910 0 {?} 0 2420 {308.HB} 1.97100 0.07900 0.09000 ++ 0.00000 {?} {310.HG21} 1.28300 0.06700 0.08300 ++ 0.00000 {?} {310.CG2} 23.27100 0.32500 0.32500 EE 0.00000 {?} 1.82390 0.06120 0 {?} 0 2421 {376.HA} 4.71000 0.06200 0.12400 ? 0.00000 {?} {376.HD21} 0.90700 0.09500 0.20500 ? 0.00000 {?} {376.CD2} 24.05800 0.48800 0.48800 EE 0.00000 {?} 18.68680 0.32960 0 {?} 0 2422 {?} 2.01900 0.04000 0.08600 ? 0.00000 {?} {?} 0.97300 0.02600 0.08600 ? 0.00000 {?} {?} 23.79600 0.45800 0.45800 EE 0.00000 {?} 1.95700 0.18340 0 {?} 0 2423 {385.HA} 3.98700 0.05100 0.07800 ? 0.00000 {?} {280.HD21} 0.93400 0.06000 0.10000 ++ 0.00000 {?} {280.CD2} 23.79600 0.45600 0.45600 EE 0.00000 {?} 5.38720 0.17800 0 {?} 0 2424 {282.HB2} 3.29900 0.05400 0.06400 ++ 0.00000 {?} {279.HG11} 0.80900 0.06500 0.09300 ? 0.00000 {?} {279.CG1} 24.58300 0.32100 0.32100 EE 0.00000 {?} 1.03140 0.06000 0 {?} 0 2425 {380.HA} 4.45600 0.05900 0.06600 ++ 0.00000 {?} {382.HD11} 0.10900 0.08700 0.09400 ++ 0.00000 {?} {382.CD1} 25.10800 0.28700 0.28700 EE 0.00000 {?} 1.45290 0.05130 0 {?} 0 2426 {333.HA} 4.77600 0.04800 0.06700 ? 0.00000 {?} {331.HG21} 0.94900 0.04900 0.11600 ? 0.00000 {?} {331.CG2} 20.91000 0.46700 0.46700 EE 0.00000 {?} 5.56900 0.20980 0 {?} 0 2427 {346.HD1} 7.22600 0.06300 0.08400 ? 0.00000 {?} {343.HD11} 1.01500 0.13900 0.16900 ++ 0.00000 {?} {343.CD1} 25.63200 0.35100 0.35100 EE 0.00000 {?} 3.29580 0.06920 0 {?} 0 2428 {354.HG12} 0.59700 0.08400 0.08400 ? 0.00000 {?} {343.HD11} 1.03000 0.08400 0.12800 ? 0.00000 {?} {343.CD1} 25.63200 0.42600 0.42600 EE 0.00000 {?} 6.37680 0.12130 0 {?} 0 2429 {331.HG21} 0.99100 0.03300 0.05300 ? 0.00000 {?} {329.HG1} 1.67100 0.05400 0.12000 ? 0.00000 {?} {329.CG} 25.89500 0.48500 0.48500 EE 0.00000 {?} 6.87290 0.30070 0 {?} 0 2430 {331.HG21} 0.98200 0.02900 0.05700 ++ 0.00000 {?} {329.HG2} 1.56200 0.06000 0.12700 ? 0.00000 {?} {329.CG} 25.89500 0.49500 0.49500 EE 0.00000 {?} 9.48950 0.39900 0 {?} 0 2431 {317.HE1} 6.89700 0.09800 0.13000 ? 0.00000 {?} {377.HG1} 2.06500 0.10800 0.11700 ++ 0.00000 {?} {377.CG} 27.46900 0.29400 0.29400 EE 0.00000 {?} 2.80650 0.05210 0 {?} 0 2432 {?} 6.88500 0.07400 0.09100 ? 0.00000 {?} {?} 0.67800 0.10700 0.11200 ++ 0.00000 {?} {?} 28.25600 0.27800 0.27800 EE 0.00000 {?} 1.77930 0.04870 0 {?} 0 2433 {350.HE1} 6.79500 0.06700 0.06500 ? 0.00000 {?} {349.HB2} 0.68000 0.04600 0.10100 ? 0.00000 {?} {349.CB} 28.25600 0.24800 0.24800 EE 0.00000 {?} 0.67380 0.04330 0 {?} 0 2434 {345.HD1} 6.73400 0.05000 0.08700 ? 0.00000 {?} {334.HD1} 1.64400 0.10000 0.11100 ++ 0.00000 {?} {334.CD} 29.04300 0.30800 0.30800 EE 0.00000 {?} 1.70130 0.05550 0 {?} 0 2435 {324.HE3} 7.92900 0.04200 0.08500 ? 0.00000 {?} {324.HB2} 3.04700 0.08500 0.14200 ++ 0.00000 {?} {324.CB} 28.78000 0.39700 0.39700 EE 0.00000 {?} 2.30390 0.09380 0 {?} 0 2436 {338.HB1} 3.83900 0.06200 0.10400 ++ 0.00000 {?} {334.HD1} 1.65700 0.08200 0.10600 ++ 0.00000 {?} {334.CD} 29.04300 0.41800 0.41800 EE 0.00000 {?} 3.98900 0.11230 0 {?} 0 2437 {274.HD11} 0.93400 0.03000 0.07000 ? 0.00000 {?} {271.HB1} 3.26500 0.09100 0.12800 ? 0.00000 {?} {271.CB} 29.56700 0.38300 0.38300 EE 0.00000 {?} 1.56110 0.08450 0 {?} 0 2438 {274.HD11} 0.94000 0.02300 0.08300 ? 0.00000 {?} {271.HB2} 3.13000 0.09600 0.12500 ? 0.00000 {?} {271.CB} 29.56700 0.43300 0.43300 EE 0.00000 {?} 2.42000 0.11190 0 {?} 0 2439 {295.HE1} 7.56800 0.06400 0.10400 ++ 0.00000 {?} {299.HB} 1.76200 0.13000 0.17500 ++ 0.00000 {?} {299.CB} 30.87900 0.39700 0.39700 EE 0.00000 {?} 4.55560 0.09370 0 {?} 0 2440 {387.HA} 5.04100 0.07200 0.10900 ++ 0.00000 {?} {387.HB1} 2.77000 0.13100 0.23600 ? 0.00000 {?} {387.CB} 30.61700 0.38600 0.38600 EE 0.00000 {?} 3.97600 0.08640 0 {?} 0 2441 {279.HG21} 0.97500 0.07700 0.15600 ++ 0.00000 {?} {384.HB2} 1.95200 0.13200 0.23600 ? 0.00000 {?} {384.CB} 31.40300 0.46600 0.46600 EE 0.00000 {?} 19.51150 0.20330 0 {?} 0 2442 {280.HA} 4.13000 0.06400 0.07000 ? 0.00000 {?} {384.HB1} 2.43600 0.10000 0.11100 ++ 0.00000 {?} {384.CB} 31.40300 0.29900 0.29900 EE 0.00000 {?} 1.67320 0.05310 0 {?} 0 2443 {277.HA} 4.76300 0.02300 0.05700 ++ 0.00000 {?} {277.HB2} 2.21800 0.06600 0.12100 ? 0.00000 {?} {277.CB} 31.92800 0.49800 0.49800 EE 0.00000 {?