data_15100 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR structure of E.coli YfgJ protein modelled with two Zn+2 bound. Northeast Structural Genomics Consortium Target ER317. ; _BMRB_accession_number 15100 _BMRB_flat_file_name bmr15100.str _Entry_type original _Submission_date 2007-01-12 _Accession_date 2007-01-12 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Ramelot Theresa A. . 2 Cort John R. . 3 Yee Adelinda A. . 4 Semesi Anthony . . 5 Johnathan Lukin . . 6 Arrowsmith Cheryl H. . 7 Kennedy Michael A. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 spectral_peak_list 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 410 "13C chemical shifts" 302 "15N chemical shifts" 71 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-05-25 update BMRB 'update entity name' 2009-06-23 update BMRB 'added time domain data' 2007-10-03 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'NMR structure of E.coli YfgJ protein modelled with two Zn+2 bound. Northeast Structural Genomics Consortium Target ER317.' _Citation_status 'in preparation' _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Ramelot Theresa A. . 2 Cort John R. . 3 Yee Adelinda A. . 4 Arrowsmith Cheryl H. . 5 Kennedy Michael A. . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . loop_ _Keyword 'all beta' C3H C4 'C4C3H zinc finger' Zn+2 stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'YfgJ with Zn+2' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'YfgJ protein' $entity_1 '1st Zn+2' $ZN '2nd Zn+2' $ZN stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic ? _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'YfgJ protein' _Molecular_mass 8010.390 _Mol_thiol_state 'free and other bound' loop_ _Biological_function unknown stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 101 _Mol_residue_sequence ; FCLTLRRRYTMGSSHHHHHH SSGLVPRGSHMELHCPQCQH VLDQDNGHARCRSCGEFIEM KALCPDCHQPLQVLKACGAV DYFCQHGHGLISKKRVEFVL A ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -29 PHE 2 -28 CYS 3 -27 LEU 4 -26 THR 5 -25 LEU 6 -24 ARG 7 -23 ARG 8 -22 ARG 9 -21 TYR 10 -20 THR 11 -19 MET 12 -18 GLY 13 -17 SER 14 -16 SER 15 -15 HIS 16 -14 HIS 17 -13 HIS 18 -12 HIS 19 -11 HIS 20 -10 HIS 21 -9 SER 22 -8 SER 23 -7 GLY 24 -6 LEU 25 -5 VAL 26 -4 PRO 27 -3 ARG 28 -2 GLY 29 -1 SER 30 0 HIS 31 1 MET 32 2 GLU 33 3 LEU 34 4 HIS 35 5 CYS 36 6 PRO 37 7 GLN 38 8 CYS 39 9 GLN 40 10 HIS 41 11 VAL 42 12 LEU 43 13 ASP 44 14 GLN 45 15 ASP 46 16 ASN 47 17 GLY 48 18 HIS 49 19 ALA 50 20 ARG 51 21 CYS 52 22 ARG 53 23 SER 54 24 CYS 55 25 GLY 56 26 GLU 57 27 PHE 58 28 ILE 59 29 GLU 60 30 MET 61 31 LYS 62 32 ALA 63 33 LEU 64 34 CYS 65 35 PRO 66 36 ASP 67 37 CYS 68 38 HIS 69 39 GLN 70 40 PRO 71 41 LEU 72 42 GLN 73 43 VAL 74 44 LEU 75 45 LYS 76 46 ALA 77 47 CYS 78 48 GLY 79 49 ALA 80 50 VAL 81 51 ASP 82 52 TYR 83 53 PHE 84 54 CYS 85 55 GLN 86 56 HIS 87 57 GLY 88 58 HIS 89 59 GLY 90 60 LEU 91 61 ILE 92 62 SER 93 63 LYS 94 64 LYS 95 65 ARG 96 66 VAL 97 67 GLU 98 68 PHE 99 69 VAL 100 70 LEU 101 71 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-10-21 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 2JNE "Nmr Structure Of E.Coli Yfgj Modelled With Two Zn+2 Bound. Northeast Structural Genomics Consortium Target Er317" 100.00 101 100.00 100.00 3.48e-66 DBJ BAE76728 "hypothetical protein [Escherichia coli str. K12 substr. W3110]" 70.30 71 100.00 100.00 2.86e-43 DBJ BAI31784 "conserved predicted protein [Escherichia coli O103:H2 str. 12009]" 70.30 71 97.18 97.18 2.03e-41 DBJ BAJ44293 "hypothetical protein ECDH1ME8569_2437 [Escherichia coli DH1]" 70.30 71 100.00 100.00 2.86e-43 DBJ BAL39266 "predicted protein [Escherichia coli str. K-12 substr. MDS42]" 70.30 71 100.00 100.00 2.86e-43 EMBL CAQ32881 "predicted protein [Escherichia coli BL21(DE3)]" 70.30 71 100.00 100.00 2.86e-43 EMBL CBJ02173 "conserved hypothetical protein [Escherichia coli ETEC H10407]" 70.30 71 100.00 100.00 2.86e-43 EMBL CCP95953 "Hypothetical protein yfgJ [Escherichia coli O10:K5(L):H4 str. ATCC 23506]" 70.30 71 100.00 100.00 2.86e-43 EMBL CCQ02273 "Hypothetical protein yfgJ [Escherichia coli O5:K4(L):H4 str. ATCC 23502]" 70.30 71 100.00 100.00 2.86e-43 EMBL CDJ72855 "hypothetical protein BN896_2274 [Escherichia coli str. K-12 substr. MC4100]" 70.30 71 100.00 100.00 2.86e-43 GB AAC75563 "DUF1407 family protein [Escherichia coli str. K-12 substr. MG1655]" 70.30 71 100.00 100.00 2.86e-43 GB ABV17482 "conserved hypothetical protein [Escherichia coli O139:H28 str. E24377A]" 70.30 71 97.18 97.18 2.03e-41 GB ACB03662 "predicted protein [Escherichia coli str. K-12 substr. DH10B]" 70.30 71 100.00 100.00 2.86e-43 GB ACD09416 "conserved hypothetical protein [Shigella boydii CDC 3083-94]" 70.30 71 97.18 97.18 2.03e-41 GB ACR64901 "predicted protein [Escherichia coli BW2952]" 70.30 71 100.00 100.00 2.86e-43 REF NP_417005 "DUF1407 family protein [Escherichia coli str. K-12 substr. MG1655]" 70.30 71 100.00 100.00 2.86e-43 REF WP_001295478 "hypothetical protein [Escherichia coli]" 70.30 71 98.59 98.59 3.41e-42 REF WP_001297332 "MULTISPECIES: hypothetical protein [Enterobacteriaceae]" 70.30 71 97.18 97.18 2.03e-41 REF WP_001301158 "MULTISPECIES: DUF1407 domain-containing protein [Proteobacteria]" 70.30 71 100.00 100.00 2.86e-43 REF WP_001341056 "hypothetical protein [Escherichia coli]" 70.30 71 98.59 100.00 9.78e-43 SP P76575 "RecName: Full=Uncharacterized protein YfgJ" 70.30 71 100.00 100.00 2.86e-43 stop_ save_ ############# # Ligands # ############# save_ZN _Saveframe_category ligand _Mol_type non-polymer _Name_common "ZN (ZINC ION)" _BMRB_code . _PDB_code ZN _Molecular_mass 65.409 _Mol_charge 2+ _Mol_paramagnetic . _Mol_aromatic . _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Wed Dec 20 05:48:03 2006 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons ZN ZN ZN N 2 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $entity_1 . . . . Escherichia coli YfgJ stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity_1 'recombinant technology' . Escherichia coli . pET stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1 mM '[U-100% 13C]' TRIS 10 mM 'natural abundance' 'sodium chloride' 250 mM 'natural abundance' $ZN 10 uM 'natural abundance' DTT 10 mM 'natural abundance' 'sodium azide' 0.01 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_AutoStructure _Saveframe_category software _Name AutoStruct _Version 2.1.1 loop_ _Vendor _Address _Electronic_address 'Huang, Swapana, Rajan, Ke, Xia, Shukla, Inouye and Montelione' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_X-PLOR_NIH _Saveframe_category software _Name 'X-PLOR NIH' _Version 2.15.0 loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_CNS _Saveframe_category software _Name CNS _Version 1.1 loop_ _Vendor _Address _Electronic_address 'Brunger, Adams, Clore, Gros, Nilges and Read' . . stop_ loop_ _Task refinement stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version 3.1 loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'peak picking' stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version linux9 loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_nmr_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details 'at PNNL' save_ save_nmr_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 750 _Details 'at PNNL' save_ save_nmr_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _Details 'at PNNL' save_ ############################# # NMR applied experiments # ############################# save_3D_1H-15N_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_NMR_spectrometer_expt_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 250 1 mM pH 7.3 0.2 pH pressure 1 . atm temperature 298 1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . indirect . . . 0.101329118 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 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $SPARKY stop_ loop_ _Experiment_label '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'YfgJ protein' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 31 MET H H 8.21 0.02 1 2 1 31 MET HA H 4.43 0.02 1 3 1 31 MET HB2 H 1.99 0.02 2 4 1 31 MET HB3 H 2.08 0.02 2 5 1 31 MET HG2 H 2.46 0.02 1 6 1 31 MET HG3 H 2.46 0.02 1 7 1 31 MET C C 175.4 0.2 1 8 1 31 MET CA C 55.3 0.2 1 9 1 31 MET CB C 32.8 0.2 1 10 1 31 MET CG C 31.9 0.2 1 11 1 31 MET N N 120.8 0.2 1 12 2 32 GLU H H 8.37 0.02 1 13 2 32 GLU HA H 4.28 0.02 1 14 2 32 GLU HB2 H 1.9 0.02 1 15 2 32 GLU HB3 H 1.9 0.02 1 16 2 32 GLU HG2 H 2.16 0.02 2 17 2 32 GLU HG3 H 2.25 0.02 2 18 2 32 GLU C C 175.1 0.2 1 19 2 32 GLU CA C 56.1 0.2 1 20 2 32 GLU CB C 30.7 0.2 1 21 2 32 GLU CG C 36.5 0.2 1 22 2 32 GLU N N 122.2 0.2 1 23 3 33 LEU H H 8.53 0.02 1 24 3 33 LEU HA H 4.6 0.02 1 25 3 33 LEU HB2 H 1.3 0.02 2 26 3 33 LEU HB3 H 1.57 0.02 2 27 3 33 LEU HG H 1.63 0.02 1 28 3 33 LEU HD1 H 0.75 0.02 1 29 3 33 LEU HD2 H 0.87 0.02 1 30 3 33 LEU C C 175.7 0.2 1 31 3 33 LEU CA C 53.7 0.2 1 32 3 33 LEU CB C 44.8 0.2 1 33 3 33 LEU CG C 26.9 0.2 1 34 3 33 LEU CD1 C 25.9 0.02 1 35 3 33 LEU CD2 C 23.4 0.02 1 36 3 33 LEU N N 123.5 0.2 1 37 4 34 HIS H H 8.42 0.02 1 38 4 34 HIS HA H 4.82 0.02 1 39 4 34 HIS HB2 H 2.65 0.02 2 40 4 34 HIS HB3 H 2.79 0.02 2 41 4 34 HIS HD2 H 6.87 0.02 1 42 4 34 HIS C C 173.5 0.2 1 43 4 34 HIS CA C 55.3 0.2 1 44 4 34 HIS CB C 32.3 0.2 1 45 4 34 HIS CD2 C 120.8 0.2 1 46 4 34 HIS N N 119.6 0.2 1 47 5 35 CYS H H 9.32 0.02 1 48 5 35 CYS HA H 4.31 0.02 1 49 5 35 CYS HB2 H 3.11 0.02 2 50 5 35 CYS HB3 H 3.21 0.02 2 51 5 35 CYS CA C 57.3 0.2 1 52 5 35 CYS CB C 31.9 0.2 1 53 5 35 CYS N N 125.6 0.2 1 54 6 36 PRO HA H 4.46 0.02 1 55 6 36 PRO HB2 H 2.08 0.02 2 56 6 36 PRO HB3 H 2.4 0.02 2 57 6 36 PRO HG2 H 2.14 0.02 1 58 6 36 PRO HG3 H 2.14 0.02 1 59 6 36 PRO HD2 H 3.94 0.02 2 60 6 36 PRO HD3 H 4.13 0.02 2 61 6 36 PRO C C 177 0.2 1 62 6 36 PRO CA C 64.2 0.2 1 63 6 36 PRO CB C 32.3 0.2 1 64 6 36 PRO CG C 27.4 0.2 1 65 6 36 PRO CD C 51.5 0.2 1 66 7 37 GLN H H 9.28 0.02 1 67 7 37 GLN HA H 4.51 0.02 1 68 7 37 GLN HB2 H 2.18 0.02 2 69 7 37 GLN HB3 H 2.28 0.02 2 70 7 37 GLN HG2 H 2.33 0.02 2 71 7 37 GLN HG3 H 2.38 0.02 2 72 7 37 GLN HE21 H 7.74 0.02 2 73 7 37 GLN HE22 H 6.84 0.02 2 74 7 37 GLN C C 177.6 0.2 1 75 7 37 GLN CA C 57.4 0.2 1 76 7 37 GLN CB C 29.9 0.2 1 77 7 37 GLN CG C 33.6 0.2 1 78 7 37 GLN CD C 179.8 0.2 1 79 7 37 GLN N N 119.8 0.2 1 80 7 37 GLN NE2 N 112.6 0.2 1 81 8 38 CYS H H 8.77 0.02 1 82 8 38 CYS HA H 5.04 0.02 1 83 8 38 CYS HB2 H 2.55 0.02 2 84 8 38 CYS HB3 H 3.25 0.02 2 85 8 38 CYS C C 176.4 0.2 1 86 8 38 CYS CA C 59.2 0.2 1 87 8 38 CYS CB C 32.8 0.2 1 88 8 38 CYS N N 119.8 0.2 1 89 9 39 GLN H H 8.21 0.02 1 90 9 39 GLN HA H 4.17 0.02 1 91 9 39 GLN HB2 H 2.34 0.02 2 92 9 39 GLN HB3 H 2.47 0.02 2 93 9 39 GLN HG2 H 2.26 0.02 1 94 9 39 GLN HG3 H 2.26 0.02 1 95 9 39 GLN HE21 H 7.24 0.02 2 96 9 39 GLN HE22 H 6.48 0.02 2 97 9 39 GLN C C 174.7 0.2 1 98 9 39 GLN CA C 59.1 0.2 1 99 9 39 GLN CB C 26.1 0.2 1 100 9 39 GLN CG C 34.5 0.2 1 101 9 39 GLN CD C 180.4 0.2 1 102 9 39 GLN N N 116.2 0.2 1 103 9 39 GLN NE2 N 112.4 0.2 1 104 10 40 HIS H H 8.67 0.02 1 105 10 40 HIS HA H 4.54 0.02 1 106 10 40 HIS HB2 H 3.39 0.02 1 107 10 40 HIS HB3 H 3.39 0.02 1 108 10 40 HIS HD2 H 7.26 0.02 1 109 10 40 HIS C C 175.2 0.2 1 110 10 40 HIS CA C 58 0.2 1 111 10 40 HIS CB C 31.2 0.2 1 112 10 40 HIS CD2 C 123.7 0.2 1 113 10 40 HIS N N 123.2 0.2 1 114 11 41 VAL H H 8.18 0.02 1 115 11 41 VAL HA H 3.88 0.02 1 116 11 41 VAL HB H 1.85 0.02 1 117 11 41 VAL HG1 H 0.88 0.02 1 118 11 41 VAL HG2 H 0.87 0.02 1 119 11 41 VAL C C 176.3 0.2 1 120 11 41 VAL CA C 64.1 0.2 1 121 11 41 VAL CB C 32.1 0.2 1 122 11 41 VAL CG1 C 21.1 0.02 1 123 11 41 VAL CG2 C 22.2 0.02 1 124 11 41 VAL N N 123.4 0.2 1 125 12 42 LEU H H 8.34 0.02 1 126 12 42 LEU HA H 4.48 0.02 1 127 12 42 LEU HB2 H 1.16 0.02 2 128 12 42 LEU HB3 H 1.5 0.02 2 129 12 42 LEU HG H 1.55 0.02 1 130 12 42 LEU HD1 H 0.66 0.02 1 131 12 42 LEU HD2 H 0.75 0.02 1 132 12 42 LEU C C 176.7 0.2 1 133 12 42 LEU CA C 54.3 0.2 1 134 12 42 LEU CB C 43.8 0.2 1 135 12 42 LEU CG C 26.8 0.2 1 136 12 42 LEU CD1 C 26.7 0.02 1 137 12 42 LEU CD2 C 23.6 0.02 1 138 12 42 LEU N N 126.6 0.2 1 139 13 43 ASP H H 8.66 0.02 1 140 13 43 ASP HA H 4.91 0.02 1 141 13 43 ASP HB2 H 2.68 0.02 1 142 13 43 ASP HB3 H 2.68 0.02 1 143 13 43 ASP C C 175.7 0.2 1 144 13 43 ASP CA C 53.8 0.2 1 145 13 43 ASP CB C 42.4 0.2 1 146 13 43 ASP N N 121.8 0.2 1 147 14 44 GLN H H 8.74 0.02 1 148 14 44 GLN HA H 4.8 0.02 1 149 14 44 GLN HB2 H 1.83 0.02 2 150 14 44 GLN HB3 H 2.04 0.02 2 151 14 44 GLN HG2 H 2.1 0.02 2 152 14 