} 8.07320 0.45380 0 {?} 0 2444 {322.HG21} -0.51600 0.07400 0.07200 ++ 0.00000 {?} {360.HB1} 1.65200 0.10700 0.10100 ++ 0.00000 {?} {360.CB} 32.71500 0.24800 0.24800 EE 0.00000 {?} 0.98510 0.04340 0 {?} 0 2445 {296.HB2} 0.77000 0.08400 0.12400 ? 0.00000 {?} {296.HG2} 0.20700 0.10000 0.14000 ++ 0.00000 {?} {296.CG} 32.45300 0.38800 0.38800 EE 0.00000 {?} 4.03530 0.08790 0 {?} 0 2446 {324.HE3} 7.94700 0.03700 0.03800 ++ 0.00000 {?} {360.HB1} 1.63700 0.14700 0.15000 ++ 0.00000 {?} {360.CB} 32.71500 0.27300 0.27300 EE 0.00000 {?} 1.28500 0.04760 0 {?} 0 2447 {324.HE3} 7.94100 0.02700 0.02700 ++ 0.00000 {?} {360.HB2} 0.95800 0.10700 0.10700 ++ 0.00000 {?} {360.CB} 32.71500 0.15900 0.15900 EE 0.00000 {?} 0.56150 0.03280 0 {?} 0 2448 {298.HG1} 2.63400 0.01900 0.06400 ? 0.00000 {?} {294.HB2} 1.73900 0.05700 0.10600 ? 0.00000 {?} {294.CB} 32.97700 0.41400 0.41400 EE 0.00000 {?} 0.99260 0.10830 0 {?} 0 2449 {293.HD2} 7.19900 0.04900 0.05200 ++ 0.00000 {?} {294.HB1} 1.94800 0.06500 0.08400 ? 0.00000 {?} {294.CB} 32.97700 0.29100 0.29100 EE 0.00000 {?} 1.03020 0.05130 0 {?} 0 2450 {293.HD2} 7.20500 0.03500 0.05500 ? 0.00000 {?} {294.HB2} 1.73100 0.08800 0.11800 ? 0.00000 {?} {294.CB} 32.97700 0.35300 0.35300 EE 0.00000 {?} 1.42760 0.06370 0 {?} 0 2451 {?} 6.31100 0.05100 0.05000 ++ 0.00000 {?} {?} 1.70600 0.12500 0.12300 ++ 0.00000 {?} {?} 33.76400 0.25500 0.25500 EE 0.00000 {?} 0.77770 0.04450 0 {?} 0 2452 {279.HG21} 0.95000 0.04700 0.06800 ++ 0.00000 {?} {283.HG1} 2.53900 0.10300 0.14700 ? 0.00000 {?} {283.CG} 34.02700 0.37900 0.37900 EE 0.00000 {?} 2.60970 0.08240 0 {?} 0 2453 {?} 4.66200 0.04000 0.05500 ? 0.00000 {?} {?} 2.21400 0.15200 0.20300 ? 0.00000 {?} {?} 34.55100 0.38900 0.38900 EE 0.00000 {?} 3.00750 0.08870 0 {?} 0 2454 {299.HB} 1.75000 0.03600 0.05900 ? 0.00000 {?} {298.HG1} 2.63200 0.05800 0.11000 ? 0.00000 {?} {298.CG} 34.28900 0.32000 0.32000 EE 0.00000 {?} 0.76870 0.05820 0 {?} 0 2455 {?} 8.78500 0.04500 0.04100 ++ 0.00000 {?} {?} 1.77700 0.08500 0.08500 ++ 0.00000 {?} {?} 35.86300 0.22900 0.22900 EE 0.00000 {?} 0.64770 0.04060 0 {?} 0 2456 {276.HA} 4.60600 0.04300 0.04600 ? 0.00000 {?} {277.HG1} 2.48700 0.07500 0.08000 ++ 0.00000 {?} {277.CG} 36.38800 0.28200 0.28200 EE 0.00000 {?} 0.77410 0.04930 0 {?} 0 2457 {281.HA} 4.43100 0.05900 0.07900 ++ 0.00000 {?} {277.HG1} 2.48800 0.08400 0.15000 ? 0.00000 {?} {277.CG} 36.38800 0.37500 0.37500 EE 0.00000 {?} 2.11850 0.08000 0 {?} 0 2458 {282.HA} 4.32700 0.06200 0.05900 ++ 0.00000 {?} {277.HG1} 2.48200 0.06400 0.10800 ? 0.00000 {?} {277.CG} 36.38800 0.25000 0.25000 EE 0.00000 {?} 0.69300 0.04370 0 {?} 0 2459 {?} 3.30200 0.05200 0.06200 ++ 0.00000 {?} {?} 2.48500 0.09200 0.14100 ++ 0.00000 {?} {?} 36.38800 0.39800 0.39800 EE 0.00000 {?} 2.86190 0.09440 0 {?} 0 2460 {?} 8.37700 0.04600 0.04500 ++ 0.00000 {?} {?} 2.26400 0.15700 0.15300 ++ 0.00000 {?} {?} 36.38800 0.25000 0.25000 EE 0.00000 {?} 1.11560 0.04360 0 {?} 0 2461 {354.HD11} 0.93100 0.03200 0.05900 ? 0.00000 {?} {346.HB1} 3.06400 0.07600 0.11700 ? 0.00000 {?} {346.CB} 37.17500 0.38000 0.38000 EE 0.00000 {?} 1.45640 0.08270 0 {?} 0 2462 {295.HE1} 7.56700 0.08300 0.10100 ++ 0.00000 {?} {287.HB1} 2.81300 0.10100 0.15000 ? 0.00000 {?} {287.CB} 38.22400 0.33800 0.33800 EE 0.00000 {?} 2.94750 0.06430 0 {?} 0 2463 {284.HD1} 7.30800 0.03400 0.06700 ? 0.00000 {?} {287.HB2} 2.71700 0.07100 0.10100 ? 0.00000 {?} {287.CB} 38.22400 0.35400 0.35400 EE 0.00000 {?} 1.06280 0.05560 0 {?} 0 2464 {284.HD1} 7.30900 0.03700 0.07200 ? 0.00000 {?} {287.HB1} 2.81400 0.06800 0.09600 ? 0.00000 {?} {287.CB} 38.22400 0.35400 0.35400 EE 0.00000 {?} 1.40200 0.07020 0 {?} 0 2465 {284.HA} 4.34600 0.05500 0.08800 ? 0.00000 {?} {287.HB2} 2.71700 0.09200 0.09200 ? 0.00000 {?} {287.CB} 38.22400 0.46600 0.46600 EE 0.00000 {?} 11.84950 0.20110 0 {?} 0 2466 {383.HD11} 0.15800 0.05400 0.05900 ++ 0.00000 {?} {342.HB1} 3.63800 0.12100 0.12900 ++ 0.00000 {?} {342.CB} 38.22400 0.28700 0.28700 EE 0.00000 {?} 1.58490 0.05040 0 {?} 0 2467 {383.HD11} 0.15700 0.04200 0.03600 ++ 0.00000 {?} {342.HB2} 3.17100 0.15900 0.15900 ++ 0.00000 {?} {342.CB} 38.22400 0.22700 0.22700 EE 0.00000 {?} 0.94730 0.04030 0 {?} 0 2468 {279.HG11} 0.80600 0.05300 0.08000 ? 