44 GLN HG3 H 2.2 0.02 2 153 14 44 GLN HE21 H 7.54 0.02 2 154 14 44 GLN HE22 H 6.66 0.02 2 155 14 44 GLN C C 175 0.2 1 156 14 44 GLN CA C 55.7 0.2 1 157 14 44 GLN CB C 30.6 0.2 1 158 14 44 GLN CG C 34.4 0.2 1 159 14 44 GLN CD C 179 0.2 1 160 14 44 GLN N N 122.6 0.2 1 161 14 44 GLN NE2 N 111.2 0.2 1 162 15 45 ASP H H 8.46 0.02 1 163 15 45 ASP HA H 4.64 0.02 1 164 15 45 ASP HB2 H 2.54 0.02 1 165 15 45 ASP HB3 H 2.54 0.02 1 166 15 45 ASP CA C 54 0.2 1 167 15 45 ASP CB C 42.8 0.2 1 168 15 45 ASP N N 122.8 0.2 1 169 16 46 ASN HA H 4.33 0.02 1 170 16 46 ASN HB2 H 2.7 0.02 2 171 16 46 ASN HB3 H 2.95 0.02 2 172 16 46 ASN HD21 H 7.7 0.02 2 173 16 46 ASN HD22 H 6.91 0.02 2 174 16 46 ASN CA C 54.4 0.2 1 175 16 46 ASN CB C 38.5 0.2 1 176 16 46 ASN ND2 N 113.7 0.2 1 177 17 47 GLY H H 8.36 0.02 1 178 17 47 GLY HA2 H 2.96 0.02 2 179 17 47 GLY HA3 H 3.27 0.02 2 180 17 47 GLY C C 173.5 0.2 1 181 17 47 GLY CA C 45.5 0.2 1 182 17 47 GLY N N 106.8 0.2 1 183 18 48 HIS H H 7.94 0.02 1 184 18 48 HIS HA H 5.05 0.02 1 185 18 48 HIS HB2 H 2.97 0.02 2 186 18 48 HIS HB3 H 3.14 0.02 2 187 18 48 HIS HD2 H 6.79 0.02 1 188 18 48 HIS HE1 H 7.80 0.02 1 189 18 48 HIS C C 173.4 0.2 1 190 18 48 HIS CA C 54.7 0.2 1 191 18 48 HIS CB C 32.4 0.2 1 192 18 48 HIS CD2 C 120.8 0.2 1 193 18 48 HIS N N 119.1 0.2 1 194 19 49 ALA H H 8.94 0.02 1 195 19 49 ALA HA H 5.18 0.02 1 196 19 49 ALA HB H 1.26 0.02 1 197 19 49 ALA C C 175.3 0.2 1 198 19 49 ALA CA C 50.6 0.2 1 199 19 49 ALA CB C 22.2 0.2 1 200 19 49 ALA N N 124.7 0.2 1 201 20 50 ARG H H 8.54 0.02 1 202 20 50 ARG HA H 5.18 0.02 1 203 20 50 ARG HB2 H 1.69 0.02 1 204 20 50 ARG HB3 H 1.69 0.02 1 205 20 50 ARG HG2 H 1.37 0.02 1 206 20 50 ARG HG3 H 1.37 0.02 1 207 20 50 ARG HD2 H 2.98 0.02 2 208 20 50 ARG HD3 H 3.08 0.02 2 209 20 50 ARG C C 174.4 0.2 1 210 20 50 ARG CA C 54.2 0.2 1 211 20 50 ARG CB C 34.2 0.2 1 212 20 50 ARG CG C 27.4 0.2 1 213 20 50 ARG CD C 43.2 0.2 1 214 20 50 ARG N N 120 0.2 1 215 21 51 CYS H H 8.94 0.02 1 216 21 51 CYS HA H 4.66 0.02 1 217 21 51 CYS HB2 H 2.68 0.02 2 218 21 51 CYS HB3 H 3.16 0.02 2 219 21 51 CYS C C 178 0.2 1 220 21 51 CYS CA C 59.1 0.2 1 221 21 51 CYS CB C 31.7 0.2 1 222 21 51 CYS N N 127.7 0.2 1 223 22 52 ARG H H 9.32 0.02 1 224 22 52 ARG HA H 4.13 0.02 1 225 22 52 ARG HB2 H 1.86 0.02 2 226 22 52 ARG HB3 H 1.91 0.02 2 227 22 52 ARG HG2 H 1.68 0.02 1 228 22 52 ARG HG3 H 1.68 0.02 1 229 22 52 ARG HD2 H 3.2 0.02 1 230 22 52 ARG HD3 H 3.2 0.02 1 231 22 52 ARG C C 176.4 0.2 1 232 22 52 ARG CA C 57.9 0.2 1 233 22 52 ARG CB C 30.3 0.2 1 234 22 52 ARG CG C 27.5 0.2 1 235 22 52 ARG CD C 43.4 0.2 1 236 22 52 ARG N N 130.2 0.2 1 237 23 53 SER H H 8.72 0.02 1 238 23 53 SER HA H 4.36 0.02 1 239 23 53 SER HB2 H 3.1 0.02 2 240 23 53 SER HB3 H 3.84 0.02 2 241 23 53 SER C C 176 0.2 1 242 23 53 SER CA C 59.9 0.2 1 243 23 53 SER CB C 62.9 0.2 1 244 23 53 SER N N 116.8 0.2 1 245 24 54 CYS H H 9.29 0.02 1 246 24 54 CYS C C 177.2 0.2 1 247 24 54 CYS N N 121 0.2 1 248 25 55 GLY H H 7.63 0.02 1 249 25 55 GLY HA2 H 3.81 0.02 2 250 25 55 GLY HA3 H 4.22 0.02 2 251 25 55 GLY CA C 46 0.2 1 252 25 55 GLY N N 111.5 0.2 1 253 26 56 GLU HA H 4.29 0.02 1 254 26 56 GLU HB2 H 1.97 0.02 2 255 26 56 GLU HB3 H 2.03 0.02 2 256 26 56 GLU HG2 H 2.28 0.02 1 257 26 56 GLU HG3 H 2.28 0.02 1 258 26 56 GLU C C 175 0.2 1 259 26 56 GLU CA C 57.5 0.2 1 260 26 56 GLU CB C 30.3 0.2 1 261 27 57 PHE H H 8.61 0.02 1 262 27 57 PHE HA H 5.21 0.02 1 263 27 57 PHE HB2 H 3 0.02 2 264 27 57 PHE HB3 H 3.06 0.02 2 265 27 57 PHE HD1 H 7.18 0.02 1 266 27 57 PHE HD2 H 7.18 0.02 1 267 27 57 PHE HE1 H 6.97 0.02 1 268 27 57 PHE HE2 H 6.97 0.02 1 269 27 57 PHE HZ H 6.96 0.02 1 270 27 57 PHE C C 175 0.2 1 271 27 57 PHE CA C 57.1 0.2 1 272 27 57 PHE CB C 40.8 0.2 1 273 27 57 PHE CD1 C 131.7 0.02 1 274 27 57 PHE CD2 C 131.7 0.02 1 275 27 57 PHE CE1 C 129.4 0.02 1 276 27 57 PHE CE2 C 129.4 0.02 1 277 27 57 PHE CZ C 132.2 0.2 1 278 27 57 PHE N N 124.5 0.2 1 279 28 58 ILE H H 8.73 0.02 1 280 28 58 ILE HA H 4.3 0.02 1 281 28 58 ILE HB H 1.66 0.02 1 282 28 58 ILE HG12 H 1.2 0.02 2 283 28 58 ILE HG13 H 1.39 0.02 2 284 28 58 ILE HG2 H 0.84 0.02 1 285 28 58 ILE HD1 H 0.85 0.02 1 286 28 58 ILE C C 174.6 0.2 1 287 28 58 ILE CA C 59.7 0.2 1 288 28 58 ILE CB C 41.7 0.2 1 289 28 58 ILE CG1 C 27.7 0.2 1 290 28 58 ILE CG2 C 18.5 0.2 1 291 28 58 ILE CD1 C 14.1 0.2 1 292 28 58 ILE N N 126.1 0.2 1 293 29 59 GLU H H 8.64 0.02 1 294 29 59 GLU HA H 4.29 0.02 1 295 29 59 GLU HB2 H 1.95 0.02 2 296 29 59 GLU HB3 H 2.03 0.02 2 297 29 59 GLU HG2 H 2.21 0.02 1 298 29 59 GLU HG3 H 2.21 0.02 1 299 29 59 GLU C C 175.6 0.2 1 300 29 59 GLU CA C 56.4 0.2 1 301 29 59 GLU CB C 30.3 0.2 1 302 29 59 GLU CG C 36.6 0.2 1 303 29 59 GLU N N 127.1 0.2 1 304 30 60 MET H H 8.41 0.02 1 305 30 60 MET HA H 4.86 0.02 1 306 30 60 MET HB2 H 1.79 0.02 2 307 30 60 MET HB3 H 2.15 0.02 2 308 30 60 MET HG2 H 2 0.02 2 309 30 60 MET HG3 H 2.28 0.02 2 310 30 60 MET HE H 1.56 0.02 1 311 30 60 MET C C 175.2 0.2 1 312 30 60 MET CA C 55.3 0.2 1 313 30 60 MET CB C 35.3 0.2 1 314 30 60 MET CG C 32.6 0.2 1 315 30 60 MET CE C 17.4 0.2 1 316 30 60 MET N N 123.8 0.2 1 317 31 61 LYS H H 9.18 0.02 1 318 31 61 LYS HA H 4.65 0.02 1 319 31 61 LYS HB2 H 1.66 0.02 1 320 31 61 LYS HB3 H 1.66 0.02 1 321 31 61 LYS HG2 H 1.3 0.02 2 322 31 61 LYS HG3 H 1.44 0.02 2 323 31 61 LYS HD2 H 1.68 0.02 1 324 31 61 LYS HD3 H 1.68 0.02 1 325 31 61 LYS HE2 H 2.95 0.02 1 326 31 61 LYS HE3 H 2.95 0.02 1 327 31 61 LYS C C 174.3 0.2 1 328 31 61 LYS CA C 55.2 0.2 1 329 31 61 LYS CB C 34.4 0.2 1 330 31 61 LYS CG C 24.5 0.2 1 331 31 61 LYS CD C 29.4 0.2 1 332 31 61 LYS CE C 41.7 0.2 1 333 31 61 LYS N N 122.6 0.2 1 334 32 62 ALA H H 8.35 0.02 1 335 32 62 ALA HA H 4.21 0.02 1 336 32 62 ALA HB H 1.1 0.02 1 337 32 62 ALA C C 176 0.2 1 338 32 62 ALA CA C 50.9 0.2 1 339 32 62 ALA CB C 21.1 0.2 1 340 32 62 ALA N N 127.2 0.2 1 341 33 63 LEU H H 9.18 0.02 1 342 33 63 LEU HA H 4.61 0.02 1 343 33 63 LEU HB2 H 1.88 0.02 2 344 33 63 LEU HB3 H 0.83 0.02 2 345 33 63 LEU HG H 1.52 0.02 1 346 33 63 LEU HD1 H 0.76 0.02 1 347 33 63 LEU HD2 H 0.57 0.02 1 348 33 63 LEU C C 175 0.2 1 349 33 63 LEU CA C 52.8 0.2 1 350 33 63 LEU CB C 44.2 0.2 1 351 33 63 LEU CG C 26.7 0.2 1 352 33 63 LEU CD1 C 26 0.02 1 353 33 63 LEU CD2 C 21.9 0.02 1 354 33 63 LEU N N 125.1 0.2 1 355 34 64 CYS H H 8.05 0.02 1 356 34 64 CYS HA H 4.37 0.02 1 357 34 64 CYS HB2 H 2.84 0.02 2 358 34 64 CYS HB3 H 3.27 0.02 2 359 34 64 CYS CA C 56.5 0.2 1 360 34 64 CYS CB C 31.5 0.2 1 361 34 64 CYS N N 123.4 0.2 1 362 35 65 PRO HA H 4.24 0.02 1 363 35 65 PRO HB2 H 1.88 0.02 2 364 35 65 PRO HB3 H 2.35 0.02 2 365 35 65 PRO HG2 H 1.79 0.02 1 366 35 65 PRO HG3 H 1.79 0.02 1 367 35 65 PRO HD2 H 3.4 0.02 2 368 35 65 PRO HD3 H 4.32 0.02 2 369 35 65 PRO C C 175.5 0.2 1 370 35 65 PRO CA C 63.8 0.2 1 371 35 65 PRO CB C 32 0.2 1 372 35 65 PRO CG C 26.8 0.2 1 373 35 65 PRO CD C 51 0.2 1 374 36 66 ASP H H 8.79 0.02 1 375 36 66 ASP HA H 4.52 0.02 1 376 36 66 ASP HB2 H 1.09 0.02 2 377 36 66 ASP HB3 H 1.59 0.02 2 378 36 66 ASP C C 176.6 0.2 1 379 36 66 ASP CA C 56.3 0.2 1 380 36 66 ASP CB C 40.8 0.2 1 381 36 66 ASP N N 121.7 0.2 1 382 37 67 CYS H H 7.75 0.02 1 383 37 67 CYS HA H 4.9 0.02 1 384 37 67 CYS HB2 H 2.96 0.02 2 385 37 67 CYS HB3 H 3.29 0.02 2 386 37 67 CYS C C 175.8 0.2 1 387 37 67 CYS CA C 58.2 0.2 1 388 37 67 CYS CB C 32.8 0.2 1 389 37 67 CYS N N 116 0.2 1 390 38 68 HIS H H 7.93 0.02 1 391 38 68 HIS HA H 4.49 0.02 1 392 38 68 HIS HB2 H 3.34 0.02 1 393 38 68 HIS HB3 H 3.34 0.02 1 394 38 68 HIS HD2 H 6.93 0.02 1 395 38 68 HIS C C 172.9 0.2 1 396 38 68 HIS CA C 57.6 0.2 1 397 38 68 HIS CB C 26.6 0.2 1 398 38 68 HIS CD2 C 119.6 0.2 1 399 38 68 HIS N N 118.1 0.2 1 400 39 69 GLN H H 7.65 0.02 1 401 39 69 GLN HA H 4.83 0.02 1 402 39 69 GLN HB2 H 2.07 0.02 2 403 39 69 GLN HB3 H 2.11 0.02 2 404 39 69 GLN HG2 H 1.84 0.02 2 405 39 69 GLN HG3 H 2.25 0.02 2 406 39 69 GLN HE21 H 6.7 0.02 2 407 39 69 GLN HE22 H 7.17 0.02 2 408 39 69 GLN CA C 53.6 0.2 1 409 39 69 GLN CB C 28.5 0.2 1 410 39 69 GLN CG C 33.7 0.2 1 411 39 69 GLN CD C 180 0.2 1 412 39 69 GLN N N 116.7 0.2 1 413 39 69 GLN NE2 N 112.9 0.2 1 414 40 70 PRO HA H 4.68 0.02 1 415 40 70 PRO HB2 H 2.07 0.02 2 416 40 70 PRO HB3 H 2.33 0.02 2 417 40 70 PRO HG2 H 1.88 0.02 2 418 40 70 PRO HG3 H 2.31 0.02 2 419 40 70 PRO HD2 H 3.81 0.02 2 420 40 70 PRO HD3 H 3.91 0.02 2 421 40 70 PRO C C 176.7 0.2 1 422 40 70 PRO CA C 63.9 0.2 1 423 40 70 PRO CB C 32.2 0.2 1 424 40 70 PRO CG C 28.1 0.2 1 425 40 70 PRO CD C 50.9 0.2 1 426 41 71 LEU H H 8.24 0.02 1 427 41 71 LEU HA H 4.55 0.02 1 428 41 71 LEU HB2 H 1.47 0.02 2 429 41 71 LEU HB3 H 1.54 0.02 2 430 41 71 LEU HG H 1.67 0.02 1 431 41 71 LEU HD1 H 0.58 0.02 1 432 41 71 LEU HD2 H 0.89 0.02 1 433 41 71 LEU C C 177.7 0.2 1 434 41 71 LEU CA C 54.6 0.2 1 435 41 71 LEU CB C 43.5 0.2 1 436 41 71 LEU CG C 27.8 0.2 1 437 41 71 LEU CD1 C 28.4 0.02 1 438 41 71 LEU CD2 C 25.5 0.02 1 439 41 71 LEU N N 124.6 0.2 1 440 42 72 GLN H H 9.24 0.02 1 441 42 72 GLN HA H 4.54 0.02 1 442 42 72 GLN HB2 H 2.2 0.02 2 443 42 72 GLN HB3 H 2.38 0.02 2 444 42 72 GLN HG2 H 2.31 0.02 2 445 42 72 GLN HG3 H 2.51 0.02 2 446 42 72 GLN HE21 H 7.32 0.02 2 447 42 72 GLN HE22 H 6.6 0.02 2 448 42 72 GLN C C 175 0.2 1 449 42 72 GLN CA C 55.6 0.2 1 450 42 72 GLN CB C 29.7 0.2 1 451 42 72 GLN CG C 33.9 0.2 1 452 42 72 GLN CD C 179.3 0.2 1 453 42 72 GLN N N 122 0.2 1 454 42 72 GLN NE2 N 110.1 0.2 1 455 43 73 VAL H H 8.57 0.02 1 456 43 73 VAL HA H 4.31 0.02 1 457 43 73 VAL HB H 2.01 0.02 1 458 43 73 VAL HG1 H 0.7 0.02 1 459 43 73 VAL HG2 H 1.06 0.02 1 460 43 73 VAL C C 175.7 0.2 1 461 43 73 VAL CA C 62.3 0.2 1 462 43 73 VAL CB C 32.1 0.2 1 463 43 73 VAL CG1 C 21.6 0.02 1 464 43 73 VAL CG2 C 20.9 0.02 1 465 43 73 VAL N N 126.6 0.2 1 466 44 74 LEU H H 9.01 0.02 1 467 44 74 LEU HA H 4.54 0.02 1 468 44 74 LEU HB2 H 1.34 0.02 2 469 44 74 LEU HB3 H 1.6 0.02 2 470 44 74 LEU HG H 1.41 0.02 1 471 44 74 LEU HD1 H 0.65 0.02 1 472 44 74 LEU HD2 H 0.66 0.02 1 473 44 74 LEU C C 175.7 0.2 1 474 44 74 LEU CA C 53.6 0.2 1 475 44 74 LEU CB C 42.6 0.2 1 476 44 74 LEU CG C 27 0.2 1 477 44 74 LEU CD1 C 25.5 0.02 1 478 44 74 LEU CD2 C 23.5 0.02 1 479 44 74 LEU N N 130.5 0.2 1 480 45 75 LYS H H 8.48 0.02 1 481 45 75 LYS HA H 4.88 0.02 1 482 45 75 LYS HB2 H 1.7 0.02 2 483 45 75 LYS HB3 H 1.82 0.02 2 484 45 75 LYS HG2 H 1.3 0.02 2 485 45 75 LYS HG3 H 1.38 0.02 2 486 45 75 LYS HD2 H 1.68 0.02 1 487 45 75 LYS HD3 H 1.68 0.02 1 488 45 75 LYS HE2 H 2.94 0.02 1 489 45 75 LYS HE3 H 2.94 0.02 1 490 45 75 LYS C C 175.7 0.2 1 491 45 75 LYS CA C 55.8 0.2 1 492 45 75 LYS CB C 33.8 0.2 1 493 45 75 LYS CG C 25.3 0.2 1 494 45 75 LYS CD C 29.5 0.2 1 495 45 75 LYS CE C 41.9 0.2 1 496 45 75 LYS N N 124.1 0.2 1 497 46 76 ALA H H 8.25 0.02 1 498 46 76 ALA HA H 4.56 0.02 1 499 46 76 ALA HB H 1.36 0.02 1 500 46 76 ALA CA C 52.1 0.2 1 501 46 76 ALA CB C 20.9 0.2 1 502 46 76 ALA N N 126.6 0.2 1 503 47 77 CYS HA H 4.14 0.02 1 504 47 77 CYS HB2 H 2.93 0.02 2 505 47 77 CYS HB3 H 3.1 0.02 2 506 47 77 CYS CA C 59.9 0.2 1 507 47 77 CYS CB C 25.9 0.2 1 508 48 78 GLY HA2 H 3.72 0.02 2 509 48 78 GLY HA3 H 4.11 0.02 2 510 48 78 GLY C C 173.3 0.2 1 511 48 78 GLY CA C 45.6 0.2 1 512 49 79 ALA H H 7.83 0.02 1 513 49 79 ALA HA H 4.66 0.02 1 514 49 79 ALA HB H 1.41 0.02 1 515 49 79 ALA C C 176.2 0.2 1 516 49 79 ALA CA C 51.3 0.2 1 517 49 79 ALA CB C 21.4 0.2 1 518 49 79 ALA N N 124.1 0.2 1 519 50 80 VAL H H 8.09 0.02 1 520 50 80 VAL HA H 4.63 0.02 1 521 50 80 VAL HB H 1.83 0.02 1 522 50 80 VAL HG1 H 0.57 0.02 1 523 50 80 VAL HG2 H 0.76 0.02 1 524 50 80 VAL C C 174.3 0.2 1 525 50 80 VAL CA C 61.5 0.2 1 526 50 80 VAL CB C 34.2 0.2 1 527 50 80 VAL CG1 C 21.3 0.02 1 528 50 80 VAL CG2 C 21.1 0.02 1 529 50 80 VAL N N 119.8 0.2 1 530 51 81 ASP H H 8.55 0.02 1 531 51 81 ASP HA H 5.08 0.02 1 532 51 81 ASP HB2 H 2.39 0.02 2 533 51 81 ASP HB3 H 2.52 0.02 2 534 51 81 ASP C C 173.6 0.2 1 535 51 81 ASP CA C 52.9 0.2 1 536 51 81 ASP CB C 45.5 0.2 1 537 51 81 ASP N N 125.5 0.2 1 538 52 82 TYR H H 8.97 0.02 1 539 52 82 TYR HA H 5.14 0.02 1 540 52 82 TYR HB2 H 2.76 0.02 2 541 52 82 TYR HB3 H 3.07 0.02 2 542 52 82 TYR HD1 H 6.97 0.02 1 543 52 82 TYR HD2 H 6.97 0.02 1 544 52 82 TYR HE1 H 6.75 0.02 1 545 52 82 TYR HE2 H 6.75 0.02 1 546 52 82 TYR C C 174.6 0.2 1 547 52 82 TYR CA C 57.4 0.2 1 548 52 82 TYR CB C 41.2 0.2 1 549 52 82 TYR CD1 C 133.3 0.02 1 550 52 82 TYR CD2 C 133.3 0.02 1 551 52 82 TYR CE1 C 117.6 0.02 1 552 52 82 TYR CE2 C 117.6 0.02 1 553 52 82 TYR N N 118.7 0.2 1 554 53 83 PHE H H 9.21 0.02 1 555 53 83 PHE HA H 5.08 0.02 1 556 53 83 PHE