0.00000 {?} {282.HB2} 3.31400 0.08000 0.11000 ? 0.00000 {?} {282.CB} 39.27300 0.34900 0.34900 EE 0.00000 {?} 1.90900 0.06840 0 {?} 0 2469 {279.HG21} 0.98200 0.06100 0.06500 ++ 0.00000 {?} {282.HB1} 3.46500 0.07500 0.09300 ? 0.00000 {?} {282.CB} 39.27300 0.28600 0.28600 EE 0.00000 {?} 1.20170 0.05030 0 {?} 0 2470 {295.HE1} 7.56600 0.06300 0.05800 ++ 0.00000 {?} {295.HB1} 3.32800 0.10600 0.10700 ? 0.00000 {?} {295.CB} 39.27300 0.23700 0.23700 EE 0.00000 {?} 1.07750 0.04170 0 {?} 0 2471 {383.HG21} 0.70500 0.04300 0.07100 ? 0.00000 {?} {354.HB} 1.67900 0.05200 0.11600 ? 0.00000 {?} {354.CB} 39.53600 0.37800 0.37800 EE 0.00000 {?} 1.07850 0.08190 0 {?} 0 2472 {276.HA} 4.59400 0.04400 0.05800 ? 0.00000 {?} {388.HB1} 3.14200 0.09500 0.09900 ++ 0.00000 {?} {388.CB} 40.32300 0.27600 0.27600 EE 0.00000 {?} 1.02580 0.04820 0 {?} 0 2473 {276.HA} 4.59400 0.03800 0.04500 ++ 0.00000 {?} {388.HB2} 2.85600 0.09000 0.11200 ++ 0.00000 {?} {388.CB} 40.32300 0.33800 0.33800 EE 0.00000 {?} 1.06040 0.06410 0 {?} 0 2474 {?} 3.68800 0.03800 0.05400 ++ 0.00000 {?} {?} 1.78800 0.10800 0.13000 ? 0.00000 {?} {?} 40.58500 0.38800 0.38800 EE 0.00000 {?} 2.36630 0.08770 0 {?} 0 2475 {324.HZ2} 7.12900 0.04200 0.04200 ++ 0.00000 {?} {322.HB} 1.40800 0.06000 0.06000 ++ 0.00000 {?} {322.CB} 40.84700 0.15500 0.15500 EE 0.00000 {?} 0.43310 0.03240 0 {?} 0 2476 {350.HA} 5.06900 0.04800 0.08400 ++ 0.00000 {?} {350.HB1} 3.46600 0.07500 0.15800 ? 0.00000 {?} {350.CB} 41.11000 0.42100 0.42100 EE 0.00000 {?} 3.45680 0.11570 0 {?} 0 2477 {?} 7.15100 0.04900 0.04900 ? 0.00000 {?} {?} 2.57900 0.15300 0.14500 ++ 0.00000 {?} {?} 41.11000 0.24300 0.24300 EE 0.00000 {?} 1.28270 0.04260 0 {?} 0 2478 {303.HA} 4.25700 0.06300 0.07800 ++ 0.00000 {?} {306.HB2} 1.34900 0.12000 0.14300 ++ 0.00000 {?} {306.CB} 41.89700 0.34300 0.34300 EE 0.00000 {?} 2.44180 0.06590 0 {?} 0 2479 {?} -0.57100 0.07900 0.09200 ++ 0.00000 {?} {?} 3.01300 0.12400 0.16800 ++ 0.00000 {?} {?} 41.89700 0.33400 0.33400 EE 0.00000 {?} 2.93790 0.06300 0 {?} 0 2480 {?} 8.36400 0.05800 0.06300 ++ 0.00000 {?} {?} 2.98700 0.09900 0.10900 ++ 0.00000 {?} {?} 41.89700 0.29600 0.29600 EE 0.00000 {?} 1.44070 0.05250 0 {?} 0 2481 {386.HA} 4.58300 0.06000 0.09600 ++ 0.00000 {?} {386.HB2} 1.97200 0.07500 0.17100 ? 0.00000 {?} {386.CB} 42.42100 0.41600 0.41600 EE 0.00000 {?} 3.39300 0.11040 0 {?} 0 2482 {?} 8.35600 0.06300 0.06800 ++ 0.00000 {?} {?} 1.64100 0.14800 0.15700 ++ 0.00000 {?} {?} 42.15900 0.29000 0.29000 EE 0.00000 {?} 2.19990 0.05100 0 {?} 0 2483 {317.HA} 4.66900 0.05200 0.07900 ? 0.00000 {?} {317.HB1} 2.91400 0.08300 0.15100 ? 0.00000 {?} {317.CB} 43.20800 0.41400 0.41400 EE 0.00000 {?} 3.43770 0.10800 0 {?} 0 2484 {321.HA} 4.76400 0.02700 0.07400 ? 0.00000 {?} {321.HB2} 2.23700 0.08900 0.13600 ? 0.00000 {?} {321.CB} 43.20800 0.46200 0.46200 EE 0.00000 {?} 4.81800 0.19130 0 {?} 0 2485 {?} 4.66200 0.04600 0.06900 ++ 0.00000 {?} {?} 4.06100 0.08000 0.14200 ? 0.00000 {?} {?} 44.25800 0.43500 0.43500 EE 0.00000 {?} 4.77590 0.13360 0 {?} 0 2486 {?} 4.66400 0.05700 0.08600 ? 0.00000 {?} {?} 3.96100 0.12900 0.12900 ? 0.00000 {?} {?} 44.25800 0.41500 0.41500 EE 0.00000 {?} 5.46050 0.10940 0 {?} 0 2487 {282.HE1} 7.20400 0.05500 0.05800 ++ 0.00000 {?} {303.HG} 1.69600 0.10000 0.10800 ++ 0.00000 {?} {303.CB} 45.04500 0.28600 0.28600 EE 0.00000 {?} 1.29640 0.05020 0 {?} 0 2488 {282.HE1} 7.19900 0.06000 0.05900 ++ 0.00000 {?} {303.HB2} 1.30500 0.10100 0.09800 ++ 0.00000 {?} {303.CB} 45.04500 0.25400 0.25400 EE 0.00000 {?} 0.90750 0.04430 0 {?} 0 2489 {333.HG1} 1.35600 0.06200 0.07700 ++ 0.00000 {?} {337.HA1} 4.37800 0.11000 0.14200 ? 0.00000 {?} {337.CA} 45.04500 0.37700 0.37700 EE 0.00000 {?} 2.66130 0.08140 0 {?} 0 2490 {382.HA} 4.60900 0.06300 0.08500 ++ 0.00000 {?} {382.HB1} 1.29900 0.13000 0.18000 ++ 0.00000 {?} {382.CB} 45.30700 0.35800 0.35800 EE 0.00000 {?} 2.91540 0.07210 0 {?} 0 2491 {382.HA} 4.61000 0.06300 0.11500 ++ 0.00000 {?} {382.HB2} 1.02200 0.10400 0.17000 ++ 0.00000 {?} {382.CB} 45.30700 0.44400 0.44400 EE 0.00000 {?} 7.96330 0.14870 0 {?} 0 2492 {?} 1.63800 0.06200 0.06200 ? 0.00000 {?} {?} 3.99200 0.06700 0.09100 ? 0.00000 {?} {?} 45.30700 0.40100 0.40100 EE 0.00000 {?} 2.87060 0.09680 0 {?} 0 2493 {327.HB1} 3.15300 0.05900 0.06200 ++ 0.00000 {?} {328.HD2} 3.52000 0.11400 0.11900 ++ 0.00000 {?} {328.CD} 50.55300 0.28500 0.28500 EE 0.00000 {?} 1.53240 0.05010 0 {?} 0 2494 {327.HB2} 2.84200 0.05600 0.05800 ? 0.00000 {?} {328.HD2} 3.56400 0.08100 0.07300 ++ 0.00000 {?} {328.CD} 50.55300 0.23200 0.23200 EE 0.00000 {?} 0.67200 0.04100 0 {?} 0 2495 {365.HA} 4.74000 0.05600 0.09100 ++ 0.00000 {?} {366.HD1} 3.84800 0.10100 0.15700 ? 0.00000 {?} {366.CD} 50.81600 0.48800 0.48800 EE 0.00000 {?} 20.50740 0.32830 0 {?} 0 2496 {365.HB1} 2.14800 0.02500 0.08100 ? 0.00000 {?} {366.HD1} 3.83900 0.08200 0.13400 ? 0.00000 {?} {366.CD} 50.81600 0.45100 0.45100 EE 0.00000 {?} 3.72390 0.16180 0 {?} 0 2497 {?} 2.38500 0.02000 0.05800 ? 0.00000 {?} {?} 3.85500 0.08400 0.12100 ? 0.00000 {?} {?} 50.81600 0.40600 0.40600 EE 0.00000 {?} 1.53780 0.10130 0 {?} 0 2498 {319.HG21} 0.76300 0.10500 0.12200 ? 0.00000 {?} {321.HA} 4.73700 0.06900 0.11700 ? 0.00000 {?} {321.CA} 52.65200 0.38900 0.38900 EE 0.00000 {?} 4.65340 0.08820 0 {?} 0 2499 {365.HG1} 2.39900 0.06700 0.07500 ++ 0.00000 {?} {365.HA} 4.74600 0.11700 0.12700 ? 0.00000 {?} {365.CA} 53.43900 0.30700 0.30700 EE 0.00000 {?} 2.32240 0.05510 0 {?} 0 2500 {383.HG12} 0.81700 0.01400 0.07100 ? 0.00000 {?} {383.HA} 4.53000 0.09600 0.13000 ? 0.00000 {?} {383.CA} 53.96400 0.35200 0.35200 EE 0.00000 {?} 0.74170 0.06940 0 {?} 0 2501 {343.HD11} 1.04400 0.03800 0.06500 ? 0.00000 {?} {353.HA} 4.40500 0.08800 0.13400 ? 0.00000 {?} {353.CA} 55.01300 0.37600 0.37600 EE 0.00000 {?} 1.67910 0.08060 0 {?} 0 2502 {?} 4.70600 0.07200 0.11100 ? 0.00000 {?} {?} 4.40600 0.08100 0.15200 ? 0.00000 {?} {?} 55.53800 0.50400 0.50400 EE 0.00000 {?} 43.19650 0.58870 0 {?} 0 2503 {284.HD1} 7.31800 0.03100 0.03300 ++ 0.00000 {?} {285.HA} 4.53300 0.08800 0.09200 ++ 0.00000 {?} {285.CA} 55.80000 0.28100 0.28100 EE 0.00000 {?} 0.65500 0.04910 0 {?} 0 2504 {288.HD2} 7.13800 0.05200 0.05700 ++ 0.00000 {?} {285.HA} 4.52300 0.12300 0.15000 ? 0.00000 {?} {285.CA} 55.80000 0.30400 0.30400 EE 0.00000 {?} 1.63350 0.05430 0 {?} 0 2505 {282.HE1} 7.19200 0.05400 0.05600 ++ 0.00000 {?} {303.HA} 4.25100 0.09900 0.10200 ++ 0.00000 {?} {303.CA} 55.80000 0.27500 0.27500 EE 0.00000 {?} 1.09980 0.04800 0 {?} 0 2506 {348.HB2} 1.80500 0.05800 0.06000 ++ 0.00000 {?} {349.HA} 3.78200 0.09700 0.10500 ++ 0.00000 {?} {349.CA} 56.84900 0.28600 0.28600 EE 0.00000 {?} 1.39120 0.05030 0 {?} 0 2507 {348.HG1} 1.54000 0.04700 0.04800 ++ 0.00000 {?} {349.HA} 3.77300 0.11400 0.11600 ++ 0.00000 {?} {349.CA} 56.84900 0.26900 0.26900 EE 0.00000 {?} 1.19980 0.04690 0 {?} 0 2508 {363.HG21} 0.88000 0.07400 0.09100 ? 0.00000 {?} {364.HA} 5.19800 0.11200 0.09900 ++ 0.00000 {?} {364.CA} 56.84900 0.22700 0.22700 EE 0.00000 {?} 1.37680 0.04030 0 {?} 0 2509 {387.HB2} 2.20800 0.05200 0.06500 ++ 0.00000 {?} {308.HA} 5.29400 0.14200 0.17900 ++ 0.00000 {?} {308.CA} 58.16100 0.35200 0.35200 EE 0.00000 {?} 2.47330 0.06930 0 {?} 0 2510 {387.HB1} 2.79400 0.05000 0.06500 ? 0.00000 {?} {308.HA} 5.27200 0.06100 0.09700 ? 0.00000 {?} {308.CA} 58.16100 0.28000 0.28000 EE 0.00000 {?} 0.70880 0.03740 0 {?} 0 2511 {283.HE1} 1.94800 0.03900 0.04700 ++ 0.00000 {?} {324.HA} 4.48600 0.07800 0.09100 ++ 0.00000 {?} {324.CA} 58.16100 0.33900 0.33900 EE 0.00000 {?} 0.94340 0.06460 0 {?} 0 2512 {?} 4.67400 0.02800 0.05800 ? 0.00000 {?} {?} 4.01300 0.09100 0.11100 ++ 0.00000 {?} {?} 58.16100 0.35400 0.35400 EE 0.00000 {?} 1.17030 0.07020 0 {?} 0 2513 {?} 7.35000 0.03200 0.07600 ? 0.00000 {?} {?} 2.96000 0.09200 0.12000 ++ 0.00000 {?} {?} 41.89700 0.37200 0.37200 EE 0.00000 {?} 1.52110 0.08280 0 {?} 0 2514 {280.HB1} 1.88400 0.05700 0.08100 ++ 0.00000 {?} {280.HB2} 1.00700 0.12300 0.19800 ++ 0.00000 {?} {280.CB} 41.37200 0.40700 0.40700 EE 0.00000 {?} 6.02340 0.12270 0 {?} 0 2515 {385.HG2} 2.43000 0.07500 0.07800 ++ 0.00000 {?} {280.HB2} 1.01400 0.11900 0.12200 ++ 0.00000 {?} {280.CB} 41.37200 0.27200 0.27200 EE 0.00000 {?} 2.22340 0.05690 0 {?} 0 2516 {385.HG2} 2.43800 0.06900 0.06700 ? 0.00000 {?} {280.HB1} 1.87200 0.11000 0.10800 ++ 0.00000 {?} {280.CB} 41.37200 0.25500 0.25500 EE 0.00000 {?} 1.23220 0.05330 0 {?