HB2 H 2.69 0.02 2 557 53 83 PHE HB3 H 2.98 0.02 2 558 53 83 PHE HD1 H 6.98 0.02 1 559 53 83 PHE HD2 H 6.98 0.02 1 560 53 83 PHE HE1 H 7.28 0.02 1 561 53 83 PHE HE2 H 7.28 0.02 1 562 53 83 PHE HZ H 7.29 0.02 1 563 53 83 PHE C C 173.2 0.2 1 564 53 83 PHE CA C 56.6 0.2 1 565 53 83 PHE CB C 44.4 0.2 1 566 53 83 PHE CD1 C 131.5 0.02 1 567 53 83 PHE CD2 C 131.5 0.02 1 568 53 83 PHE CE1 C 131.6 0.02 1 569 53 83 PHE CE2 C 131.6 0.02 1 570 53 83 PHE CZ C 130 0.2 1 571 53 83 PHE N N 123.3 0.2 1 572 54 84 CYS H H 9.13 0.02 1 573 54 84 CYS HA H 4.82 0.02 1 574 54 84 CYS HB2 H 2.78 0.02 2 575 54 84 CYS HB3 H 2.82 0.02 2 576 54 84 CYS C C 175.9 0.2 1 577 54 84 CYS CA C 58.3 0.2 1 578 54 84 CYS CB C 29.7 0.2 1 579 54 84 CYS N N 131 0.2 1 580 55 85 GLN H H 9.5 0.02 1 581 55 85 GLN HA H 4.2 0.02 1 582 55 85 GLN HB2 H 1.89 0.02 2 583 55 85 GLN HB3 H 2.03 0.02 2 584 55 85 GLN HG2 H 2.04 0.02 2 585 55 85 GLN HG3 H 2.29 0.02 2 586 55 85 GLN HE21 H 7.45 0.02 2 587 55 85 GLN HE22 H 6.87 0.02 2 588 55 85 GLN C C 174.7 0.2 1 589 55 85 GLN CA C 56.7 0.2 1 590 55 85 GLN CB C 29 0.2 1 591 55 85 GLN CG C 33.8 0.2 1 592 55 85 GLN CD C 180.1 0.2 1 593 55 85 GLN N N 129 0.2 1 594 55 85 GLN NE2 N 112.1 0.2 1 595 56 86 HIS H H 8.88 0.02 1 596 56 86 HIS HA H 4.6 0.02 1 597 56 86 HIS HB2 H 3.09 0.02 2 598 56 86 HIS HB3 H 3.32 0.02 2 599 56 86 HIS HD2 H 7.26 0.02 1 600 56 86 HIS C C 175 0.2 1 601 56 86 HIS CA C 55.3 0.2 1 602 56 86 HIS CB C 30.3 0.2 1 603 56 86 HIS CD2 C 121.2 0.2 1 604 56 86 HIS N N 122.5 0.2 1 605 57 87 GLY H H 7.29 0.02 1 606 57 87 GLY HA2 H 3.48 0.02 2 607 57 87 GLY HA3 H 4.17 0.02 2 608 57 87 GLY C C 175.8 0.2 1 609 57 87 GLY CA C 45.1 0.2 1 610 57 87 GLY N N 105.8 0.2 1 611 58 88 HIS H H 7.49 0.02 1 612 58 88 HIS HA H 4.68 0.02 1 613 58 88 HIS HB2 H 3.09 0.02 2 614 58 88 HIS HB3 H 3.42 0.02 2 615 58 88 HIS HD2 H 7.18 0.02 1 616 58 88 HIS HE1 H 7.66 0.02 1 617 58 88 HIS C C 174.2 0.2 1 618 58 88 HIS CA C 59.9 0.2 1 619 58 88 HIS CB C 30.1 0.2 1 620 58 88 HIS CD2 C 118 0.2 1 621 58 88 HIS CE1 C 137.6 0.2 1 622 58 88 HIS N N 116.4 0.2 1 623 59 89 GLY H H 7.61 0.02 1 624 59 89 GLY HA2 H 3 0.02 2 625 59 89 GLY HA3 H 3.77 0.02 2 626 59 89 GLY C C 173.1 0.2 1 627 59 89 GLY CA C 45.7 0.2 1 628 59 89 GLY N N 108 0.2 1 629 60 90 LEU H H 8.43 0.02 1 630 60 90 LEU HA H 4.72 0.02 1 631 60 90 LEU HB2 H 1.69 0.02 2 632 60 90 LEU HB3 H 1.73 0.02 2 633 60 90 LEU HG H 1.72 0.02 1 634 60 90 LEU HD1 H 1.01 0.02 1 635 60 90 LEU HD2 H 0.99 0.02 1 636 60 90 LEU C C 176.9 0.2 1 637 60 90 LEU CA C 55.9 0.2 1 638 60 90 LEU CB C 42.4 0.2 1 639 60 90 LEU CG C 27.4 0.2 1 640 60 90 LEU CD1 C 25 0.02 1 641 60 90 LEU CD2 C 24.7 0.02 1 642 60 90 LEU N N 124.4 0.2 1 643 61 91 ILE H H 8.75 0.02 1 644 61 91 ILE HA H 4.3 0.02 1 645 61 91 ILE HB H 1.85 0.02 1 646 61 91 ILE HG12 H 1.25 0.02 2 647 61 91 ILE HG13 H 1.84 0.02 2 648 61 91 ILE HG2 H 0.78 0.02 1 649 61 91 ILE HD1 H 0.64 0.02 1 650 61 91 ILE C C 175.7 0.2 1 651 61 91 ILE CA C 57.3 0.2 1 652 61 91 ILE CB C 37.9 0.2 1 653 61 91 ILE CG1 C 27.2 0.2 1 654 61 91 ILE CG2 C 18.2 0.2 1 655 61 91 ILE CD1 C 9.8 0.2 1 656 61 91 ILE N N 128.4 0.2 1 657 62 92 SER H H 8.46 0.02 1 658 62 92 SER HA H 4.45 0.02 1 659 62 92 SER HB2 H 3.84 0.02 2 660 62 92 SER HB3 H 4.1 0.02 2 661 62 92 SER C C 176.5 0.2 1 662 62 92 SER CA C 58.6 0.2 1 663 62 92 SER CB C 63.7 0.2 1 664 62 92 SER N N 121.7 0.2 1 665 63 93 LYS H H 9.04 0.02 1 666 63 93 LYS HA H 3.88 0.02 1 667 63 93 LYS HB2 H 2.06 0.02 2 668 63 93 LYS HB3 H 2.21 0.02 2 669 63 93 LYS HG2 H 1.7 0.02 1 670 63 93 LYS HG3 H 1.7 0.02 1 671 63 93 LYS HD2 H 1.96 0.02 1 672 63 93 LYS HD3 H 1.96 0.02 1 673 63 93 LYS HE2 H 3.15 0.02 2 674 63 93 LYS HE3 H 3.2 0.02 2 675 63 93 LYS C C 178.1 0.2 1 676 63 93 LYS CA C 60.4 0.2 1 677 63 93 LYS CB C 32.3 0.2 1 678 63 93 LYS CG C 25.5 0.2 1 679 63 93 LYS CD C 29.5 0.2 1 680 63 93 LYS CE C 42.3 0.2 1 681 63 93 LYS N N 126.7 0.2 1 682 64 94 LYS H H 8.04 0.02 1 683 64 94 LYS HA H 4.22 0.02 1 684 64 94 LYS HB2 H 1.84 0.02 2 685 64 94 LYS HB3 H 1.9 0.02 2 686 64 94 LYS HG2 H 1.5 0.02 1 687 64 94 LYS HG3 H 1.5 0.02 1 688 64 94 LYS HD2 H 1.74 0.02 1 689 64 94 LYS HD3 H 1.74 0.02 1 690 64 94 LYS HE2 H 3.04 0.02 1 691 64 94 LYS HE3 H 3.04 0.02 1 692 64 94 LYS C C 176.9 0.2 1 693 64 94 LYS CA C 57.9 0.2 1 694 64 94 LYS CB C 32.4 0.2 1 695 64 94 LYS CG C 25.1 0.2 1 696 64 94 LYS CD C 29.1 0.2 1 697 64 94 LYS CE C 42 0.2 1 698 64 94 LYS N N 114.8 0.2 1 699 65 95 ARG H H 7.99 0.02 1 700 65 95 ARG HA H 4.35 0.02 1 701 65 95 ARG HB2 H 1.69 0.02 2 702 65 95 ARG HB3 H 1.94 0.02 2 703 65 95 ARG HG2 H 1.53 0.02 2 704 65 95 ARG HG3 H 1.63 0.02 2 705 65 95 ARG HD2 H 3.2 0.02 2 706 65 95 ARG HD3 H 3.35 0.02 2 707 65 95 ARG C C 176.1 0.2 1 708 65 95 ARG CA C 56 0.2 1 709 65 95 ARG CB C 32.4 0.2 1 710 65 95 ARG CG C 28.7 0.2 1 711 65 95 ARG CD C 43.5 0.2 1 712 65 95 ARG N N 116.5 0.2 1 713 66 96 VAL H H 6.82 0.02 1 714 66 96 VAL HA H 2.85 0.02 1 715 66 96 VAL HB H 1.33 0.02 1 716 66 96 VAL HG1 H -0.55 0.02 1 717 66 96 VAL HG2 H 0.21 0.02 1 718 66 96 VAL C C 174.4 0.2 1 719 66 96 VAL CA C 65.2 0.2 1 720 66 96 VAL CB C 32.3 0.2 1 721 66 96 VAL CG1 C 21.1 0.02 1 722 66 96 VAL CG2 C 23.1 0.02 1 723 66 96 VAL N N 120 0.2 1 724 67 97 GLU H H 7.29 0.02 1 725 67 97 GLU HA H 4.38 0.02 1 726 67 97 GLU HB2 H 1.62 0.02 2 727 67 97 GLU HB3 H 1.84 0.02 2 728 67 97 GLU HG2 H 1.99 0.02 2 729 67 97 GLU HG3 H 2.09 0.02 2 730 67 97 GLU C C 173.8 0.2 1 731 67 97 GLU CA C 54.5 0.2 1 732 67 97 GLU CB C 30.7 0.2 1 733 67 97 GLU CG C 35.9 0.2 1 734 67 97 GLU N N 126.2 0.2 1 735 68 98 PHE H H 8.35 0.02 1 736 68 98 PHE HA H 5.4 0.02 1 737 68 98 PHE HB2 H 2.71 0.02 2 738 68 98 PHE HB3 H 2.87 0.02 2 739 68 98 PHE HD1 H 6.98 0.02 1 740 68 98 PHE HD2 H 6.98 0.02 1 741 68 98 PHE HE1 H 7.2 0.02 1 742 68 98 PHE HE2 H 7.2 0.02 1 743 68 98 PHE HZ H 6.95 0.02 1 744 68 98 PHE C C 176.2 0.2 1 745 68 98 PHE CA C 57.8 0.2 1 746 68 98 PHE CB C 41.1 0.2 1 747 68 98 PHE CD1 C 132.1 0.02 1 748 68 98 PHE CD2 C 132.1 0.02 1 749 68 98 PHE CE1 C 131.5 0.02 1 750 68 98 PHE CE2 C 131.5 0.02 1 751 68 98 PHE CZ C 129.1 0.2 1 752 68 98 PHE N N 124.5 0.2 1 753 69 99 VAL H H 8.8 0.02 1 754 69 99 VAL HA H 4.72 0.02 1 755 69 99 VAL HB H 2.25 0.02 1 756 69 99 VAL HG1 H 0.85 0.02 1 757 69 99 VAL HG2 H 0.8 0.02 1 758 69 99 VAL C C 175.1 0.2 1 759 69 99 VAL CA C 58.9 0.2 1 760 69 99 VAL CB C 35.7 0.2 1 761 69 99 VAL CG1 C 21.7 0.02 1 762 69 99 VAL CG2 C 19 0.02 1 763 69 99 VAL N N 115.6 0.2 1 764 70 100 LEU H H 8.51 0.02 1 765 70 100 LEU HA H 4.46 0.02 1 766 70 100 LEU HB2 H 1.66 0.02 1 767 70 100 LEU HB3 H 1.66 0.02 1 768 70 100 LEU HG H 1.74 0.02 1 769 70 100 LEU HD1 H 0.96 0.02 1 770 70 100 LEU HD2 H 0.83 0.02 1 771 70 100 LEU C C 176.5 0.2 1 772 70 100 LEU CA C 55.8 0.2 1 773 70 100 LEU CB C 41.8 0.2 1 774 70 100 LEU CG C 27.2 0.2 1 775 70 100 LEU CD1 C 25.7 0.02 1 776 70 100 LEU CD2 C 23.5 0.02 1 777 70 100 LEU N N 122.1 0.2 1 778 71 101 ALA H H 7.99 0.02 1 779 71 101 ALA HA H 4.07 0.02 1 780 71 101 ALA HB H 1.3 0.02 1 781 71 101 ALA CA C 53.8 0.2 1 782 71 101 ALA CB C 20.5 0.2 1 783 71 101 ALA N N 129.7 0.2 1 stop_ save_ save_spectral_peak_list_1 _Saveframe_category spectral_peak_list _Details . _Experiment_label '3D 1H-15N NOESY' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H H 2 H H 3 N HN stop_ _Sample_label $sample_1 _Sample_conditions_label $sample_conditions_1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_spectral_peak_list_1 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode spectral_peak_list_1 >> _Spectral_peak_list.Entry_ID 15100 >> _Spectral_peak_list.ID 1 >> _Spectral_peak_list.Sample_ID 1 >> _Spectral_peak_list.Sample_label $sample_1 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 >> _Spectral_peak_list.Experiment_ID 1 >> _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _Spectral_peak_list.Details . >> _Spectral_peak_list.Text_data_format text >> _Spectral_peak_list.Text_data >>; >>YfgJ_n15_noesy.list >> w1 w2 w3 Data Height >> >> 125.088 1.051 9.177 1583689 >> 119.981 1.604 8.544 1785142 >> 124.101 4.765 7.831 17168572 >> 124.278 2.928 7.841 505915 >> 126.591 4.786 8.230 17716636 >> 124.081 4.771 8.483 12963020 >> 126.638 2.464 8.571 1603256 >> 116.718 7.977 7.648 3121958 >> 121.642 2.749 8.775 1358839 >> 122.520 9.199 8.718 430472 >> 122.512 9.092 8.712 453929 >> 122.803 5.070 8.462 790055 >> 122.742 7.761 8.449 798459 >> 125.485 3.859 9.314 925616 >> 115.632 6.931 8.804 439544 >> 115.610 8.463 8.787 437205 >> 116.575 4.769 7.991 1766573 >> 114.800 4.770 8.040 10833072 >> 126.479 1.588 9.042 375364 >> 126.644 4.770 9.043 8841094 >> 121.695 4.771 8.454 19814514 >> 121.754 8.795 8.456 761201 >> 124.737 4.916 8.919 2629378 >> 127.733 5.097 8.937 3008984 >> 105.775 4.771 7.294 13303270 >> 122.523 4.773 8.876 4272255 >> 122.413 8.476 8.876 599824 >> 122.523 9.195 8.886 578061 >> 130.739 1.766 9.159 320771 >> 131.048 4.769 9.132 2477152 >> 118.666 3.018 8.978 3622368 >> 119.880 7.291 8.105 640585 >> 119.787 0.959 8.080 344732 >> 126.819 9.190 8.322 684424 >> 120.809 4.767 8.211 4076082 >> 120.962 8.784 9.284 455419 >> 109.919 2.131 7.321 786938 >> 110.053 4.771 7.321 3659258 >> 110.062 4.770 6.593 3528144 >> 110.097 7.660 7.340 380907 >> 110.087 7.651 6.614 452401 >> 112.373 4.769 7.232 3845056 >> 112.373 4.767 6.478 2941897 >> 112.851 4.772 7.163 2459523 >> 112.885 4.769 6.688 2780616 >> 113.643 4.771 7.706 5981124 >> 113.646 4.769 6.900 4768729 >> 112.338 4.772 7.739 2712079 >> 112.099 2.574 6.861 496522 >> 112.078 4.772 7.454 7904056 >> 125.490 4.832 8.549 1049717 >> 108.038 4.171 7.609 407649 >> 128.438 3.003 8.747 917103 >> 126.832 1.660 8.326 2168312 >> 119.968 5.074 8.541 4904884 >> 122.759 2.946 8.464 485782 >> 123.766 1.874 8.409 1739580 >> 123.781 2.075 8.412 1722103 >> 122.677 2.077 9.184 2432000 >> 115.966 4.316 7.757 629960 >> 124.424 5.133 8.610 773007 >> 126.073 5.124 8.732 6358670 >> 127.070 2.163 8.635 1766380 >> 124.687 2.887 8.334 1022866 >> 116.236 8.770 8.212 4709896 >> 116.235 4.155 8.211 7936350 >> 106.945 2.913 8.370 397226 >> 126.856 1.052 8.325 5462711 >> 118.689 0.225 8.960 543212 >> 119.866 0.803 6.809 1177678 >> 122.241 2.255 8.374 423426 >> 119.560 2.653 8.422 1960397 >> 119.560 4.814 8.418 3734110 >> 125.564 3.209 9.318 2763296 >> 119.811 2.286 8.764 2294013 >> 123.237 4.172 8.678 369595 >> 126.636 1.138 8.344 1654329 >> 126.636 1.234 8.344 1376919 >> 126.636 0.665 8.341 943171 >> 122.546 4.838 8.726 9316816 >> 118.957 3.273 7.935 298479 >> 130.231 4.561 9.318 4257954 >> 122.253 4.431 8.373 2136388 >> 122.214 2.110 8.361 484865 >> 122.241 4.273 8.359 610588 >> 122.271 1.886 8.370 1773353 >> 123.500 4.266 8.528 8670571 >> 123.649 2.219 8.526 602196 >> 123.488 1.890 8.528 2411841 >> 123.489 8.541 8.528 39590880 >> 123.529 4.588 8.528 1231162 >> 123.478 1.283 8.527 1319082 >> 123.491 1.556 8.528 4547098 >> 123.554 0.826 8.523 1226209 >> 119.578 4.587 8.420 9689277 >> 119.571 1.296 8.423 1960437 >> 119.608 1.573 8.422 1400638 >> 119.593 0.837 8.420 1883310 >> 119.581 8.431 8.420 45999092 >> 119.583 2.773 8.421 3684145 >> 125.568 4.838 9.317 3387223 >> 125.580 2.649 9.321 906067 >> 125.569 9.334 9.321 17498778 >> 125.590 4.316 9.323 1282486 >> 125.556 3.110 9.319 2544999 >> 125.623 8.753 9.326 538812 >> 125.507 4.167 9.319 638384 >> 125.517 2.368 9.316 432960 >> 125.668 8.364 9.324 707257 >> 125.654 0.716 9.323 863549 >> 125.511 1.550 9.313 1053224 >> 119.764 4.332 9.279 661158 >> 119.867 3.243 9.281 640128 >> 119.944 3.925 9.261 394886 >> 119.779 4.126 9.277 1930648 >> 119.802 9.287 9.276 53076764 >> 119.808 8.778 9.275 5921678 >> 119.838 8.221 9.273 1056326 >> 119.805 4.485 9.276 3010424 >> 119.811 2.170 9.275 5691259 >> 119.844 2.330 9.275 4084025 >> 112.344 7.752 7.739 79987744 >> 112.352 7.751 6.843 22674852 >> 112.348 6.855 7.738 33792252 >> 112.353 2.311 7.742 1158428 >> 119.830 4.154 8.765 635110 >> 119.823 9.285 8.765 4895498 >> 119.809 4.470 8.759 960294 >> 119.816 2.201 8.765 2543990 >> 119.836 8.775 8.766 25838724 >> 119.814 5.025 8.771 1430730 >> 119.850 2.545 8.768 1070897 >> 119.827 8.224 8.767 3507242 >> 119.821 3.207 8.764 2055038 >> 116.223 3.201 8.212 3304850 >> 116.228 9.299 8.211 1528404 >> 116.236 8.770 8.212 4709896 >> 116.198 5.011 8.204 479385 >> 116.401 2.541 8.227 432279 >> 116.231 8.223 8.212 33204932 >> 116.235 4.155 8.211 7936350 >> 116.252 2.273 8.212 2480420 >> 112.546 4.436 7.237 378810 >> 112.347 4.435 6.470 462836 >> 112.410 7.243 7.233 46389868 >> 112.412 7.245 6.476 22528352 >> 112.407 6.487 7.231 25411954 >> 112.416 