} 0 2517 {385.HA} 4.00000 0.07500 0.08300 ++ 0.00000 {?} {280.HB2} 1.00800 0.10700 0.11900 ++ 0.00000 {?} {280.CB} 41.37200 0.29400 0.29400 EE 0.00000 {?} 2.61480 0.06250 0 {?} 0 2518 {280.HA} 4.13200 0.06000 0.05900 ++ 0.00000 {?} {280.HB2} 1.00900 0.09000 0.08800 ++ 0.00000 {?} {280.CB} 41.37200 0.25700 0.25700 EE 0.00000 {?} 0.77760 0.05370 0 {?} 0 2519 {295.HD1} 7.17300 0.08500 0.11000 ++ 0.00000 {?} {289.HG1} 2.26800 0.10300 0.12300 ? 0.00000 {?} {289.CG} 33.50200 0.32800 0.32800 EE 0.00000 {?} 3.25250 0.07310 0 {?} 0 2520 {321.HA} 4.74200 0.05000 0.05700 ++ 0.00000 {?} {304.HG11} 1.77100 0.11100 0.12300 ++ 0.00000 {?} {304.CG1} 29.83000 0.31400 0.31400 EE 0.00000 {?} 2.73910 0.10000 0 {?} 0 2521 {321.HA} 4.74400 0.05400 0.05300 ++ 0.00000 {?} {304.HG12} 0.79900 0.08800 0.08600 ++ 0.00000 {?} {304.CG1} 29.83000 0.25300 0.25300 EE 0.00000 {?} 1.03520 0.07770 0 {?} 0 2522 {383.HG21} 0.70400 0.07200 0.07400 ++ 0.00000 {?} {385.HB1} 2.68000 0.09100 0.09600 ++ 0.00000 {?} {385.CB} 32.19000 0.27400 0.27400 EE 0.00000 {?} 1.82220 0.05840 0 {?} 0 2523 {295.HA} 4.29100 0.03600 0.05500 ? 0.00000 {?} {292.HA} 3.96300 0.08600 0.11400 ++ 0.00000 {?} {292.CA} 59.99700 0.33200 0.33200 EE 0.00000 {?} 1.30510 0.07450 0 {?} 0 2524 {333.HA} 4.73200 0.05000 0.06500 ++ 0.00000 {?} {339.HG1} 2.12900 0.10200 0.16900 ? 0.00000 {?} {339.CG} 36.91200 0.37800 0.37800 EE 0.00000 {?} 3.02070 0.10010 0 {?} 0 2525 {334.HA} 4.39600 0.06700 0.08600 ? 0.00000 {?} {334.HG1} 1.30700 0.05700 0.10200 ? 0.00000 {?} {334.CG} 25.63200 0.41400 0.41400 EE 0.00000 {?} 2.87050 0.09040 0 {?} 0 2526 {333.HA} 4.72200 0.04100 0.10000 ? 0.00000 {?} {339.HB1} 1.76500 0.09700 0.17300 ? 0.00000 {?} {339.CB} 32.45300 0.45000 0.45000 EE 0.00000 {?} 8.00530 0.19580 0 {?} 0 2527 {341.HB2} 3.94300 0.06000 0.07100 ++ 0.00000 {?} {341.HB1} 4.40100 0.12000 0.14900 ++ 0.00000 {?} {341.CB} 65.50600 0.34300 0.34300 EE 0.00000 {?} 3.04450 0.08050 0 {?} 0 2528 {361.HA} 4.03400 0.06200 0.07700 ? 0.00000 {?} {383.HD11} 0.15200 0.07800 0.10000 ++ 0.00000 {?} {383.CD1} 7.79400 0.33400 0.33400 EE 0.00000 {?} 1.34450 0.05250 0 {?} 0 2529 {?} 0.16600 0.04300 0.05200 ++ 0.00000 {?} {?} 1.03100 0.02400 0.07400 ? 0.00000 {?} {?} 25.63200 0.32900 0.32900 EE 0.00000 {?} 0.25860 0.04960 0 {?} 0 2530 {346.HD1} 7.22600 0.07200 0.07000 ++ 0.00000 {?} {343.HA} 4.17000 0.06400 0.15400 ? 0.00000 {?} {343.CA} 58.68600 0.25500 0.25500 EE 0.00000 {?} 1.14420 0.05440 0 {?} 0 2531 {389.HA} 4.42000 0.04600 0.04900 ? 0.00000 {?} {308.HG21} 0.75900 0.08300 0.08800 ++ 0.00000 {?} {308.CG2} 18.02500 0.28500 0.28500 EE 0.00000 {?} 0.81060 0.04180 0 {?} 0 2532 {316.HA} 5.62300 0.03700 0.03500 ++ 0.00000 {?} {308.HG21} 0.74300 0.10700 0.10300 ++ 0.00000 {?} {308.CG2} 18.02500 0.24700 0.24700 EE 0.00000 {?} 0.45740 0.03600 0 {?} 0 2533 {308.HG11} 0.68400 0.06500 0.06500 ? 0.00000 {?} {307.HB} 1.79500 0.04700 0.10900 ? 0.00000 {?} {307.CB} 31.92800 0.37800 0.37800 EE 0.00000 {?} 1.36630 0.06800 0 {?} 0 2534 {316.HA} 5.60600 0.03700 0.03700 ++ 0.00000 {?} {309.HB2} 1.35300 0.05800 0.05800 ++ 0.00000 {?} {309.CB} 46.35600 0.15800 0.15800 EE 0.00000 {?} 0.35690 0.02730 0 {?} 0 2535 {388.HB2} 2.85000 0.05800 0.06400 ++ 0.00000 {?} {309.HB2} 1.33700 0.11700 0.13900 ++ 0.00000 {?} {309.CB} 46.35600 0.31000 0.31000 EE 0.00000 {?} 1.79840 0.04590 0 {?} 0 2536 {?} 7.13100 0.06600 0.08200 ++ 0.00000 {?} {?} 1.33500 0.12400 0.15500 ? 0.00000 {?} {?} 27.46900 0.34500 0.34500 EE 0.00000 {?} 2.25020 0.05550 0 {?} 0 2537 {316.HA} 5.63200 0.04400 0.04400 ++ 0.00000 {?} {309.HD11} 0.79700 0.06000 0.05200 ++ 0.00000 {?} {309.CD1} 26.15700 0.20200 0.20200 EE 0.00000 {?} 0.32290 0.03100 0 {?} 0 2538 {311.HA} 4.08800 0.07300 0.06900 ++ 0.00000 {?} {311.HD2} 1.26200 0.11100 0.10300 ++ 0.00000 {?} {311.CD} 29.83000 0.24500 0.24500 EE 0.00000 {?} 1.37940 0.05240 0 {?} 0 2539 {392.HD11} 0.91400 0.04300 0.11100 ? 0.00000 {?} {307.HB} 1.80100 0.07800 0.14300 ? 0.00000 {?} {307.CB} 31.92800 0.45900 0.45900 EE 0.00000 {?} 9.28380 0.22280 0 {?} 0 2540 {360.HA} 5.16800 0.09400 0.08800 ++ 0.00000 {?} {322.HD11} 0.72500 0.08500 0.07800 ++ 0.00000 {?} {322.CD1} 15.40100 0.23600 0.23600 EE 0.00000 {?} 0.78770 0.03460 0 {?