6.486 6.477 56358368 >> 112.360 2.246 7.236 1523581 >> 112.319 2.251 6.473 581840 >> 123.198 9.295 8.667 437909 >> 123.336 3.182 8.676 921094 >> 123.206 8.225 8.677 516360 >> 123.260 8.681 8.674 7607027 >> 123.150 4.497 8.680 530627 >> 123.232 3.348 8.674 1244770 >> 123.434 4.529 8.175 3189065 >> 123.590 3.389 8.175 631006 >> 123.476 8.184 8.175 13520713 >> 123.489 3.836 8.171 1014759 >> 123.464 1.829 8.175 2650376 >> 123.471 0.850 8.177 2288022 >> 126.619 4.847 8.342 1147627 >> 126.844 4.160 8.326 1728683 >> 126.560 3.851 8.344 7175752 >> 126.560 0.843 8.342 2522415 >> 126.816 8.336 8.327 54994448 >> 126.637 4.472 8.341 1425024 >> 126.574 1.510 8.342 4753808 >> 126.846 4.678 8.324 11124516 >> 121.823 1.596 8.660 660015 >> 121.731 0.839 8.659 368821 >> 121.816 4.471 8.663 6624521 >> 121.836 1.176 8.660 1914853 >> 121.802 1.495 8.665 896124 >> 121.844 0.758 8.662 1344337 >> 121.825 8.679 8.664 33070640 >> 121.823 2.683 8.664 4200246 >> 121.807 4.788 8.665 2844289 >> 122.573 2.688 8.726 1171648 >> 122.568 4.782 8.725 11150649 >> 122.555 1.797 8.723 1872935 >> 122.647 2.187 8.726 763018 >> 122.672 4.630 8.731 932458 >> 111.218 0.783 7.520 372690 >> 111.174 0.738 6.658 476676 >> 111.264 4.773 7.540 1395965 >> 111.260 4.758 6.661 979562 >> 111.327 1.845 6.648 301872 >> 111.222 7.555 7.540 25152506 >> 111.272 7.552 6.662 12481044 >> 111.259 6.674 7.537 13491437 >> 111.239 6.673 6.662 21857304 >> 111.218 2.183 7.540 1631148 >> 111.342 2.179 6.661 404465 >> 111.197 1.558 7.540 500772 >> 111.379 1.603 6.665 474008 >> 122.705 4.765 8.463 3949632 >> 122.728 1.857 8.468 927409 >> 122.729 8.474 8.462 31815366 >> 122.754 4.611 8.462 6783815 >> 122.751 2.565 8.463 2489118 >> 113.630 2.713 7.709 603534 >> 113.660 2.982 7.714 402799 >> 113.630 7.715 7.703 10721695 >> 113.656 7.715 6.899 6851527 >> 113.653 6.908 7.704 8588361 >> 113.631 6.908 6.900 16304638 >> 119.064 4.774 7.944 487407 >> 118.984 7.943 7.934 10709996 >> 118.953 3.143 7.930 522133 >> 118.936 1.228 7.948 459957 >> 119.085 2.949 7.935 767073 >> 124.706 4.773 8.918 5346838 >> 124.691 5.072 8.916 1121480 >> 124.762 2.976 8.913 1352521 >> 124.727 8.928 8.917 11778012 >> 124.689 1.282 8.920 1666341 >> 119.959 1.287 8.539 1673780 >> 119.927 8.557 8.542 19981532 >> 127.760 0.746 8.931 379018 >> 127.741 1.271 8.936 644250 >> 127.963 8.525 8.954 412551 >> 127.690 8.947 8.937 11854108 >> 127.711 4.697 8.936 505415 >> 127.697 2.709 8.934 1084545 >> 127.663 3.146 8.937 1218689 >> 127.722 1.619 8.929 564889 >> 130.221 9.333 9.318 14868782 >> 130.205 4.116 9.321 1232853 >> 130.224 1.855 9.316 2527376 >> 130.209 1.679 9.314 1763129 >> 130.298 8.719 9.321 1156936 >> 116.884 8.734 8.726 8638966 >> 116.830 4.346 8.718 531501 >> 116.846 3.114 8.724 776785 >> 116.951 3.832 8.725 624312 >> 116.916 9.273 8.729 1050150 >> 121.037 9.287 9.266 1853611 >> 121.043 3.139 9.295 351499 >> 111.592 9.258 7.648 741907 >> 111.567 7.656 7.642 7295467 >> 111.483 3.780 7.634 983747 >> 111.531 4.214 7.644 396325 >> 111.385 3.145 7.633 450220 >> 124.497 4.293 8.614 4108790 >> 124.342 1.974 8.615 629723 >> 124.558 2.313 8.619 927839 >> 124.443 8.624 8.614 19346136 >> 124.476 3.009 8.614 2089498 >> 124.512 7.183 8.608 474554 >> 126.084 1.268 8.727 1401016 >> 126.103 8.944 8.722 915985 >> 126.110 3.006 8.731 1068012 >> 126.032 8.736 8.728 28277480 >> 125.991 4.308 8.729 1471818 >> 126.044 1.661 8.731 2264363 >> 125.990 1.403 8.738 915461 >> 126.098 0.857 8.736 938603 >> 127.069 0.862 8.633 2951922 >> 127.067 8.645 8.634 45579232 >> 127.058 1.963 8.635 5480740 >> 127.068 4.313 8.634 12720728 >> 123.785 4.281 8.409 4997306 >> 123.726 2.244 8.404 1528611 >> 122.631 4.855 9.184 4209181 >> 122.675 1.666 9.183 3821748 >> 122.600 8.788 9.183 1356769 >> 122.617 4.689 9.182 1745314 >> 122.637 0.800 9.181 1145563 >> 122.542 4.428 9.180 761299 >> 122.602 8.378 9.185 545368 >> 122.524 1.299 9.185 528923 >> 127.221 4.611 8.353 4209424 >> 127.452 1.479 8.353 383626 >> 127.183 1.678 8.354 785044 >> 127.183 4.175 8.354 615056 >> 127.183 1.110 8.350 1666197 >> 126.856 1.052 8.325 5462711 >> 124.986 8.338 9.179 618432 >> 125.067 4.200 9.181 8935542 >> 125.069 9.193 9.180 40100432 >> 125.046 4.587 9.181 1483739 >> 125.112 0.813 9.180 1985303 >> 125.103 0.556 9.179 1422396 >> 125.098 1.511 9.178 2807124 >> 125.220 8.030 9.175 353062 >> 125.140 -0.580 9.173 1144293 >> 125.046 7.300 9.183 983481 >> 125.031 5.385 9.182 1271176 >> 125.144 6.987 9.189 377084 >> 125.070 1.847 9.182 2831122 >> 123.586 9.195 8.046 314468 >> 123.404 4.595 8.055 9714350 >> 123.435 0.841 8.055 4763679 >> 123.394 0.567 8.054 2466081 >> 123.417 8.065 8.053 43440636 >> 123.393 4.338 8.047 1549597 >> 123.410 2.828 8.054 4672280 >> 123.405 3.259 8.053 5077688 >> 123.397 7.667 8.056 1444516 >> 123.327 2.083 8.060 412729 >> 123.410 1.658 8.054 2975734 >> 123.433 1.829 8.055 1845581 >> 121.639 3.380 8.799 1299450 >> 121.656 4.287 8.794 3017132 >> 121.656 1.787 8.792 3857270 >> 121.655 8.804 8.791 53662808 >> 121.686 4.501 8.788 3152724 >> 121.655 1.072 8.793 5748994 >> 121.663 1.590 8.793 2656375 >> 121.665 7.766 8.793 6539790 >> 121.666 7.956 8.794 1515512 >> 121.743 0.650 8.791 610233 >> 116.035 2.861 7.754 1269650 >> 116.000 8.803 7.753 5927918 >> 116.007 4.499 7.756 2174436 >> 115.992 1.075 7.753 2472185 >> 116.042 1.600 7.756 1250180 >> 116.005 7.765 7.754 48308572 >> 116.016 4.902 7.755 2043022 >> 116.020 2.938 7.756 1388820 >> 116.005 3.266 7.754 3725197 >> 116.023 7.953 7.754 8249188 >> 118.065 0.809 7.936 972918 >> 118.199 2.845 7.945 1392254 >> 118.165 8.810 7.934 1022972 >> 118.093 7.762 7.935 7501056 >> 118.112 4.896 7.936 1036003 >> 118.074 3.283 7.935 4547160 >> 118.101 7.946 7.936 35011288 >> 118.080 4.475 7.933 10937652 >> 118.191 1.817 7.945 475779 >> 116.693 0.859 7.648 959540 >> 116.726 8.070 7.650 2062254 >> 116.723 2.825 7.646 1878142 >> 116.725 3.270 7.647 4676888 >> 116.700 4.478 7.649 2779354 >> 116.709 7.661 7.649 59958472 >> 116.690 4.814 7.649 2925666 >> 116.712 2.099 7.649 6463936 >> 116.735 1.826 7.648 1914592 >> 116.726 2.241 7.651 4508121 >> 116.790 3.819 7.650 696032 >> 116.684 7.215 7.651 761206 >> 112.756 3.298 6.680 511416 >> 112.758 3.320 7.172 514417 >> 112.870 6.696 6.687 41557072 >> 112.877 6.697 7.160 26488084 >> 112.880 7.168 6.686 23710422 >> 112.867 7.170 7.161 42356924 >> 112.970 1.824 6.683 536177 >> 112.924 1.815 7.163 655035 >> 112.968 2.232 6.688 747766 >> 112.824 2.243 7.161 1685066 >> 124.617 4.655 8.244 10008292 >> 124.702 2.044 8.245 600583 >> 124.677 2.328 8.241 910984 >> 124.637 8.257 8.243 30555684 >> 124.622 1.487 8.243 4786736 >> 124.631 0.901 8.243 1090765 >> 124.607 1.633 8.240 4241027 >> 124.720 1.016 8.246 740066 >> 124.615 0.562 8.244 2917294 >> 122.044 8.268 9.233 495371 >> 121.967 1.527 9.239 3538715 >> 122.021 0.559 9.246 523989 >> 122.024 0.874 9.245 1657967 >> 121.946 9.245 9.235 49341824 >> 121.988 2.198 9.237 3968868 >> 121.965 2.368 9.239 3703358 >> 122.063 8.595 9.226 379607 >> 122.003 2.951 9.236 926422 >> 121.981 4.797 9.235 949901 >> 121.952 4.527 9.235 11702938 >> 110.038 7.331 7.320 44383984 >> 110.059 7.333 6.591 24982746 >> 110.057 6.600 7.320 29055022 >> 110.058 6.602 6.592 48297948 >> 110.035 2.291 7.321 1319459 >> 110.154 2.301 6.589 621483 >> 110.047 2.492 7.322 1470151 >> 110.148 2.511 6.598 587461 >> 110.097 0.642 7.327 517228 >> 126.768 0.852 8.572 963708 >> 126.625 9.240 8.572 724777 >> 126.628 4.528 8.571 15856454 >> 126.657 2.339 8.576 2428462 >> 126.675 8.584 8.574 75987728 >> 126.823 4.287 8.569 5635718 >> 126.688 2.007 8.575 6786100 >> 126.629 1.037 8.573 4984174 >> 126.677 9.019 8.573 621918 >> 126.620 0.673 8.581 2302572 >> 130.453 4.300 9.015 13311802 >> 130.480 1.049 9.017 947696 >> 130.457 9.026 9.015 56585172 >> 130.463 4.537 9.012 2477206 >> 130.447 1.582 9.013 4604878 >> 130.450 2.345 9.012 579090 >> 130.449 2.498 9.024 574393 >> 130.447 5.137 9.009 1397645 >> 130.468 8.569 9.015 2617862 >> 130.461 0.673 9.014 4446073 >> 130.461 1.372 9.014 4850771 >> 124.088 0.656 8.486 1293608 >> 124.081 4.538 8.481 8789530 >> 124.089 8.488 8.478 39916496 >> 124.163 1.704 8.472 4542066 >> 124.066 1.355 8.483 3095854 >> 126.571 1.787 8.230 1034129 >> 126.590 8.241 8.229 36436736 >> 126.590 4.575 8.230 2847524 >> 126.604 1.360 8.229 3843744 >> 126.601 7.834 8.232 1042727 >> 126.622 8.580 8.232 1181788 >> 124.104 8.252 7.831 1442198 >> 124.120 3.731 7.830 1484290 >> 124.081 4.117 7.830 1733736 >> 124.104 4.645 7.829 4839622 >> 124.105 1.402 7.831 6570405 >> 119.766 1.406 8.088 4926090 >> 119.780 8.100 8.089 88407016 >> 119.796 1.816 8.087 4843748 >> 119.788 0.600 8.089 1597210 >> 119.776 0.753 8.087 3347546 >> 119.655 8.538 8.081 813127 >> 119.775 4.654 8.089 15104354 >> 125.520 9.020 8.550 2339423 >> 125.575 1.363 8.551 1417909 >> 125.542 1.598 8.552 1714672 >> 125.673 8.113 8.563 1054679 >> 125.533 4.619 8.549 14072062 >> 125.499 1.797 8.547 1416973 >> 125.615 0.725 8.556 2091830 >> 125.518 8.561 8.552 65925288 >> 125.517 5.058 8.552 2561830 >> 125.520 2.381 8.551 4010392 >> 125.598 0.610 8.561 2267028 >> 118.805 8.556 8.980 460747 >> 118.691 5.063 8.978 8924734 >> 118.730 2.375 8.979 1546320 >> 118.689 2.521 8.980 3643900 >> 118.689 8.984 8.977 54317408 >> 118.687 2.740 8.979 1856043 >> 118.700 6.953 8.980 2249637 >> 118.719 1.727 8.986 756150 >> 118.681 0.977 8.973 1420734 >> 123.313 1.525 9.215 1841290 >> 123.178 0.926 9.213 1004416 >> 123.268 2.376 9.215 947450 >> 123.193 4.302 9.207 1002632 >> 123.225 0.615 9.218 1342589 >> 123.263 5.132 9.210 11257206 >> 123.254 9.228 9.214 47411480 >> 123.259 2.695 9.211 3833049 >> 123.250 2.964 9.210 4548234 >> 123.233 6.960 9.214 933681 >> 123.145 4.533 9.215 629609 >> 131.076 0.891 9.134 1650469 >> 131.038 5.071 9.134 8720110 >> 130.961 6.991 9.128 725335 >> 131.039 9.147 9.134 36441148 >> 131.066 2.794 9.134 5332272 >> 130.993 7.632 9.133 1081804 >> 130.944 8.424 9.130 518810 >> 131.254 4.696 9.143 1697973 >> 131.104 0.636 9.133 811519 >> 131.099 1.830 9.131 1474761 >> 131.254 2.993 9.133 1404606 >> 129.150 4.543 9.495 569980 >> 128.980 0.889 9.495 950444 >> 129.029 7.306 9.485 600839 >> 129.265 9.144 9.507 367522 >> 129.028 4.790 9.497 10739156 >> 129.082 2.787 9.495 817918 >> 129.024 9.508 9.498 24209600 >> 129.039 4.190 9.497 1976558 >> 128.998 1.889 9.499 2354712 >> 129.034 2.275 9.501 1108948 >> 129.004 8.896 9.498 1832708 >> 129.028 2.024 9.498 3166181 >> 112.082 7.466 7.454 45510424 >> 112.094 7.466 6.858 18923146 >> 112.089 6.870 7.453 20020752 >> 112.230 6.863 6.849 80190584 >> 112.049 2.280 7.454 1704676 >> 112.138 2.300 6.858 965409 >> 112.028 2.003 7.458 753838 >> 112.153 2.034 6.861 644202 >> 122.480 2.804 8.873 611646 >> 122.523 9.512 8.879 3608992 >> 122.540 4.191 8.880 2043115 >> 122.556 2.326 8.869 506946 >> 122.524 8.890 8.879 63718560 >> 122.531 4.598 8.878 2781094 >> 122.520 3.077 8.880 4468425 >> 122.522 3.307 8.877 2276826 >> 122.540 7.289 8.879 3808586 >> 122.523 7.502 8.876 1234208 >> 122.518 2.004 8.877 1170752 >> 105.776 8.891 7.294 1419910 >> 105.817 4.571 7.300 986838 >> 105.777 7.304 7.293 8114286 >> 105.795 3.484 7.294 1934751 >> 105.758 4.179 7.296 1564373 >> 105.760 7.499 7.295 1367131 >> 116.372 2.801 7.491 3858466 >> 116.381 8.920 7.481 955914 >> 116.366 7.313 7.493 3523194 >> 116.377 4.178 7.491 1495508 >> 116.367 7.506 7.492 61107328 >> 116.374 4.689 7.491 2844036 >> 116.360 3.075 7.491 4490866 >> 116.399 3.444 7.492 3315642 >> 108.016 9.144 7.614 1371329 >> 108.041 2.805 7.613 6396809 >> 108.047 4.683 7.616 1243723 >> 108.080 3.435 7.619 981851 >> 108.042 7.621 7.613 64820352 >> 108.043 3.006 7.613 10305617 >> 108.043 3.765 7.613 5226893 >> 108.067 8.436 7.608 693444 >> 108.035 7.296 7.611 1457223 >> 124.340 5.075 8.424 777269 >> 124.490 6.963 8.446 615614 >> 124.363 7.272 8.425 810721 >> 124.334 7.623 8.436 812099 >> 124.355 3.002 8.433 4228962 >> 124.346 3.761 8.432 9668348 >> 124.337 8.439 8.433 68415152 >> 124.320 4.712 8.433 3267922 >> 124.438 8.774 8.443 770140 >> 124.382 0.979 8.432 1598621 >> 128.368 0.590 8.745 1138641 >> 128.406 2.784 8.747 666263 >> 128.434 5.076 8.758 1691601 >> 128.336 9.158 8.760 485998 >> 128.403 4.704 8.750 9243803 >> 128.375 0.975 8.750 1417033 >> 128.400 8.757 8.751 31719710 >> 128.419 4.283 8.749 1658946 >> 128.398 1.255 8.756 1012778 >> 128.331 8.475 8.750 627004 >> 128.402 1.829 8.749 6041698 >> 121.649 4.281 8.459 11383032 >> 121.651 1.858 8.451 1493292 >> 121.666 0.779 8.456 3223325 >> 121.679 8.471 8.458 49139672 >> 121.667 4.456 8.457 3225428 >> 121.655 3.834 8.461 4316399 >> 121.653 4.110 8.459 4286600 >> 121.667 8.015 8.460 660169 >> 121.677 3.196 8.466 921218 >> 126.663 4.442 9.044 2403494 >> 126.735 4.113 9.058 492083 >> 126.646 9.051 9.044 3336024 >> 126.648 3.911 9.043 1013321 >> 126.626 2.172 9.042 1614384 >> 126.604 1.692 9.040 833801 >> 126.566 8.029 9.038 347057 >> 114.771 8.042 8.037 5447166 >> 114.773 4.223 8.040 1308344 >> 114.788 1.861 8.038 1891303 >> 114.795 1.473 8.041 1090732 >> 116.569 0.781 7.994 835086 >> 116.508 3.854 7.996 1414117 >> 116.516 4.317 7.994 3076156 >> 116.376 3.230 7.994 537374 >> 116.511 6.821 7.992 6728811 >> 116.572 0.224 7.988 933803 >> 116.536 8.013 7.996 57815960 >> 116.578 1.913 7.997 2900934 >> 116.529 1.664 7.996 5654960 >> 119.866 0.803 6.809 1177678 >> 119.947 3.915 6.816 1038213 >> 120.017 4.210 6.813 873434 >> 119.973 8.011 6.817 6096856 >> 119.993 4.315 6.818 1431087 >> 119.897 1.662 6.807 1372049 >> 120.018 1.916 6.816 1171013 >> 119.985 6.831 6.819 46741132 >> 119.979 2.852 6.816 2076554 >> 119.969 1.350 6.819 5670219 >> 119.883 -0.536 6.811 1000920 >> 119.967 0.223 6.816 4956911 >> 126.334 4.235 7.293 750560 >> 126.203 9.185 7.297 863830 >> 126.230 3.393 7.301 1195253 >> 126.331 0.770 7.309 579139 >> 126.329 6.860 7.304 622983 >> 126.181 2.849 7.294 9760300 >> 126.197 1.366 7.313 741016 >> 126.177 -0.543 7.294 3793350 >> 126.172 0.242 7.287 990585 >> 126.178 7.307 7.294 46695756 >> 126.177 4.371 7.294 2871080 >> 126.182 1.612 7.296 3248920 >> 126.124 2.076 7.292 1102556 >> 126.246 8.361 7.296 389218 >> 126.169 1.832 7.294 3777884 >> 124.555 7.286 8.351 574073 >> 124.524 4.371 8.354 10325334 >> 124.554 1.627 8.355 1076526 >> 124.467 1.844 8.352 853433 >> 124.695 2.024 8.339 588007 >> 124.533 8.367 8.355 53118532 >> 124.551 5.406 8.357 1359126 >> 124.505 2.702 8.354 3795350 >> 124.460 2.864 8.354 1969452 >> 124.536 6.950 8.356 1760822 >> 124.429 0.845 8.364 490484 >> 115.585 9.194 8.799 1880628 >> 115.705 1.668 8.799 911510 >> 115.593 4.204 8.800 830427 >> 115.584 2.066 8.795 758471 >> 115.595 8.384 8.791 515671 >> 115.592 5.386 8.796 7398118 >> 115.602 2.876 8.797 1013143 >> 115.584 8.808 8.797 32272860 >> 115.604 4.686 8.799 1934142 >> 115.600 0.803 8.796 4273947 >> 115.593 2.247 8.799 709664 >> 122.105 4.698 8.512 7011803 >> 122.132 2.240 8.510 5761119 >> 122.150 8.523 8.510 49856976 >> 122.126 4.456 8.508 2306072 >> 122.131 8.005 8.509 616590 >> 122.122 0.820 8.512 3515978 >> 122.122 1.700 8.510 8195886 >> 129.681 0.820 7.993 1642755 >> 129.620 1.955 7.996 468595 >> 129.659 4.847 7.997 1575970 >> 129.700 2.136 7.997 590271 >> 129.720 2.266 7.999 733417 >> 129.556 9.188 7.999 501395 >> 129.570 8.496 7.987 865153 >> 129.653 4.456 7.995 7398849 >> 129.713 1.673 7.999 2708613 >> 129.665 8.009 7.995 59618204 >> 129.634 4.058 7.996 1750724 >> 129.655 1.277 7.994 3569874 >> >>c13_noesy_aliph.list >> w1 w2 w3 Data Height >> >> 45.798 0.694 1.289 836834 >> 38.925 3.340 3.839 306889 >> 45.208 7.479 3.472 117980 >> 33.124 8.840 5.219 542427 >> 32.797 9.181 2.086 105122 >> 50.019 8.276 2.437 88754 >> 52.636 8.740 4.588 94272 >> 49.584 8.111 0.872 144239 >> 42.491 0.866 1.602 905208 >> 42.513 4.374 1.601 392286 >> 42.435 7.294 1.718 85393 >> 36.449 0.222 3.894 687596 >> 36.527 1.355 3.902 124303 >> 36.482 2.205 3.884 436052 >> 36.432 2.052 3.890 282274 >> 36.494 6.959 3.892 81650 >> 36.467 6.783 3.893 138216 >> 33.919 8.542 1.808 138979 >> 48.628 8.996 1.327 109418 >> 48.641 4.277 1.446 131625 >> 54.284 1.637 5.147 182448 >> 43.264 1.318 2.967 412744 >> 43.330 1.622 2.962 229250 >> 43.299 1.634 3.063 366294 >> 43.301 1.292 3.058 399337 >> 32.135 2.283 1.890 5082220 >> 32.186 1.894 2.271 5197202 >> 40.054 1.608 4.676 164775 >> 52.174 3.860 1.885 464068 >> 50.913 0.563 3.784 117537 >> 34.515 2.392 2.119 613620 >> 38.813 3.725 3.826 6846064 >> 53.758 6.916 4.096 118618 >> 45.186 0.566 -0.531 599117 >> 41.762 4.379 1.660 225074 >> 47.586 4.369 0.839 458012 >> 34.617 6.912 4.465 119466 >> 51.249 0.833 1.250 538768 >> 51.193 0.838 1.851 437037 >> 46.360 8.868 1.242 147360 >> 33.148 8.545 5.219 95264 >> 35.055 9.469 4.658 200309 >> 50.513 8.884 5.189 156158 >> 45.892 0.839 1.286 1047787 >> 46.269 7.938 0.859 107405 >> 35.659 0.861 4.329 964529 >> 32.749 2.048 4.390 576351 >> 33.227 1.857 5.147 100246 >> 48.715 1.705 0.980 1885215 >> 45.167 8.530 0.879 114498 >> 46.393 2.204 0.859 119545 >> 53.505 1.019 1.674 268751 >> 48.683 6.970 0.980 502714 >> 47.463 8.581 0.862 142604 >> 43.745 4.471 1.179 133940 >> 43.515 4.504 1.486 112919 >> 43.685 1.490 1.183 1343598 >> 35.642 1.663 4.329 297573 >> 45.136 1.490 1.113 237769 >> 52.703 4.581 4.585 731169 >> 50.865 2.342 3.396 137683 >> 54.206 8.912 3.329 177397 >> 38.011 2.784 1.843 133393 >> 54.748 4.277 1.901 817955 >> 54.804 8.549 1.897 292006 >> 35.094 2.305 4.165 1080165 >> 34.057 8.183 4.539 590050 >> 54.381 8.363 4.480 164289 >> 42.492 1.680 2.690 220064 >> 45.652 3.273 2.981 688086 >> 45.884 5.075 1.290 334969 >> 45.866 8.727 1.290 166818 >> 46.279 0.849 1.240 1475707 >> 45.877 7.637 3.779 743295 >> 53.498 2.940 1.677 2138285 >> 32.684 8.080 4.377 253008 >> 49.470 8.532 1.298 115675 >> 52.946 0.591 5.063 189628 >> 51.677 3.219 1.685 835725 >> 52.428 3.078 0.572 253710 >> 31.429 2.070 4.439 917859 >> 31.426 2.444 4.441 332531 >> 32.414 4.441 2.069 312943 >> 32.208 8.528 4.290 1963095 >> 32.208 8.391 4.290 556752 >> 32.303 2.179 4.289 783308 >> 32.271 1.911 4.287 1615559 >> 32.315 0.865 4.278 333206 >> 54.888 8.394 1.898 195857 >> 54.748 4.277 1.901 817955 >> 54.752 2.137 1.906 1362122 >> 54.760 1.896 1.901 25171220 >> 54.804 8.549 1.897 292006 >> 54.791 0.862 1.898 658528 >> 36.594 8.406 2.169 129441 >> 36.625 4.284 2.157 392718 >> 36.627 4.283 2.260 456628 >> 36.623 2.164 2.158 20323584 >> 36.647 2.242 2.258 28285770 >> 36.656 1.924 2.258 1973950 >> 36.703 8.546 2.256 143557 >> 36.658 0.867 2.146 410440 >> 36.644 0.867 2.261 428009 >> 53.769 1.305 4.593 755426 >> 53.739 1.581 4.583 615808 >> 53.741 0.861 4.597 1127226 >> 53.748 8.451 4.595 1016414 >> 44.812 8.493 1.302 169507 >> 44.792 8.529 1.566 228601 >> 44.770 4.584 1.294 138106 >> 44.819 1.330 1.541 4617688 >> 44.767 1.566 1.303 2695211 >> 44.730 1.558 1.558 4031762 >> 44.765 0.782 1.302 920909 >> 44.776 0.759 1.558 745663 >> 49.742 1.294 0.758 428996 >> 49.936 1.565 0.764 1044503 >> 47.407 4.589 0.862 504976 >> 47.377 1.307 0.864 454630 >> 47.463 8.433 0.862 149414 >> 47.412 1.590 0.859 1629096 >> 32.323 8.434 2.661 166887 >> 32.317 8.435 2.801 247082 >> 32.309 2.640 2.649 4505173 >> 32.317 2.658 2.790 2704744 >> 32.283 2.781 2.656 2350530 >> 32.199 2.786 2.791 3784469 >> 32.318 4.163 2.657 247192 >> 32.282 4.167 2.790 236043 >> 33.319 9.338 4.321 236274 >> 33.316 3.127 4.313 419734 >> 33.305 3.940 4.315 852118 >> 33.255 4.145 4.305 942540 >> 33.324 2.129 4.320 206874 >> 33.311 1.554 4.310 158056 >> 33.269 4.284 4.291 12602417 >> 33.284 0.657 4.296 1445266 >> 31.892 9.352 3.123 292800 >> 31.882 9.355 3.215 289606 >> 31.905 4.274 3.108 154711 >> 31.889 4.286 3.212 131360 >> 31.923 4.158 3.122 132757 >> 31.967 4.164 3.217 133576 >> 31.919 8.741 3.223 240617 >> 31.865 8.244 3.114 192923 >> 31.916 8.243 3.220 247799 >> 31.899 0.744 3.113 358455 >> 31.831 0.760 3.216 289941 >> 40.308 2.090 4.465 1389491 >> 40.324 2.398 4.465 2102500 >> 40.338 9.306 4.468 200742 >> 40.353 7.234 4.445 105826 >> 32.285 4.456 2.071 336084 >> 32.322 4.459 2.404 733984 >> 32.331 2.079 2.402 5504809 >> 32.381 3.935 2.399 214132 >> 32.324 4.118 2.072 181604 >> 32.738 0.922 2.053 2021835 >> 32.296 2.380 2.072 5611256 >> 32.281 3.912 2.071 613413 >> 51.491 4.308 3.949 934588 >> 51.522 4.304 4.134 783802 >> 51.548 2.406 3.952 240788 >> 51.501 3.948 3.948 4145888 >> 51.496 3.946 4.135 2453756 >> 51.496 4.131 3.948 2594118 >> 51.500 4.133 4.135 3410167 >> 51.467 2.128 3.948 1087604 >> 51.483 2.129 4.135 1108496 >> 51.519 9.299 4.141 208029 >> 51.529 2.349 4.129 142018 >> 51.523 0.678 3.948 289327 >> 51.474 0.682 4.131 219044 >> 51.504 0.841 3.946 502277 >> 51.518 0.833 4.132 533163 >> 51.334 4.320 2.134 228697 >> 51.378 4.460 2.141 240540 >> 51.330 2.390 2.136 1550585 >> 51.356 3.937 2.136 753380 >> 51.365 4.127 2.137 740640 >> 51.334 2.131 2.137 27183560 >> 51.401 9.293 2.140 165693 >> 51.349 0.845 2.136 597929 >> 33.490 9.289 4.503 496877 >> 33.438 8.789 4.510 160238 >> 33.510 2.285 4.503 1295388 >> 53.837 9.291 2.280 427875 >> 53.842 4.509 2.292 263336 >> 53.810 2.246 2.278 5616408 >> 53.906 8.792 2.190 269457 >> 53.944 8.790 2.289 210110 >> 53.756 9.264 2.199 769988 >> 53.790 2.201 2.192 11288380 >> 33.714 9.287 2.327 217169 >> 33.712 9.293 2.384 222459 >> 33.756 4.509 2.384 94849 >> 33.928 9.259 2.314 221716 >> 33.896 4.527 2.309 184601 >> 35.156 2.280 5.042 250322 >> 35.183 8.791 5.039 318057 >> 35.198 5.037 5.040 4068255 >> 35.187 2.556 5.039 841732 >> 35.198 3.256 5.038 961679 >> 35.165 8.235 5.039 143656 >> 32.775 8.792 2.555 211271 >> 32.726 8.797 3.263 185943 >> 32.768 5.037 2.564 373829 >> 32.761 5.034 3.258 375928 >> 32.753 2.555 3.259 2819868 >> 32.763 3.255 2.560 2993435 >> 32.765 3.263 3.271 5458620 >> 35.081 2.650 4.165 508178 >> 35.039 3.207 4.166 168014 >> 35.110 8.240 4.165 1284995 >> 35.094 2.305 4.165 1080165 >> 35.088 8.708 4.164 142421 >> 50.121 8.245 2.343 121023 >> 50.166 4.162 2.341 411055 >> 50.146 4.166 2.480 355753 >> 50.134 2.326 2.343 5328710 >> 50.131 2.324 2.474 4707037 >> 50.133 2.467 2.343 3625081 >> 50.142 2.470 2.476 5332108 >> 34.490 8.239 2.263 238228 >> 34.506 4.166 2.265 745247 >> 34.493 2.454 2.263 3095521 >> 34.611 7.242 2.249 141034 >> 34.091 8.701 4.539 228582 >> 34.035 3.384 4.539 582008 >> 34.057 8.183 4.539 590050 >> 34.044 0.868 4.539 121743 >> 31.289 8.693 3.402 468415 >> 31.262 4.525 3.405 120911 >> 31.260 3.816 3.394 185280 >> 40.054 4.837 3.912 15119 >> 40.077 1.849 3.866 379486 >> 40.114 8.363 3.865 1198013 >> 40.087 0.859 3.866 972902 >> 32.071 8.180 1.847 423055 >> 32.117 3.873 1.860 306071 >> 32.117 8.372 1.850 102349 >> 32.077 0.868 1.849 2031512 >> 45.165 8.191 0.883 129777 >> 45.124 8.351 0.875 303189 >> 45.138 3.860 0.873 351172 >> 45.065 1.850 0.875 1097525 >> 46.325 6.905 0.854 224380 >> 46.255 8.180 0.854 438477 >> 46.291 3.870 0.854 617989 >> 46.273 1.855 0.854 1372808 >> 46.246 8.366 0.857 238035 >> 54.381 8.363 4.480 164289 >> 54.307 1.168 4.486 506108 >> 54.289 0.755 4.484 875948 >> 54.304 8.697 4.483 865643 >> 54.304 1.522 4.485 474259 >> 43.797 8.763 1.507 85581 >> 43.745 8.339 1.167 165025 >> 43.800 8.351 1.508 304635 >> 43.850 4.471 1.173 135220 >> 43.682 4.492 1.496 121681 >> 43.716 1.182 1.184 2502606 >> 43.715 1.178 1.489 1398333 >> 43.748 0.684 1.175 378896 >> 43.773 0.669 1.500 588255 >> 43.836 1.516 1.138 855893 >> 43.672 8.685 1.165 91902 >> 43.660 1.490 1.483 3331281 >> 50.741 9.356 0.671 161713 >> 50.673 4.312 0.667 332791 >> 50.658 3.928 0.663 199085 >> 50.735 8.360 0.658 301467 >> 50.755 4.490 0.659 124433 >> 50.677 0.661 0.665 30349400 >> 50.692 1.268 0.666 1202584 >> 50.647 4.145 0.667 131773 >> 50.700 1.537 0.664 4124500 >> 47.536 9.348 0.763 135649 >> 47.576 4.323 0.766 374346 >> 47.648 4.494 0.770 401619 >> 47.618 1.195 0.768 450676 >> 47.645 8.713 0.770 136656 >> 47.617 3.145 0.774 631968 >> 47.652 1.544 0.766 1043499 >> 47.619 2.706 0.762 464548 >> 50.750 0.667 1.554 3712184 >> 50.754 8.370 1.555 254745 >> 42.322 8.694 2.706 414872 >> 54.385 1.282 2.026 282447 >> 34.346 1.832 2.101 372038 >> 34.370 7.563 2.106 95874 >> 54.051 2.566 4.635 632873 >> 42.792 8.486 2.571 167374 >> 42.770 4.629 2.564 148073 >> 54.384 2.702 4.323 230929 >> 54.568 2.956 4.328 272643 >> 38.605 4.319 2.943 144703 >> 38.535 2.705 2.947 2751498 >> 38.542 2.946 2.710 2390349 >> 45.704 2.982 3.279 998241 >> 45.652 3.273 2.981 688086 >> 54.734 8.896 5.047 310303 >> 32.447 5.062 2.962 146724 >> 32.423 2.970 3.134 979626 >> 32.439 8.906 3.130 93104 >> 32.642 2.968 2.973 8586482 >> 50.510 1.231 5.186 433042 >> 50.475 8.548 5.208 23674 >> 46.352 0.664 1.248 461529 >> 45.839 2.050 1.284 144182 >> 45.884 5.075 1.290 334969 >> 45.865 8.933 1.292 122924 >> 46.373 5.184 1.246 291589 >> 45.867 1.283 1.290 29947636 >> 45.868 8.552 1.287 210020 >> 45.842 1.640 1.289 400399 >> 46.309 1.590 1.240 346721 >> 45.911 2.280 1.292 215371 >> 46.357 8.697 1.254 183111 >> 46.279 0.849 1.240 1475707 >> 54.183 1.295 5.162 41210 >> 54.213 5.165 5.171 894560 >> 54.183 8.960 5.169 216086 >> 54.177 8.721 5.169 32043 >> 54.177 1.642 5.161 166582 >> 34.286 5.175 1.697 104750 >> 34.230 3.082 1.708 99455 >> 34.464 2.952 1.682 