} 0 2541 {322.HG21} -0.51300 0.05600 0.05300 ++ 0.00000 {?} {319.HG21} 0.76100 0.09400 0.09000 ++ 0.00000 {?} {319.CG2} 22.48400 0.24300 0.24300 EE 0.00000 {?} 0.77710 0.05200 0 {?} 0 2542 {?} 6.91400 0.05400 0.07400 ? 0.00000 {?} {?} 1.93200 0.09600 0.10600 ++ 0.00000 {?} {?} 17.50000 0.30700 0.30700 EE 0.00000 {?} 1.34020 0.04590 0 {?} 0 2543 {326.HA} 4.71300 0.02100 0.04500 ? 0.00000 {?} {361.HG21} 0.22500 0.10000 0.12600 ++ 0.00000 {?} {361.CG2} 21.69700 0.36800 0.36800 EE 0.00000 {?} 0.78700 0.06370 0 {?} 0 2544 {?} 5.47700 0.05500 0.06600 ++ 0.00000 {?} {?} 0.22300 0.11100 0.14500 ++ 0.00000 {?} {?} 21.69700 0.36300 0.36300 EE 0.00000 {?} 1.77850 0.06170 0 {?} 0 2545 {381.HE1} 2.05600 0.10700 0.10700 ? 0.00000 {?} {361.HG11} 0.43500 0.09600 0.12200 ++ 0.00000 {?} {361.CG1} 21.69700 0.35700 0.35700 EE 0.00000 {?} 4.39680 0.08730 0 {?} 0 2546 {381.HA} 5.10300 0.06400 0.08400 ++ 0.00000 {?} {361.HG11} 0.44000 0.11300 0.23600 ? 0.00000 {?} {361.CG1} 21.69700 0.36500 0.36500 EE 0.00000 {?} 3.38150 0.09190 0 {?} 0 2547 {?} 6.86700 0.07600 0.08300 ++ 0.00000 {?} {?} 1.91500 0.13700 0.14700 ++ 0.00000 {?} {?} 32.19000 0.29000 0.29000 EE 0.00000 {?} 1.97450 0.04260 0 {?} 0 2548 {?} 3.01200 0.05700 0.07700 ++ 0.00000 {?} {?} 1.38900 0.10900 0.15000 ? 0.00000 {?} {?} 41.89700 0.38400 0.38400 EE 0.00000 {?} 3.34900 0.10410 0 {?} 0 2549 {318.HA} 4.84100 0.01500 0.05700 ? 0.00000 {?} {307.HG21} 0.80300 0.04200 0.09300 ? 0.00000 {?} {307.CG2} 21.17300 0.51600 0.51600 EE 0.00000 {?} 7.18130 1.16150 0 {?} 0 2550 {393.HA} 4.59600 0.03800 0.08200 ? 0.00000 {?} {307.HG21} 0.81100 0.04900 0.09300 ? 0.00000 {?} {307.CG2} 21.17300 0.46900 0.46900 EE 0.00000 {?} 10.93750 0.56030 0 {?} 0 2551 {390.HB} 4.31000 0.02200 0.05300 ? 0.00000 {?} {307.HG21} 0.80500 0.04000 0.08100 ? 0.00000 {?} {307.CG2} 21.43500 0.47000 0.47000 EE 0.00000 {?} 1.04800 0.07860 0 {?} 0 2552 {307.HA} 4.91800 0.03700 0.05100 ? 0.00000 {?} {307.HB} 1.81300 0.09900 0.13500 ++ 0.00000 {?} {307.CB} 31.92800 0.44200 0.44200 EE 0.00000 {?} 4.02690 0.12020 0 {?} 0 2553 {376.HD11} 0.92600 0.07200 0.07700 ++ 0.00000 {?} {374.HA2} 4.01100 0.10900 0.11600 ++ 0.00000 {?} {374.CA} 45.30700 0.28500 0.28500 EE 0.00000 {?} 2.27370 0.06100 0 {?} 0 2554 {308.HG11} 0.65000 0.05700 0.05800 ? 0.00000 {?} {390.HA} 4.59300 0.11200 0.11300 ++ 0.00000 {?} {390.CA} 61.30900 0.26800 0.26800 EE 0.00000 {?} 1.67810 0.05700 0 {?} 0 2555 {308.HA} 5.30200 0.06500 0.06500 ++ 0.00000 {?} {390.HB} 4.26500 0.07400 0.07400 ++ 0.00000 {?} {390.CB} 71.27700 0.17900 0.17900 EE 0.00000 {?} 1.14120 0.04230 0 {?} 0 2556 {?} 7.36600 0.06500 0.05600 ++ 0.00000 {?} {?} 1.21500 0.07500 0.07500 ++ 0.00000 {?} {?} 21.69700 0.20800 0.20800 EE 0.00000 {?} 0.55880 0.03150 0 {?} 0 2557 {?} 2.40600 0.03000 0.06500 ? 0.00000 {?} {?} 1.22200 0.06800 0.10900 ++ 0.00000 {?} {?} 21.69700 0.45400 0.45400 EE 0.00000 {?} 2.60740 0.10200 0 {?} 0 2558 {?} 2.34700 0.02600 0.05500 ? 0.00000 {?} {?} 1.22700 0.09000 0.14400 ++ 0.00000 {?} {?} 21.69700 0.45400 0.45400 EE 0.00000 {?} 3.72670 0.14210 0 {?} 0 2559 {308.HG11} 0.64600 0.04600 0.04600 ++ 0.00000 {?} {390.HB} 4.24400 0.08900 0.08900 ++ 0.00000 {?} {390.CB} 71.27700 0.06500 0.06500 EE 0.00000 {?} 0.65130 0.03060 0 {?} 0 2560 {390.HA} 4.59900 0.04400 0.09100 ? 0.00000 {?} {389.HD21} 0.63800 0.09400 0.10700 ? 0.00000 {?} {389.CD2} 24.05800 0.36100 0.36100 EE 0.00000 {?} 1.30210 0.06100 0 {?} 0 2561 {?} 7.19400 0.04500 0.07000 ? 0.00000 {?} {?} 1.48600 0.14900 0.14900 ? 0.00000 {?} {?} 27.20600 0.34000 0.34000 EE 0.00000 {?} 1.90290 0.05480 0 {?} 0 2562 {279.HG11} 0.79900 0.04800 0.07000 ? 0.00000 {?} {389.HB2} 1.59600 0.07600 0.13700 ? 0.00000 {?} {389.CB} 41.89700 0.46700 0.46700 EE 0.00000 {?} 7.96380 0.17730 0 {?} 0 2563 {278.HA} 5.03800 0.05200 0.05600 ++ 0.00000 {?} {388.HB1} 3.13200 0.10200 0.10800 ++ 0.00000 {?} {388.CB} 40.06000 0.28800 0.28800 EE 0.00000 {?} 1.16920 0.04290 0 {?} 0 2564 {362.HD21} 0.53300 0.05200 0.05600 ++ 0.00000 {?} {387.HB2} 2.20700 0.06100 0.07000 ++ 0.00000 {?} {387.CB} 30.61700 0.29700 0.29700 EE 0.00000 {?} 0.63530 0.04460 0 {?} 0 2565 {?} 3.98200 0.05400 0.09100 ? 0.00000 {?} {?} 0.83300 0.07400 0.11600 ? 0.00000 {?} {?