193040 >> 51.765 5.203 1.378 135700 >> 51.732 3.049 1.359 224343 >> 31.561 0.751 2.680 264456 >> 31.673 0.738 3.157 262630 >> 31.546 8.941 2.686 102495 >> 31.598 8.950 3.160 246437 >> 31.603 2.708 3.159 1473388 >> 31.565 3.155 2.685 987958 >> 31.936 8.714 3.136 205471 >> 31.625 7.625 3.156 100829 >> 31.577 1.969 2.685 53682 >> 31.509 2.009 3.152 105550 >> 34.008 9.330 4.129 130824 >> 33.998 1.880 4.129 1139964 >> 34.106 3.232 4.123 143043 >> 34.002 1.696 4.128 647476 >> 54.310 9.338 1.894 172072 >> 54.328 4.124 1.858 517967 >> 54.335 4.129 1.900 516977 >> 54.266 3.226 1.861 285307 >> 54.266 3.226 1.912 291657 >> 43.491 1.860 3.218 1471542 >> 43.493 1.683 3.216 3663659 >> 51.719 4.120 1.697 285514 >> 51.252 3.201 1.683 604725 >> 51.174 4.381 1.710 174743 >> 51.267 1.702 1.713 42705676 >> 35.887 8.716 4.339 577729 >> 36.081 3.122 4.360 546245 >> 35.868 3.854 4.388 2071498 >> 38.987 3.401 3.106 168943 >> 38.914 8.738 3.098 95659 >> 38.932 8.749 3.838 368869 >> 38.885 4.340 3.100 174993 >> 38.832 4.322 3.831 283701 >> 38.932 3.139 3.117 1604015 >> 38.920 3.132 3.840 1651646 >> 38.915 3.838 3.100 604662 >> 38.942 9.280 3.835 197586 >> 35.959 2.937 4.148 531248 >> 35.947 3.110 4.145 1044962 >> 50.028 4.137 2.935 353177 >> 50.049 4.137 3.114 624267 >> 50.041 2.935 2.936 22308388 >> 50.043 2.938 3.114 7789327 >> 50.048 3.108 2.937 6935414 >> 50.042 3.109 3.115 22519388 >> 46.113 7.640 4.218 279746 >> 46.101 3.797 4.223 2168355 >> 46.095 4.219 3.795 2419878 >> 45.877 7.637 3.779 743295 >> 33.470 2.004 4.304 268111 >> 33.687 2.294 4.313 239655 >> 33.445 8.619 4.292 527197 >> 54.387 4.284 1.956 225130 >> 54.379 4.289 2.025 314262 >> 54.380 8.642 1.947 326009 >> 54.367 8.636 2.028 389404 >> 33.185 3.016 5.211 156147 >> 33.111 1.414 5.225 117948 >> 40.808 8.614 3.001 265293 >> 40.821 8.610 3.061 274494 >> 41.096 5.196 3.012 187781 >> 40.918 7.174 2.997 232217 >> 40.854 7.190 3.061 206178 >> 35.807 1.621 4.276 184669 >> 35.640 1.222 4.332 327300 >> 35.736 1.394 4.322 237787 >> 35.792 0.829 4.292 584354 >> 35.678 8.630 4.313 964029 >> 41.602 0.830 1.637 783443 >> 38.195 3.936 0.848 151602 >> 38.063 4.133 0.852 348315 >> 38.103 2.133 0.851 298902 >> 38.040 2.299 0.855 211784 >> 38.079 4.309 0.853 313993 >> 38.045 1.643 0.852 340467 >> 38.037 1.219 0.853 582947 >> 38.042 1.382 0.850 583388 >> 38.043 0.850 0.852 40018564 >> 51.355 4.311 1.233 150853 >> 51.798 4.282 1.380 175170 >> 51.596 0.860 1.216 949884 >> 51.626 0.851 1.395 980835 >> 42.447 4.279 0.840 349349 >> 42.579 1.226 0.873 512436 >> 42.555 1.383 0.866 360016 >> 42.474 8.644 0.853 157990 >> 42.597 1.661 0.872 809534 >> 42.589 0.868 0.871 41841084 >> 32.208 8.620 4.291 503800 >> 54.370 1.281 1.947 214004 >> 36.615 8.636 2.195 162181 >> 36.615 1.294 2.216 216902 >> 35.384 1.841 1.802 803343 >> 35.426 1.844 2.140 257558 >> 35.425 2.080 1.797 328502 >> 35.402 8.401 1.796 -1770 >> 35.400 8.405 2.140 16930 >> 35.464 2.280 1.800 129572 >> 35.384 9.191 1.785 9076 >> 35.252 9.203 2.149 21379 >> 41.310 2.713 1.577 146110 >> 41.378 2.892 1.583 240253 >> 41.242 1.288 1.582 740111 >> 41.286 0.805 1.589 1299900 >> 32.765 1.266 2.287 149102 >> 32.757 8.432 2.289 205296 >> 32.729 0.833 2.295 183677 >> 34.510 9.194 1.676 383612 >> 34.478 1.433 1.678 859423 >> 34.445 8.364 1.652 136485 >> 34.535 0.804 1.674 687252 >> 34.461 1.333 1.677 753966 >> 53.501 0.767 1.676 651738 >> 53.565 0.578 1.677 531004 >> 53.486 4.067 1.680 162984 >> 53.498 2.940 1.677 2138285 >> 42.023 0.749 2.943 682892 >> 41.985 0.574 2.949 437805 >> 42.018 1.320 2.942 1101338 >> 41.990 1.676 2.948 2926042 >> 48.676 1.299 1.302 10826160 >> 48.675 1.423 1.431 13051833 >> 48.685 2.940 1.299 153625 >> 48.694 2.961 1.434 160220 >> 48.702 8.344 1.308 84073 >> 48.525 8.343 1.446 127144 >> 48.636 0.567 1.301 266247 >> 48.595 0.565 1.436 160159 >> 48.566 0.817 1.430 308896 >> 48.632 9.204 1.445 111121 >> 48.653 1.672 1.304 1538428 >> 48.639 1.671 1.438 1996680 >> 50.956 8.358 4.204 214665 >> 50.953 4.203 4.204 5001752 >> 50.961 1.075 4.202 1108645 >> 50.969 9.196 4.203 1559026 >> 50.960 -0.555 4.203 387864 >> 50.950 5.403 4.203 465387 >> 50.964 6.955 4.204 283417 >> 50.979 0.565 4.202 135982 >> 45.068 8.350 1.106 498104 >> 45.068 4.202 1.109 430563 >> 45.084 9.198 1.108 152360 >> 45.171 0.569 1.126 492002 >> 45.080 -0.586 1.107 510310 >> 45.037 7.209 1.069 328778 >> 52.866 9.194 4.606 208873 >> 52.932 4.595 4.606 1352942 >> 52.840 1.869 4.606 387214 >> 52.836 0.825 4.607 751312 >> 52.854 0.565 4.607 1183174 >> 52.830 8.073 4.607 916407 >> 52.904 8.257 4.606 301083 >> 52.870 1.663 4.610 238326 >> 52.794 1.510 4.608 203222 >> 44.136 9.197 1.861 240468 >> 44.127 9.196 0.844 134868 >> 44.154 0.819 1.862 2103542 >> 44.119 0.570 1.861 299688 >> 44.121 0.572 0.836 536884 >> 44.142 1.525 1.863 426326 >> 44.077 8.074 1.862 161803 >> 44.116 8.056 0.839 148583 >> 44.192 4.485 1.868 134068 >> 44.218 4.487 0.843 182884 >> 44.135 1.851 1.857 2837065 >> 44.134 1.858 0.839 2199362 >> 50.181 9.202 0.761 133192 >> 50.040 1.859 0.759 645277 >> 50.062 3.346 0.755 206895 >> 45.960 1.305 0.572 243764 >> 45.926 1.674 0.569 870152 >> 45.892 9.172 0.580 81120 >> 45.903 4.628 0.570 527193 >> 45.947 1.878 0.570 905599 >> 45.937 0.769 0.568 3078908 >> 45.931 0.564 0.568 57307132 >> 45.925 1.518 0.569 1866200 >> 45.907 8.078 0.569 163898 >> 45.930 2.051 0.570 255002 >> 45.904 2.327 0.568 443431 >> 45.973 3.885 0.572 188826 >> 45.932 8.265 0.573 234867 >> 50.669 9.186 1.518 251084 >> 50.697 1.848 1.519 495703 >> 32.684 8.080 4.377 253008 >> 32.594 2.834 4.375 558440 >> 32.549 3.301 4.378 414612 >> 32.566 3.394 4.375 718479 >> 32.558 0.577 4.373 744552 >> 32.585 0.886 4.374 732227 >> 32.647 1.264 4.368 132475 >> 32.594 1.844 4.386 260069 >> 31.536 8.073 2.839 541478 >> 31.510 8.076 3.275 593507 >> 31.585 4.361 2.834 250248 >> 31.509 3.267 2.837 2074542 >> 31.418 7.948 3.274 222872 >> 31.512 7.684 2.829 220735 >> 31.510 7.682 3.275 342694 >> 31.530 0.881 2.839 673817 >> 31.489 0.880 3.267 430583 >> 31.488 2.832 3.270 2120721 >> 39.782 4.233 4.240 9805951 >> 39.768 2.343 4.239 1175539 >> 39.803 3.387 4.243 129395 >> 39.746 8.819 4.250 104880 >> 39.779 1.610 4.237 364675 >> 39.714 2.060 4.237 271341 >> 39.802 1.865 4.240 1007956 >> 32.084 4.248 1.894 502991 >> 31.901 4.241 2.348 518774 >> 31.881 3.386 2.355 183327 >> 32.294 4.375 1.893 269609 >> 31.993 1.883 2.342 3291354 >> 50.949 2.347 3.401 137545 >> 50.928 3.398 4.308 1569746 >> 50.952 4.321 3.398 1500248 >> 50.932 4.308 4.306 1780600 >> 50.927 1.790 4.309 648585 >> 50.930 0.802 3.411 384565 >> 50.907 0.796 4.309 372036 >> 50.981 7.328 3.401 120700 >> 50.981 7.309 4.307 98357 >> 51.046 0.621 3.392 182909 >> 50.950 0.608 4.307 365684 >> 50.912 2.849 3.398 378705 >> 50.932 2.849 4.307 267004 >> 50.935 1.796 3.401 717232 >> 50.766 2.342 1.784 677452 >> 50.818 3.404 1.789 507400 >> 50.779 4.297 1.788 570776 >> 50.819 1.787 1.789 6418824 >> 50.784 8.799 1.789 205176 >> 50.830 0.628 1.789 249199 >> 50.820 0.778 1.787 402861 >> 32.387 8.812 4.530 359459 >> 32.420 1.077 4.526 514092 >> 32.409 1.594 4.531 1024804 >> 32.430 7.768 4.531 152024 >> 40.754 8.814 1.085 578862 >> 40.812 8.807 1.598 250240 >> 40.724 4.523 1.081 310749 >> 40.808 4.527 1.595 323184 >> 40.774 1.080 1.085 4386841 >> 40.770 1.078 1.596 3504049 >> 40.778 1.592 1.083 3075889 >> 40.783 7.767 1.082 263907 >> 40.813 7.773 1.595 205433 >> 34.276 7.763 4.910 298192 >> 34.259 2.950 4.909 724664 >> 34.294 3.294 4.909 821452 >> 32.675 4.924 2.980 159693 >> 32.743 4.885 3.285 166902 >> 32.774 2.957 3.291 2209695 >> 32.766 3.289 2.964 2084706 >> 32.538 7.199 2.970 104290 >> 32.769 7.677 2.959 930612 >> 32.757 7.674 3.291 607041 >> 33.545 1.852 4.483 325449 >> 33.609 0.818 4.489 605749 >> 33.603 7.959 4.491 1131816 >> 33.607 3.335 4.488 971435 >> 33.617 7.688 4.487 237401 >> 50.589 0.774 3.350 337746 >> 50.706 0.595 3.358 118115 >> 50.451 7.943 3.351 194085 >> 50.514 4.477 3.348 395882 >> 50.531 6.927 3.346 219248 >> 50.510 3.343 3.345 11459115 >> 50.589 1.868 3.348 71198 >> 52.525 7.668 2.061 355859 >> 52.512 7.675 2.119 282703 >> 52.513 2.090 2.073 2894729 >> 52.528 2.090 2.116 3157699 >> 52.461 1.843 2.071 676589 >> 52.477 1.839 2.112 622988 >> 52.493 2.220 2.068 851283 >> 52.493 2.230 2.112 790225 >> 52.471 3.816 2.072 258737 >> 52.481 3.820 2.112 304987 >> 52.453 7.260 2.070 145333 >> 52.552 7.248 2.118 219539 >> 33.772 3.297 1.832 108967 >> 33.765 3.289 2.253 187214 >> 33.801 7.669 1.839 292346 >> 33.801 7.669 1.839 292346 >> 33.801 7.669 1.839 292346 >> 33.804 7.674 2.253 438670 >> 33.776 2.076 1.838 1745053 >> 33.715 7.211 1.839 244603 >> 33.850 7.191 2.251 203977 >> 33.757 1.834 2.250 4540086 >> 33.768 2.239 1.839 4017828 >> 33.766 3.818 2.247 100180 >> 33.943 1.827 1.829 18884314 >> 39.931 1.674 4.675 193369 >> 39.993 0.864 4.690 120842 >> 39.959 0.567 4.676 1203162 >> 39.833 8.087 4.680 158271 >> 39.964 4.670 4.674 1155916 >> 39.977 2.068 4.675 292077 >> 39.998 1.877 4.675 281638 >> 39.951 8.269 4.674 923051 >> 40.027 1.505 4.675 251783 >> 39.964 2.334 4.675 697423 >> 32.208 0.567 2.069 256446 >> 32.126 0.565 2.338 349451 >> 32.151 4.677 2.080 101897 >> 32.164 4.671 2.347 155028 >> 32.164 2.069 2.341 3785404 >> 32.215 1.900 2.063 3796988 >> 50.985 0.569 3.809 175596 >> 50.950 0.562 3.906 189231 >> 51.009 4.823 3.910 129127 >> 50.981 1.884 3.810 567843 >> 50.955 1.888 3.905 597380 >> 50.968 2.069 3.814 842802 >> 50.927 2.064 3.902 560206 >> 50.929 2.305 3.809 721525 >> 50.967 2.306 3.903 613039 >> 52.125 0.566 1.885 470686 >> 52.115 0.573 2.314 289574 >> 52.120 3.826 2.312 725417 >> 52.145 3.908 2.312 464982 >> 52.127 1.880 1.882 5719816 >> 52.116 1.881 2.311 3907571 >> 52.126 2.310 1.884 3522044 >> 52.141 2.306 2.312 9300244 >> 54.645 8.261 4.538 254275 >> 54.583 4.533 4.540 2998710 >> 54.607 1.522 4.543 797746 >> 54.524 0.586 4.544 166189 >> 54.623 0.881 4.538 972392 >> 54.588 1.664 4.544 412560 >> 54.632 9.256 4.541 1283242 >> 43.476 8.277 1.474 252015 >> 43.488 8.269 1.547 165651 >> 43.500 1.530 1.551 3013080 >> 43.409 0.572 1.485 491665 >> 43.428 0.567 1.551 456196 >> 43.451 0.877 1.483 362887 >> 43.369 0.874 1.552 310558 >> 43.406 9.245 1.484 297660 >> 43.458 9.261 1.545 241122 >> 43.380 2.747 1.541 143591 >> 43.419 6.973 1.480 144463 >> 43.406 6.974 1.566 123773 >> 43.442 2.763 1.471 103906 >> 52.446 1.072 0.571 778246 >> 52.379 4.364 0.570 326358 >> 52.398 1.519 0.570 710900 >> 52.446 0.567 0.571 24831402 >> 52.429 0.877 0.571 1057220 >> 52.439 2.763 0.569 743535 >> 52.522 3.052 0.573 256691 >> 52.447 6.965 0.574 259942 >> 52.418 1.273 0.571 164463 >> 52.422 -0.548 0.570 764820 >> 52.455 0.220 0.570 976816 >> 52.468 9.217 0.576 159909 >> 52.465 1.840 0.574 347756 >> 49.475 4.367 0.891 462650 >> 49.408 3.265 0.887 327073 >> 49.447 4.534 0.888 543886 >> 49.545 1.553 0.889 1081335 >> 49.456 1.661 0.890 1284935 >> 49.444 2.802 0.890 1664517 >> 49.432 1.261 0.888 727909 >> 49.433 1.843 0.888 687908 >> 49.380 9.216 0.889 406729 >> 51.751 8.272 1.667 236472 >> 51.754 4.577 1.655 136356 >> 52.011 0.565 1.663 598842 >> 31.794 9.257 4.545 367448 >> 31.737 2.201 4.540 741584 >> 31.779 2.371 4.543 728302 >> 31.753 8.593 4.540 2346449 >> 31.837 1.052 4.535 234878 >> 53.762 4.528 2.397 194985 >> 53.724 2.377 2.386 6164048 >> 53.714 2.505 2.200 828639 >> 53.714 2.505 2.390 1411233 >> 53.701 0.660 2.202 120312 >> 53.703 0.639 2.382 184574 >> 53.767 2.725 2.385 417714 >> 53.755 2.960 2.205 261150 >> 53.759 2.964 2.384 347338 >> 53.764 9.253 2.386 521877 >> 34.008 9.258 2.511 257372 >> 33.988 4.545 2.505 123588 >> 34.010 7.354 2.513 267477 >> 34.077 8.595 2.306 159846 >> 33.958 8.588 2.517 168545 >> 34.014 0.658 2.309 339748 >> 33.987 0.658 2.509 242165 >> 33.926 1.386 2.297 253441 >> 33.859 6.948 2.291 176855 >> 33.830 7.304 2.298 357913 >> 38.330 8.590 4.316 413887 >> 38.298 2.005 4.308 379506 >> 38.328 0.706 4.313 1068187 >> 38.312 1.039 4.313 938301 >> 38.330 9.036 4.312 2092949 >> 38.094 1.335 4.309 88317 >> 38.311 5.144 4.308 333735 >> 38.292 6.959 4.311 204377 >> 38.281 9.229 4.314 193099 >> 38.334 1.576 4.315 114667 >> 32.175 8.593 2.015 857296 >> 32.161 0.705 2.018 1399359 >> 32.165 1.043 2.016 1315511 >> 45.572 4.312 0.708 845059 >> 45.584 2.009 0.708 1733706 >> 45.587 0.707 0.708 70698768 >> 45.578 1.047 0.706 1953129 >> 45.607 9.039 0.706 500148 >> 45.590 1.367 0.708 384918 >> 45.565 2.940 0.707 231902 >> 45.569 6.963 0.712 191108 >> 45.579 6.756 0.708 357604 >> 45.586 8.591 0.709 261210 >> 44.995 8.349 1.062 752355 >> 45.000 4.231 1.062 813356 >> 44.946 0.584 1.053 1376584 >> 44.887 8.592 1.045 1143461 >> 44.896 4.300 1.046 851512 >> 44.893 2.013 1.046 1858051 >> 44.897 0.707 1.046 3311723 >> 44.878 9.040 1.045 217154 >> 44.917 6.966 1.048 1103066 >> 44.931 6.758 1.049 1073877 >> 45.010 9.208 1.060 249986 >> 44.983 -0.535 1.064 1028118 >> 44.953 0.225 1.050 301846 >> 44.950 1.490 1.075 265417 >> 53.714 9.039 4.551 366848 >> 53.721 1.352 4.551 1089830 >> 53.702 0.659 4.552 1483359 >> 53.675 8.493 4.552 877139 >> 42.508 9.041 1.341 260483 >> 42.576 9.036 1.599 405001 >> 42.585 4.548 1.345 243402 >> 42.546 4.512 1.591 132509 >> 42.627 8.553 1.597 200388 >> 42.538 2.386 1.343 267196 >> 42.609 2.382 1.597 379707 >> 42.599 2.533 1.337 119268 >> 42.627 2.522 1.604 158810 >> 42.576 0.645 1.346 728740 >> 42.532 0.644 1.599 865665 >> 49.477 1.597 0.640 434191 >> 49.482 2.392 0.642 261064 >> 49.410 2.487 0.636 189904 >> 49.488 9.236 0.620 74486 >> 49.537 2.690 0.644 342335 >> 49.511 2.959 0.643 193027 >> 49.477 6.965 0.639 144494 >> 49.490 0.637 0.641 60462360 >> 47.476 7.316 0.659 177908 >> 47.477 8.542 0.676 91259 >> 47.427 4.542 0.661 478425 >> 47.459 2.336 0.659 314803 >> 47.444 1.380 0.663 1304805 >> 50.884 9.039 1.405 388804 >> 31.853 1.322 4.880 484167 >> 31.814 8.248 4.881 317064 >> 31.801 0.575 4.875 99052 >> 31.864 0.763 4.877 152212 >> 31.867 8.574 4.874 304777 >> 31.859 1.687 4.885 410469 >> 31.817 1.814 4.884 390329 >> 33.745 8.494 1.700 267915 >> 33.757 8.500 1.820 98598 >> 33.821 1.349 1.700 704024 >> 33.888 4.909 1.805 87809 >> 33.777 1.345 1.817 738652 >> 53.497 1.404 1.677 2722172 >> 49.437 0.720 1.299 438802 >> 49.470 8.522 1.384 99446 >> 49.395 1.328 1.302 12717725 >> 49.435 1.350 1.379 13465887 >> 49.473 2.934 1.304 239174 >> 49.462 2.938 1.382 296543 >> 49.435 0.750 1.379 373008 >> 49.447 1.686 1.300 1363585 >> 49.441 1.681 1.377 1025703 >> 49.458 1.803 1.302 506878 >> 49.458 1.813 1.377 292907 >> 52.208 8.246 4.568 162060 >> 52.138 1.355 4.566 1563868 >> 44.915 8.257 1.359 233329 >> 44.869 4.564 1.358 529684 >> 45.718 3.726 4.117 6271122 >> 45.718 4.116 3.734 6346502 >> 45.731 7.860 3.725 107714 >> 45.660 7.848 4.128 105795 >> 51.268 4.660 4.661 4016535 >> 51.280 1.417 4.661 1327599 >> 51.264 8.108 4.661 1181949 >> 45.427 7.846 1.418 472567 >> 45.389 4.664 1.420 440253 >> 45.403 8.114 1.420 680642 >> 37.564 1.330 4.626 160101 >> 37.568 8.123 4.620 220705 >> 37.517 1.821 4.624 446665 >> 37.543 0.570 4.624 732949 >> 37.530 0.748 4.627 606605 >> 37.552 8.580 4.625 1673928 >> 34.199 8.117 1.830 354440 >> 34.181 0.570 1.826 1256997 >> 34.171 0.750 1.827 1199720 >> 34.159 8.584 1.825 199261 >> 45.339 9.021 0.570 228683 >> 45.258 8.111 0.580 174434 >> 45.325 4.620 0.571 207999 >> 45.256 1.822 0.573 1408761 >> 45.267 0.568 0.573 87716248 >> 45.321 8.580 0.574 563725 >> 45.362 6.759 0.573 287409 >> 45.159 0.917 0.771 5165745 >> 45.101 1.335 0.764 281726 >> 45.053 8.112 0.760 391643 >> 45.067 4.624 0.759 210948 >> 45.062 1.824 0.760 1553528 >> 45.172 0.582 0.757 5576842 >> 45.066 0.759 0.760 92032224 >> 45.089 8.589 0.762 224489 >> 52.887 8.583 5.069 317394 >> 52.898 5.067 5.070 6068178 >> 52.918 2.392 5.067 643358 >> 52.921 2.525 5.073 894863 >> 52.908 8.991 5.068 1259158 >> 52.910 6.958 5.065 220560 >> 52.929 0.982 5.077 112329 >> 45.585 1.333 2.380 157231 >> 45.530 1.336 2.520 118087 >> 45.593 1.590 2.378 429089 >> 45.569 1.606 2.522 271787 >> 45.540 0.623 2.375 188712 >> 45.516 0.630 2.521 200944 >> 45.535 8.570 2.384 366406 >> 45.528 8.578 2.521 267830 >> 45.545 5.073 2.388 252048 >> 45.529 5.075 2.522 398642 >> 45.544 2.384 2.384 5890420 >> 45.546 2.389 2.524 4378017 >> 45.556 2.521 2.384 3848510 >> 45.553 2.523 2.525 5889240 >> 45.531 8.997 2.380 256184 >> 45.594 8.992 2.526 421816 >> 45.567 0.982 2.379 330335 >> 45.549 0.985 2.524 592978 >> 33.461 1.576 5.147 152099 >> 33.318 0.573 5.148 172677 >> 33.514 1.030 5.150 186204 >> 33.483 5.142 5.148 7082572 >> 33.427 2.756 5.153 674018 >> 33.524 3.028 5.143 642968 >> 33.439 6.965 5.150 509569 >> 33.441 9.235 5.149 1517387 >> 33.608 8.747 5.142 734282 >> 33.401 0.644 5.146 153178 >> 33.457 9.005 5.150 396135 >> 41.259 1.563 2.750 159963 >> 41.231 0.569 2.767 609185 >> 41.232 0.573 3.050 294201 >> 41.170 0.881 2.752 182424 >> 41.288 0.849 3.043 122576 >> 41.235 8.993 3.081 249295 >> 41.216 5.144 2.767 184064 >> 40.849 5.145 3.070 193885 >> 41.218 2.746 2.755 4195936 >> 41.251 2.769 3.037 1683489 >> 41.240 3.044 2.763 1656593 >> 41.317 6.974 3.074 270555 >> 41.328 1.020 3.091 113761 >> 41.193 1.836 2.755 172866 >> 41.164 1.854 3.067 199625 >> 41.198 0.211 2.775 224636 >> 41.199 0.222 3.055 213955 >> 41.192 6.971 2.741 600535 >> 32.593 2.691 5.081 773732 >> 32.550 2.972 5.076 475968 >> 32.572 6.975 5.082 372878 >> 32.577 9.161 5.083 1393664 >> 32.584 0.960 5.085 226677 >> 32.553 1.731 5.079 143253 >> 32.577 8.791 5.081 252621 >> 32.539 1.838 5.076 182156 >> 32.712 0.614 5.101 114655 >> 44.481 2.192 2.689 140424 >> 44.418 2.196 2.968 297212 >> 44.446 2.374 2.691 183409 >> 44.413 2.384 2.969 386532 >> 44.409 2.504 2.966 229944 >> 44.421 9.229 2.693 412444 >> 44.433 9.240 2.968 519916 >> 44.434 5.089 2.688 279298 >> 44.423 5.084 2.964 171585 >> 44.416 2.686 2.688 5182735 >> 44.426 2.686 2.970 3003277 >> 44.413 2.964 2.687 3196888 >> 44.346 2.961 2.965 4597096 >> 44.450 6.974 2.686 562027 >> 44.413 6.973 2.969 599378 >> 44.391 0.984 2.685 227969 >> 44.418 0.648 2.690 504277 >> 44.415 0.649 2.970 400793 >> 53.700 0.878 2.787 425371 >> 53.700 0.888 2.821 504715 >> 53.700 9.164 2.787 312958 >> 53.671 9.159 2.823 370916 >> 53.678 3.086 2.790 450402 >> 53.700 3.084 2.821 323113 >> 53.745 3.397 2.814 191564 >> 53.654 7.625 2.793 338860 >> 53.693 7.615 2.833 266205 >> 53.673 0.633 2.778 210641 >> 53.700 0.624 2.834 118663 >> 32.799 6.973 4.200 168221 >> 32.791 7.291 4.198 708981 >> 32.772 9.516 4.196 283700 >> 32.791 1.888 4.198 831365 >> 32.810 2.292 4.199 435975 >> 32.771 8.901 4.199 151806 >> 32.785 2.030 4.197 1280588 >> 52.809 7.277 2.024 140186 >> 53.023 9.511 1.891 254074 >> 52.951 9.514 2.032 231908 >> 52.948 4.188 1.885 334437 >> 52.960 4.194 2.030 409562 >> 52.988 1.885 1.885 4688759 >> 52.985 1.887 2.029 3460161 >> 53.014 2.292 1.884 484628 >> 52.966 2.289 2.029 863625 >> 52.966 2.033 1.885 5044071 >> 52.993 2.030 2.030 6657832 >> 33.826 6.975 2.052 130485 >> 33.862 7.287 2.043 113068 >> 33.893 9.511 2.038 247951 >> 33.853 9.499 2.292 172916 >> 33.810 4.179 2.047 267571 >> 33.777 4.184 2.291 170314 >> 33.786 2.289 2.042 5144744 >> 31.355 8.901 4.602 356346 >> 31.353 3.318 4.601 1034989 >> 54.306 8.898 3.090 334332 >> 54.351 8.900 3.320 195430 >> 54.297 4.583 3.086 139887 >> 54.274 4.588 3.326 156189 >> 54.342 3.089 3.321 2531278 >> 54.327 3.321 3.088 2564318 >> 54.376 3.314 3.320 3253511 >> 54.324 7.267 3.082 181209 >> 45.129 7.301 3.493 230160 >> 45.203 7.298 4.170 170335 >> 45.168 3.487 4.181 3492012 >> 45.172 4.175 3.490 3597468 >> 45.036 7.496 3.497 109015 >> 45.142 7.514 4.186 223715 >> 35.877 7.525 4.675 243305 >> 35.852 3.069 4.670 307086 >> 35.906 3.415 4.672 694911 >> 35.892 7.179 4.671 465415 >> 35.892 7.618 4.674 128632 >> 54.080 2.805 3.087 578180 >> 54.130 2.809 3.425 464933 >> 54.084 7.516 3.088 280257 >> 54.101 7.522 3.428 229075 >> 54.104 3.087 3.423 2146120 >> 54.086 7.610 3.101 150268 >> 54.085 0.628 3.089 276775 >> 54.103 0.627 3.421 404879 >> 45.755 7.288 3.016 366907 >> 45.762 7.301 3.777 273977 >> 45.793 7.633 3.019 905372 >> 45.760 3.012 3.775 3931852 >> 45.735 3.769 3.017 3585630 >> 45.766 8.451 3.018 752381 >> 45.792 8.451 3.777 1361031 >> 45.830 1.718 3.761 183999 >> 42.326 8.987 1.714 100268 >> 42.440 8.453 1.711 1254859 >> 42.455 0.988 1.714 1865164 >> 42.426 8.787 1.716 232045 >> 42.391 6.991 1.711 115698 >> 42.449 1.710 1.714 29280106 >> 48.815 8.445 0.998 104785 >> 48.933 1.714 1.003 2082073 >> 48.695 2.529 0.982 450526 >> 48.855 9.004 0.990 130708 >> 48.788 5.084 0.989 144291 >> 48.677 2.680 0.977 261780 >> 48.825 8.783 0.985 148498 >> 48.985 6.968 0.997 98005 >> 51.357 6.975 1.713 222627 >> 51.331 8.449 1.718 463676 >> 51.440 0.989 1.716 1106001 >> 33.318 8.779 4.298 248818 >> 33.192 1.840 4.289 512269 >> 33.260 0.777 4.295 1518485 >> 33.279 8.485 4.291 1262228 >> 33.279 8.485 4.291 1262228 >> 33.279 8.485 4.291 1262228 >> 33.192 1.840 4.289 512269 >> 37.848 2.763 1.854 161132 >> 37.886 3.026 1.837 237009 >> 37.950 6.999 1.840 92048 >> 37.824 8.785 1.851 483407 >> 37.808 4.293 1.848 188069 >> 37.867 1.256 1.849 581069 >> 37.860 0.789 1.847 877742 >> 37.813 0.216 1.843 279967 >> 37.869 0.606 1.847 365038 >> 33.785 3.084 0.639 458425 >> 33.776 8.787 0.640 179765 >> 33.764 4.293 0.637 1231869 >> 33.762 0.632 0.638 39651552 >> 33.770 1.250 0.638 1083372 >> 33.767 2.803 0.637 463308 >> 33.765 3.412 0.637 688461 >> 33.759 1.839 0.638 1927088 >> 51.213 8.792 1.254 192955 >> 51.185 8.794 1.852 247862 >> 51.210 0.625 1.254 679912 >> 51.194 0.628 1.851 724922 >> 51.204 1.249 1.851 1879820 >> 51.156 4.297 1.253 161716 >> 51.208 1.843 1.252 2655576 >> 42.162 3.394 0.795 459900 >> 42.146 8.781 0.791 93035 >> 42.144 1.259 0.794 573839 >> 42.141 0.790 0.793 34710408 >> 42.195 8.475 0.796 278586 >> 42.217 8.016 0.806 88516 >> 42.396 3.325 0.796 128701 >> 42.252 6.815 0.786 115052 >> 42.138 2.851 0.793 444008 >> 42.154 0.217 0.792 1356374 >> 42.161 4.298 0.794 1023601 >> 42.158 1.836 0.793 2195532 >> 34.563 8.485 4.447 331514 >> 34.656 3.857 4.454 2525041 >> 34.502 4.109 4.447 879740 >> 34.424 9.070 4.449 324797 >> 39.716 8.484 3.848 551824 >> 39.718 8.477 4.109 484762 >> 39.811 4.447 3.849 1538545 >> 39.812 3.854 4.110 9351735 >> 39.723 4.104 3.845 5063342 >> 39.726 1.522 4.109 182759 >> 39.710 8.028 3.845 176097 >> 39.702 8.035 4.097 105850 >> 39.733 1.650 3.845 480648 >> 39.728 1.664 4.111 208625 >> 36.496 1.705 3.895 334667 >> 32.289 6.756 2.188 130736 >> 32.314 3.915 2.197 453601 >> 32.315 2.197 2.199 7498914 >> 53.589 6.758 1.963 202980 >> 53.556 3.186 1.964 906609 >> 53.557 1.958 1.963 43366848 >> 53.544 1.721 1.963 2949826 >> 53.579 1.455 1.966 192286 >> 42.424 1.959 3.184 717371 >> 42.439 1.707 3.207 466150 >> 49.468 6.987 1.713 148452 >> 49.461 6.760 1.722 157125 >> 49.531 3.915 1.718 330362 >> 49.496 2.179 1.715 379192 >> 49.550 3.196 1.722 409721 >> 49.501 1.961 1.719 1751221 >> 33.943 1.497 4.227 452170 >> 33.845 6.855 4.233 95198 >> 33.923 8.031 4.231 277108 >> 33.939 1.880 4.229 1444502 >> 33.938 1.732 4.227 264047 >> 32.362 8.042 1.836 200144 >> 32.409 4.218 1.843 599010 >> 32.399 4.239 1.904 663178 >> 32.396 1.508 1.853 886408 >> 32.412 8.022 1.917 344668 >> 32.412 1.528 1.920 1416940 >> 53.214 4.227 1.737 124671 >> 53.207 3.044 1.741 1052488 >> 53.196 1.508 1.739 3565436 >> 42.136 1.737 3.048 1912539 >> 42.126 1.495 3.047 715280 >> 48.996 8.041 1.489 142014 >> 49.026 4.224 1.496 341657 >> 49.079 1.866 1.500 1193443 >> 49.088 1.736 1.498 2718043 >> 49.071 3.055 1.497 299524 >> 49.081 1.494 1.501 36886040 >> 32.056 0.817 4.366 587362 >> 32.019 7.959 4.355 601744 >> 32.013 1.937 4.346 1152489 >> 31.996 6.849 4.349 217626 >> 32.008 1.661 4.357 1550030 >> 32.458 0.782 1.674 313073 >> 32.422 0.785 1.935 320835 >> 32.404 8.025 1.685 362336 >> 32.333 4.338 1.678 204507 >> 32.408 1.678 1.939 2931214 >> 32.393 1.928 1.682 2539938 >> 32.377 3.188 1.687 192560 >> 32.412 1.498 1.675 563616 >> 32.331 1.673 1.681 3407877 >> 43.531 4.364 3.204 210289 >> 43.496 1.539 3.214 647774 >> 43.496 1.529 3.349 660376 >> 43.554 1.634 3.348 1051194 >> 53.013 3.827 1.638 131104 >> 53.025 8.026 1.535 206909 >> 53.083 7.994 1.633 144598 >> 53.021 4.343 1.532 362351 >> 53.038 4.332 1.632 270534 >> 53.079 3.208 1.529 185519 >> 53.036 3.203 1.635 284714 >> 52.990 3.347 1.535 365659 >> 53.040 3.350 1.638 479539 >> 53.006 1.546 1.531 5036334 >> 53.011 1.932 1.524 424190 >> 53.045 1.933 1.635 443185 >> 41.148 3.396 2.861 324258 >> 41.085 4.308 2.860 179739 >> 41.167 0.572 2.854 183746 >> 41.160 0.798 2.860 371032 >> 41.151 6.862 2.853 255890 >> 41.191 1.370 2.869 289505 >> 41.192 -0.548 2.858 685272 >> 41.180 0.220 2.851 648682 >> 41.190 7.317 2.858 1383315 >> 41.171 2.854 2.862 7728132 >> 32.131 3.924 1.343 121411 >> 32.276 6.847 1.350 628764 >> 32.180 2.864 1.354 177148 >> 32.277 1.354 1.358 5305140 >> 32.277 -0.541 1.356 683242 >> 32.282 0.224 1.354 859176 >> 32.319 7.226 1.359 155837 >> 45.158 4.209 -0.536 257127 >> 45.191 1.066 -0.532 731555 >> 45.234 9.201 -0.530 167799 >> 45.087 0.569 -0.575 382050 >> 45.112 6.825 -0.528 86174 >> 45.167 2.856 -0.529 435426 >> 45.175 1.357 -0.530 671051 >> 