} 21.96000 0.40500 0.40500 EE 0.00000 {?} 2.39090 0.08530 0 {?} 0 2566 {386.HA} 4.56500 0.04600 0.05500 ++ 0.00000 {?} {386.HG} 1.20800 0.12800 0.16400 ? 0.00000 {?} {386.CG} 27.46900 0.34900 0.34900 EE 0.00000 {?} 1.86280 0.05790 0 {?} 0 2567 {319.HG11} 0.82100 0.05600 0.10100 ? 0.00000 {?} {362.HB2} 1.17700 0.09700 0.13200 ? 0.00000 {?} {362.CB} 42.15900 0.41900 0.41900 EE 0.00000 {?} 4.61210 0.09590 0 {?} 0 2568 {352.HG2} 1.97700 0.06400 0.07500 ++ 0.00000 {?} {354.HD11} 0.93100 0.06500 0.07700 ++ 0.00000 {?} {354.CD1} 15.13900 0.33600 0.33600 EE 0.00000 {?} 1.10780 0.05300 0 {?} 0 2569 {505.H5''} 4.16780 0.06481 0.06499 ++ 0.00000 {?} {382.HD21} 0.03608 0.11757 0.11776 ++ 0.00000 {?} {382.CD2} 22.22201 0.26323 0.26323 EE 0.00000 {?} 1.16690 0.03190 0 {?} 0 ; save_ save_peak_list_4 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode peak_list_4 _Spectral_peak_list.Entry_ID 17273 _Spectral_peak_list.ID 4 _Spectral_peak_list.Sample_ID . _Spectral_peak_list.Sample_label . _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID . _Spectral_peak_list.Experiment_name . _Spectral_peak_list.Number_of_spectral_dimensions . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; label dataset sw sf H1 H2 C cnoefil500.nv {5004.88 } {3319.46 } {8333.33 } {500.1324 } {500.1324 } {125.7624 } H1.L H1.P H1.W H1.B H1.E H1.J H1.U H2.L H2.P H2.W H2.B H2.E H2.J H2.U C.L C.P C.W C.B C.E C.J C.U vol int stat comment flag0 0 {?} 4.42500 0.05700 0.05700 ++ 0.00000 {?} {?} 1.15300 0.18600 0.18600 ++ 0.00000 {?} {?} 27.06400 0.99000 0.31500 ++ 0.00000 {?} 7.91950 0.33640 0 {?} 0 1 {?} 4.27100 0.09000 0.09000 ++ 0.00000 {?} {?} 1.39200 0.20900 0.20900 +E 0.00000 {?} {?} 25.40300 0.38000 0.38000 ++ 0.00000 {?} 16.89840 0.56300 0 {?} 0 2 {?} 4.56300 0.08000 0.08000 ? 0.00000 {?} {?} 1.16200 0.25600 0.17200 ++ 0.00000 {?} {?} 22.01200 0.71900 1.55300 ? 0.00000 {?} 8.19610 0.41200 0 {?} 0 3 {?} 4.42200 0.07700 0.09000 ? 0.00000 {?} {?} 1.17000 0.17200 0.20300 ++ 0.00000 {?} {?} 21.45200 1.55300 1.55300 ? 0.00000 {?} 62.66110 0.72140 0 {?} 0 4 {505.H4'} 4.31800 0.04600 0.08500 ? 0.00000 {?} {380.HB1} 1.20400 0.15600 0.24400 ? 0.00000 {?} {380.CB} 20.20800 0.88000 0.88000 ? 0.00000 {?} 59.89030 1.79970 0 {?} 0 5 {505.H5'} 4.24000 0.04300 0.07700 ? 0.00000 {?} {380.HB1} 1.20500 0.14800 0.23100 ? 0.00000 {?} {380.CB} 20.20800 0.88400 0.88400 ? 0.00000 {?} 58.21230 1.83520 0 {?} 0 6 {505.H5''} 4.12600 0.09000 0.09000 ? 0.00000 {?} {380.HB1} 1.20900 0.17900 0.22400 ? 0.00000 {?} {380.CB} 20.20800 0.66000 0.66000 ? 0.00000 {?} 31.04430 0.81810 0 {?} 0 7 {505.H1'} 6.00000 0.05500 0.09000 ++ 0.00000 {?} {380.HB1} 1.20900 0.13900 0.20000 ++ 0.00000 {?} {380.CB} 20.71800 0.80000 0.80000 EE 0.00000 {?} 31.90970 1.24970 0 {?} 0 8 {505.H5''} 4.13100 0.08400 0.08400 ? 0.00000 {?} {382.HD21} -0.07400 0.08300 0.20600 ? 0.00000 {?} {382.CD2} 21.75300 0.84600 0.84600 EE 0.00000 {?} 28.89540 0.90030 0 {?} 0 9 {505.H5'} 4.24000 0.05900 0.10400 ? 0.00000 {?} {382.HD21} -0.07300 0.08900 0.22400 ? 0.00000 {?} {382.CD2} 21.75300 0.93600 0.93600 EE 0.00000 {?} 43.21510 1.71620 0 {?} 0 10 {505.H4'} 4.31800 0.03300 0.08000 ? 0.00000 {?} {382.HD21} -0.06800 0.10000 0.20400 ++ 0.00000 {?} {382.CD2} 21.75300 0.86800 0.86800 EE 0.00000 {?} 17.57690 1.01910 0 {?} 0 11 {505.H2'} 4.42500 0.06500 0.10300 ? 0.00000 {?} {382.HD21} -0.08500 0.16100 0.18700 ++ 0.00000 {?} {382.CD2} 21.75300 0.62300 0.62300 EE 0.00000 {?} 12.89270 0.41230 0 {?} 0 12 {505.H1'} 5.99500 0.04600 0.03900 ++ 0.00000 {?} {382.HD21} -0.08100 0.16400 0.13800 ++ 0.00000 {?} {382.CD2} 21.75300 0.40800 0.40800 EE 0.00000 {?} 2.54590 0.27100 0 {?} 0 13 {?} 7.74100 0.07300 0.07600 ++ 0.00000 {?} {?} 0.90300 0.12500 0.12800 ++ 0.00000 {?} {?} 14.50600 0.53500 0.53500 EE 0.00000 {?} 6.87910 0.34030 0 {?} 0 14 {?} 8.32600 0.05500 0.04900 ++ 0.00000 {?} {?} 0.93900 0.07300 0.07300 ++ 0.00000 {?} {?} 14.50600 0.33100 0.33100 EE 0.00000 {?} 2.22250 0.24170 0 {?} 0 15 {?} 7.74700 0.07500 0.08000 ++ 0.00000 {?} {?} 0.88100 0.11800 0.12900 ++ 0.00000 {?} {?} 17.09400 0.57300 0.57300 EE 0.00000 {?} 8.07380 0.36830 0 {?} 0 16 {?} 8.10700 0.06200 0.07200 ++ 0.00000 {?} {?} 1.57100 0.14900 0.21200 ++ 0.00000 {?} {?} 18.64700 0.61200 0.61200 EE 0.00000 {?} 9.47250 0.40160 0 {?} 0 17 {?} 8.04300 0.06800 0.13000 ++ 0.00000 {?} {?} 0.76700 0.07700 0.24700 ? 0.00000 {?} {?} 22.78800 0.82600 0.82600 EE 0.00000 {?} 20.75880 0.81430 0 {?} 0 18 {?} 4.32400 0.04500 0.04800 ++ 0.00000 {?} {?} 1.17500 0.12600 0.13700 ++ 0.00000 {?} {?} 22.27100 0.57500 0.57500 EE 0.00000 {?} 5.51810 0.36970 0 {?} 0 19 {?} 6.00500 0.07000 0.08300 ++ 0.00000 {?} {?} 0.83500 0.18200 0.22400 ++ 0.00000 {?} {?} 25.37700 0.63100 0.63100 EE 0.00000 {?} 13.05920 0.42070 0 {?} 0 20 {?} 4.28200 0.10900 0.14200 ++ 0.00000 {?} {?} 0.83000 0.14500 0.17100 ++ 0.00000 {?} {?} 25.37700 0.68000 0.68000 EE 0.00000 {?} 20.70360 0.47820 0 {?} 0 21 {?} 4.32400 0.04300 0.13100 ? 0.00000 {?} {?} 1.58700 0.14600 0.31800 ? 0.00000 {?} {?} 27.96500 0.87700 0.87700 EE 0.00000 {?} 31.72010 1.07330 0 {?} 0 22 {?} 5.71700 0.09400 0.09400 ++ 0.00000 {?} {?} 1.57800 0.12900 0.12100 ++ 0.00000 {?} {?} 27.96500 0.47700 0.47700 EE 0.00000 {?} 8.18590 0.30480 0 {?} 0 23 {504.H1'} 5.61300 0.07400 0.08900 ? 0.00000 {?} {315.HD1} 1.64300 0.17700 0.20600 ++ 0.00000 {?} {315.CD} 29.00100 0.62800 0.62800 EE 0.00000 {?} 12.62680 0.41760 0 {?} 0 24 {504.H3'} 4.42400 0.02300 0.09000 ? 0.00000 {?} {315.HD1} 1.64200 0.17200 0.22400 ++ 0.00000 {?} {315.CD} 29.00100 0.70500 0.70500 EE 0.00000 {?} 5.88770 0.51530 0 {?} 0 25 {504.H2'} 4.25300 0.09500 0.09500 ? 0.00000 {?} {315.HD1} 1.63800 0.16400 0.23100 ++ 0.00000 {?} {315.CD} 29.00100 0.76900 0.76900 EE 0.00000 {?} 27.04100 0.63920 0 {?} 0 26 {504.H4'} 4.33600 0.04700 0.08600 ? 0.00000 {?} {315.HD1} 1.64100 0.10600 0.23400 ? 0.00000 {?} {315.CD} 29.00100 0.91600 0.91600 EE 0.00000 {?} 34.09370 1.42700 0 {?} 0 27 {?} 7.13400 0.04900 0.05700 ++ 0.00000 {?} {?} 3.22900 0.19600 0.21500 ? 0.00000 {?} {?} 29.51800 0.61500 0.61500 EE 0.00000 {?} 10.37760 0.40510 0 {?} 0 28 {?} 7.13900 0.05600 0.05700 ++ 0.00000 {?} {?} 3.05200 0.19800 0.20400 ? 0.00000 {?} {?} 29.51800 0.54200 0.54200 EE 0.00000 {?} 9.04750 0.34460 0 {?} 0 29 {?} 4.32600 0.07500 0.19500 ++ 0.00000 {?} {?} 1.76600 0.21200 0.38500 ? 0.00000 {?} {?} 31.58900 0.88000 0.88000 EE 0.00000 {?} 68.32130 1.09300 0 {?} 0 30 {?} 4.38900 0.07700 0.08900 ++ 0.00000 {?} {?} 2.23700 0.07500 0.17700 ? 0.00000 {?} {?} 32.62400 0.60300 0.60300 EE 0.00000 {?} 7.78720 0.39330 0 {?} 0 31 {?} 4.27200 0.06300 0.10000 ? 0.00000 {?} {?} 1.72900 0.21100 0.38500 ? 0.00000 {?} {?} 33.66000 0.84100 0.84100 EE 0.00000 {?} 43.40700 0.87710 0 {?} 0 32 {504.H4'} 4.33900 0.03400 0.08300 ? 0.00000 {?} {315.HE1} 2.95800 0.10600 0.25200 ? 0.00000 {?} {315.CE} 42.97800 0.92300 0.92300 EE 0.00000 {?} 25.63230 1.51180 0 {?} 0 33 {504.H2'} 4.20800 0.05600 0.08300 ? 0.00000 {?} {315.HE1} 2.96300 0.16300 0.19500 ++ 0.00000 {?} {315.CE} 42.97800 0.64500 0.64500 EE 0.00000 {?} 11.23060 0.43580 0 {?} 0 34 {504.H3'} 4.42700 0.02400 0.07200 ? 0.00000 {?} {315.HE1} 2.96500 0.15700 0.20500 ? 0.00000 {?} {315.CE} 42.97800 0.71100 0.71100 EE 0.00000 {?} 7.23510 0.52500 0 {?} 0 35 {?} 4.32600 0.06800 0.09700 ? 0.00000 {?} {?} 3.14000 0.12900 0.21600 ? 0.00000 {?} {?} 43.49600 0.82300 0.82300 EE 0.00000 {?} 28.60790 0.80110 0 {?} 0 36 {505.H1'} 5.99900 0.05600 0.08800 ++ 0.00000 {?} {380.HA} 4.40300 0.14600 0.27200 ? 0.00000 {?} {380.CA} 51.77800 0.86100 0.86100 EE 0.00000 {?} 37.88070 0.97450 0 {?} 0 37 {?} 7.74000 0.05100 0.06400 ++ 0.00000 {?} {?} 1.81400 0.14300 0.17900 ++ 0.00000 {?} {?} 37.28300 0.67000 0.67000 EE 0.00000 {?} 7.06930 0.32340 0 {?} 0 38 {?} 5.69300 0.04600 0.07100 ? 0.00000 {?} {?} 1.62400 0.14000 0.17700 ++ 0.00000 {?} {?} 29.00100 0.69600 0.69600 EE 0.00000 {?} 6.11440 0.34860 0 {?} 0 39 {504.H5} 5.61400 0.05700 0.07500 ? 0.00000 {?} {315.HE1} 2.93900 0.17500 0.21300 ? 0.00000 {?} {315.CE} 42.97800 0.68400 0.68400 EE 0.00000 {?} 10.36330 0.33650 0 {?} 0 40 {504.H5'} 4.14100 0.04100 0.04100 ? 0.00000 {?} {315.HE1} 2.96600 0.16000 0.15700 ++ 0.00000 {?} {315.CE} 42.97800 0.50500 0.50500 EE 0.00000 {?} 2.99660 0.22280 0 {?} 0 41 {505.H2'} 4.41700 0.07300 0.11400 ? 0.00000 {?} {380.HB1} 1.21400 0.15400 0.21600 ++ 0.00000 {?} {380.CB} 20.20000 0.74400 0.74400 EE 0.00000 {?} 18.93320 0.58490 0 {?} 0 ; save_