45.195 -0.536 -0.532 22533818 >> 45.192 0.231 -0.530 980264 >> 45.222 7.310 -0.528 463231 >> 45.082 6.979 -0.530 223560 >> 47.033 0.572 0.230 660803 >> 46.987 1.835 0.232 293973 >> 46.997 0.795 0.236 659398 >> 47.043 3.890 0.199 327713 >> 47.002 6.832 0.232 803475 >> 47.002 6.832 0.232 803475 >> 47.011 2.848 0.233 653621 >> 47.004 1.356 0.235 1010584 >> 47.012 -0.540 0.230 1525035 >> 47.008 0.226 0.228 27123194 >> 54.623 7.313 4.379 381784 >> 54.578 1.621 4.385 571185 >> 54.529 1.836 4.381 597061 >> 54.526 1.980 4.388 344808 >> 54.546 2.075 4.389 321249 >> 54.563 8.379 4.384 1405386 >> 54.675 0.820 1.608 165962 >> 54.741 0.834 1.845 279304 >> 54.739 4.221 1.620 174122 >> 54.720 7.319 1.622 442648 >> 54.713 7.319 1.839 389125 >> 54.714 4.378 1.621 357298 >> 54.711 4.370 1.841 370478 >> 54.727 1.610 1.617 5803911 >> 54.707 1.620 1.839 3351074 >> 54.694 2.079 1.621 543497 >> 54.724 8.381 1.610 92323 >> 54.717 1.839 1.620 3730320 >> 35.872 0.566 2.103 86242 >> 35.931 7.316 1.979 101012 >> 36.046 7.322 2.102 132184 >> 36.015 4.367 1.974 196282 >> 36.016 1.620 1.982 642148 >> 35.994 1.622 2.090 627629 >> 35.971 0.829 1.978 367863 >> 35.975 0.832 2.085 404292 >> 33.867 4.209 5.403 500620 >> 33.858 9.196 5.392 151969 >> 33.825 8.372 5.403 192946 >> 33.833 2.714 5.402 278564 >> 33.867 2.897 5.405 508428 >> 33.805 6.977 5.402 382576 >> 33.837 8.830 5.400 1132484 >> 33.777 0.804 5.402 181113 >> 41.092 1.591 2.870 193374 >> 41.201 8.382 2.713 348752 >> 41.113 8.365 2.894 118660 >> 41.116 5.398 2.708 178865 >> 41.176 5.399 2.891 266156 >> 41.200 2.711 2.717 3786347 >> 41.183 2.716 2.890 1989432 >> 41.181 2.882 2.712 1813180 >> 41.170 6.965 2.884 409968 >> 41.341 0.870 2.698 102336 >> 35.874 8.795 2.252 110157 >> 35.868 2.282 2.282 11485916 >> 35.776 8.541 2.254 791762 >> 35.797 0.824 2.256 2191247 >> 45.795 1.669 0.856 160058 >> 45.687 1.995 0.860 333859 >> 45.734 8.837 0.858 228949 >> 45.703 4.681 0.857 173106 >> 45.713 2.246 0.860 1574760 >> 45.680 8.542 0.862 204778 >> 43.044 9.178 0.805 184438 >> 43.035 1.301 0.797 129627 >> 43.023 1.675 0.799 1568997 >> 43.004 2.960 0.799 258050 >> 43.010 1.525 0.798 546486 >> 43.020 5.389 0.792 111701 >> 43.025 8.835 0.800 717857 >> 43.015 2.249 0.799 1776204 >> 43.018 8.537 0.800 248914 >> 43.051 8.020 0.803 94735 >> 43.035 0.799 0.799 54523372 >> 31.437 8.427 4.434 419882 >> 31.736 1.676 4.463 875506 >> 31.754 8.020 4.466 923080 >> 31.795 0.817 4.464 942350 >> 41.783 8.540 1.659 528465 >> 41.767 0.959 1.667 784834 >> 41.774 8.017 1.691 180978 >> 41.806 0.837 1.665 688993 >> 49.761 2.113 0.964 187256 >> 49.728 0.966 0.968 69629600 >> 49.626 1.667 0.969 849157 >> 51.182 8.535 1.745 482959 >> 51.183 0.815 1.740 800359 >> 53.867 1.677 4.066 695423 >> 53.801 2.948 4.063 218302 >> 53.769 0.809 4.061 175362 >> 53.847 7.986 4.066 340953 >> 53.806 1.285 4.067 1972317 >> 44.530 2.027 1.285 301470 >> 44.461 2.187 1.280 198313 >> 44.501 1.684 1.295 528355 >> 44.523 8.013 1.284 651569 >> 44.514 4.066 1.290 1701749 >> >>c13_noesy_arom.list >> w1 w2 w3 Data Height >> >> 119.505 3.008 6.927 132573 >> 131.663 1.629 7.196 133771 >> 120.553 3.913 6.884 39460 >> 120.706 0.864 6.901 172552 >> 120.712 2.706 6.899 100771 >> 123.711 7.266 7.269 10134407 >> 123.661 3.393 7.265 170013 >> 131.652 3.005 7.193 358090 >> 131.549 7.192 7.194 22231478 >> 131.595 6.982 7.207 2494352 >> 129.405 7.200 6.997 1550039 >> 129.471 6.991 6.999 4752464 >> 119.649 3.348 6.934 359851 >> 133.406 1.507 6.967 240583 >> 133.329 0.579 6.968 345683 >> 133.289 4.313 6.965 100048 >> 133.319 8.993 6.962 311766 >> 133.386 5.124 6.977 235314 >> 133.334 2.754 6.967 533474 >> 133.314 3.045 6.969 469152 >> 133.354 6.965 6.968 12476718 >> 133.334 6.756 6.968 3197732 >> 133.246 3.913 6.982 100093 >> 133.395 0.210 6.964 210973 >> 133.297 1.058 6.968 545782 >> 117.687 0.682 6.758 312139 >> 117.662 6.963 6.757 4008635 >> 117.655 6.755 6.756 14688042 >> 117.662 1.986 6.755 177033 >> 117.718 1.724 6.751 186744 >> 117.731 7.172 6.756 342602 >> 117.668 1.061 6.756 791971 >> 129.988 7.293 7.297 8125586 >> 131.548 2.284 6.972 203293 >> 131.703 2.700 6.980 514447 >> 131.637 2.969 6.978 478506 >> 131.612 7.287 6.979 4368281 >> 131.660 2.041 6.983 166948 >> 131.574 1.721 6.980 337891 >> 131.471 0.627 6.981 126995 >> 131.583 0.980 6.979 243673 >> 131.581 2.694 7.284 88314 >> 131.638 4.195 7.295 243564 >> 131.714 2.289 7.300 112509 >> 131.727 1.694 7.301 123819 >> 131.732 2.027 7.300 120808 >> 131.667 2.994 7.294 252953 >> 131.682 1.003 7.290 97934 >> 121.275 2.084 7.259 368514 >> 121.217 1.839 7.259 112929 >> 121.309 8.917 7.258 127265 >> 121.260 3.079 7.261 151057 >> 121.303 7.257 7.259 6111566 >> 118.129 3.439 7.176 123042 >> 118.075 7.176 7.180 4955002 >> 137.657 2.959 7.671 1239707 >> 137.675 3.297 7.670 560242 >> 129.002 -0.576 6.974 72121 >> 131.707 4.208 6.982 127950 >> 132.046 8.363 6.978 116498 >> 131.943 5.412 6.972 160140 >> 131.976 2.717 6.977 363367 >> 131.922 2.901 6.977 349239 >> 131.577 1.077 7.210 170833 >> 131.638 1.340 7.199 140105 >> 131.496 -0.533 7.222 93752 >> >>d2o_c13_noesy_aliph.list >> w1 w2 w3 Data Height >> >> 46.009 0.692 1.295 181385 >> 52.829 1.647 5.081 77755 >> 54.792 6.815 5.056 118730 >> 32.797 2.304 2.081 346959 >> 33.807 4.217 1.849 161969 >> 42.489 0.864 1.609 642850 >> 42.511 4.377 1.603 349103 >> 32.198 4.414 2.271 832534 >> 32.192 2.274 1.893 3445900 >> 32.192 1.897 2.269 3608844 >> 49.725 4.368 0.963 170487 >> 47.550 4.380 0.835 655339 >> 51.163 4.398 1.719 226220 >> 32.500 1.725 4.382 130701 >> 33.818 0.644 1.860 199124 >> 45.760 1.610 1.294 131949 >> 51.646 3.225 1.718 593806 >> 34.202 3.323 4.909 559542 >> 45.853 0.771 1.293 112207 >> 53.776 2.544 4.840 781870 >> 39.691 0.855 3.849 162815 >> 46.220 2.161 0.864 135859 >> 48.667 2.523 0.985 396971 >> 45.817 1.846 0.862 188802 >> 49.717 4.586 0.964 105963 >> 32.117 3.909 1.841 266583 >> 32.298 4.237 1.905 687624 >> 43.359 0.899 1.554 186195 >> 34.252 2.773 4.816 748017 >> 34.626 0.871 4.464 101457 >> 44.688 0.790 1.302 566146 >> 32.267 2.384 2.072 3697292 >> 32.061 0.873 1.850 1973934 >> 42.524 1.680 2.698 176830 >> 34.201 2.686 1.671 104376 >> 34.249 3.081 1.690 108678 >> 33.861 1.892 4.144 1011268 >> 33.853 1.705 4.141 496670 >> 51.152 3.197 1.677 637673 >> 51.728 3.030 1.408 151818 >> 53.381 0.576 1.680 309930 >> 31.927 4.242 2.359 383606 >> 32.202 4.408 1.891 404958 >> 32.298 4.237 1.905 687624 >> 32.003 1.887 2.351 1697921 >> 54.649 4.816 4.550 320990 >> 33.861 1.393 2.303 95212 >> 33.785 0.760 1.708 96443 >> 45.321 5.096 0.572 130404 >> 45.332 6.966 0.574 103195 >> 45.107 1.699 0.768 311603 >> 45.105 2.935 0.769 125562 >> 52.808 0.596 5.086 148048 >> 52.754 1.006 5.085 174609 >> 41.207 1.510 3.088 88862 >> 52.976 7.237 2.022 86761 >> 33.733 4.195 2.030 239055 >> 48.665 6.990 0.985 403462 >> 42.196 1.262 0.795 438008 >> 43.370 4.406 3.200 312460 >> 41.079 1.347 2.853 245740 >> 41.080 0.216 2.854 717527 >> 45.089 6.963 -0.570 301031 >> 33.728 2.713 5.424 232724 >> 41.729 4.371 1.677 425176 >> 31.327 2.075 4.436 814876 >> 31.350 2.429 4.432 415694 >> 32.013 4.436 2.484 120743 >> 32.197 2.163 4.283 587725 >> 32.199 2.236 4.294 662516 >> 32.204 1.922 4.282 1817548 >> 32.163 0.869 4.280 261273 >> 54.691 4.279 1.908 828691 >> 54.699 2.145 1.909 1019873 >> 54.706 2.222 1.914 666335 >> 36.649 4.281 2.158 398922 >> 36.697 4.288 2.260 560210 >> 36.703 1.918 2.149 1353138 >> 36.695 1.936 2.261 1700974 >> 36.684 0.874 2.149 325572 >> 36.663 0.875 2.261 423519 >> 53.675 1.308 4.604 690221 >> 53.680 0.862 4.599 1110030 >> 53.651 1.601 4.593 732495 >> 44.778 4.591 1.309 405541 >> 44.779 4.596 1.572 208251 >> 44.802 1.304 1.571 1500497 >> 44.787 1.574 1.306 1877550 >> 44.808 1.576 1.572 2869497 >> 44.688 0.790 1.302 566146 >> 44.796 0.776 1.573 425367 >> 49.961 4.619 0.762 185587 >> 49.856 1.298 0.766 464043 >> 49.956 1.574 0.767 980181 >> 49.961 4.619 0.762 185587 >> 47.374 4.597 0.861 1439912 >> 47.354 1.303 0.859 597227 >> 47.398 1.612 0.857 1453469 >> 50.936 4.591 1.628 212846 >> 50.917 1.313 1.625 301630 >> 50.892 0.859 1.626 553378 >> 55.080 2.662 4.842 0 >> 55.080 3.906 4.842 0 >> 32.277 4.844 2.657 188278 >> 32.295 4.840 2.774 178799 >> 32.343 2.651 2.657 3292392 >> 32.333 2.664 2.780 1371524 >> 32.297 2.779 2.783 1851325 >> 32.324 6.873 2.788 84848 >> 32.331 4.159 2.654 193435 >> 32.372 4.159 2.785 188006 >> 33.255 3.122 4.300 348983 >> 33.266 3.956 4.305 763644 >> 33.217 4.143 4.304 775628 >> 33.254 1.554 4.302 129143 >> 33.178 4.291 4.294 12248617 >> 33.205 0.654 4.297 1379579 >> 31.860 4.313 3.115 271748 >> 31.838 4.312 3.210 164965 >> 31.793 4.164 3.122 65541 >> 31.846 4.147 3.200 91897 >> 40.318 2.092 4.469 929508 >> 40.318 2.408 4.469 1407654 >> 32.338 4.465 2.404 942153 >> 32.320 2.080 2.404 3368594 >> 32.371 3.958 2.402 172132 >> 32.417 4.143 2.080 180848 >> 32.314 4.129 2.402 89986 >> 32.721 0.928 2.054 1655036 >> 32.355 4.466 2.072 530002 >> 32.267 2.384 2.072 3697292 >> 51.544 4.307 3.958 708269 >> 51.550 4.304 4.139 689140 >> 51.543 2.380 3.963 124095 >> 51.590 2.361 4.143 125719 >> 51.540 3.959 3.958 2653107 >> 51.543 3.959 4.140 1813163 >> 51.535 4.141 3.959 1805960 >> 51.575 4.139 4.138 2162296 >> 51.545 2.138 3.959 630215 >> 51.535 2.135 4.140 622756 >> 51.629 0.671 3.958 218729 >> 51.552 0.686 4.141 149400 >> 51.551 0.956 3.962 144188 >> 51.543 0.834 3.957 322622 >> 51.554 0.840 4.138 389308 >> 51.372 4.310 2.141 173928 >> 51.363 4.464 2.143 297042 >> 51.347 2.394 2.140 869790 >> 51.367 3.959 2.141 622958 >> 51.364 4.142 2.139 666948 >> 51.352 2.138 2.139 12993773 >> 51.365 0.965 2.142 229736 >> 51.358 0.839 2.142 483954 >> 33.392 2.283 4.503 1093049 >> 53.782 4.509 2.278 350607 >> 53.708 4.521 2.206 639694 >> 33.622 4.499 2.393 188062 >> 35.179 2.294 5.047 123983 >> 35.152 5.045 5.046 4235436 >> 35.154 2.561 5.046 560491 >> 35.153 3.252 5.045 585150 >> 32.724 5.046 2.564 357165 >> 32.701 5.042 3.255 425067 >> 32.701 2.563 3.255 1285465 >> 32.710 3.261 3.261 1745972 >> 32.694 3.251 2.565 1257065 >> 35.040 2.658 4.169 473340 >> 35.035 2.768 4.173 273372 >> 35.081 3.189 4.166 106143 >> 35.039 2.474 4.170 480370 >> 35.035 2.303 4.169 952034 >> 50.078 4.165 2.342 312469 >> 50.052 4.176 2.481 298177 >> 50.076 2.327 2.342 2729127 >> 50.072 2.325 2.481 2353138 >> 50.078 2.475 2.342 1925150 >> 50.069 2.477 2.480 2914104 >> 34.472 4.169 2.266 615076 >> 34.464 2.470 2.266 1874139 >> 34.471 2.268 2.267 27055724 >> 34.096 2.429 4.540 128136 >> 33.963 3.395 4.536 681827 >> 33.951 0.872 4.537 135897 >> 31.344 4.540 3.398 302568 >> 31.333 7.255 3.402 128205 >> 31.334 3.398 3.400 3831186 >> 31.387 3.827 3.394 219957 >> 40.054 4.837 3.912 722963 >> 40.068 6.878 3.913 124350 >> 40.047 1.847 3.912 481306 >> 40.157 1.510 3.905 81355 >> 40.038 0.875 3.912 1090890 >> 32.090 3.910 1.852 439944 >> 32.061 0.873 1.850 1973934 >> 45.112 3.907 0.883 477985 >> 45.130 1.857 0.883 1318757 >> 46.245 6.877 0.864 169616 >> 46.238 3.910 0.863 685281 >> 46.243 1.859 0.863 1318480 >> 46.264 0.866 0.862 51800600 >> 54.252 1.154 4.500 556514 >> 54.220 0.746 4.498 1062490 >> 54.231 1.540 4.498 566579 >> 43.886 4.506 1.146 216624 >> 43.873 4.510 1.529 175169 >> 43.868 1.143 1.143 946834 >> 43.874 1.141 1.524 979744 >> 43.876 0.675 1.521 354283 >> 43.899 0.707 1.133 330598 >> 43.864 1.529 1.135 1097372 >> 50.717 4.834 0.661 125087 >> 50.713 4.304 0.663 365753 >> 50.686 3.114 0.660 110009 >> 50.750 3.947 0.666 210093 >> 50.712 4.509 0.661 246345 >> 50.706 1.164 0.662 596284 >> 50.701 0.663 0.662 17980098 >> 50.720 1.272 0.664 872281 >> 50.684 4.155 0.663 129647 >> 50.744 1.553 0.663 3293395 >> 47.684 4.300 0.745 453463 >> 47.692 4.500 0.747 909232 >> 47.699 1.152 0.745 442038 >> 47.688 1.550 0.747 954660 >> 47.699 1.234 0.747 367320 >> 47.672 4.656 0.746 530181 >> 47.694 3.148 0.744 647365 >> 47.712 2.689 0.745 470845 >> 50.831 4.828 1.554 121598 >> 50.729 4.467 1.540 144955 >> 50.852 1.158 1.549 175736 >> 50.760 0.666 1.553 2152344 >> 53.614 2.697 4.927 1017092 >> 42.536 4.923 2.694 563764 >> 31.730 1.818 4.803 208830 >> 31.673 2.202 4.797 189763 >> 31.715 5.195 4.799 708086 >> 31.627 1.253 4.800 144003 >> 31.670 2.065 4.798 457713 >> 54.726 4.802 1.827 204738 >> 54.743 4.804 2.038 184790 >> 54.721 1.830 2.036 1578849 >> 54.694 2.041 1.824 2168254 >> 54.594 2.035 2.032 3382195 >> 54.622 2.183 2.036 791445 >> 54.651 1.837 1.830 7577918 >> 34.364 4.809 2.100 199092 >> 34.309 4.795 2.198 179746 >> 34.341 1.825 2.105 359505 >> 34.345 1.825 2.198 432697 >> 54.001 2.528 4.636 254384 >> 42.807 4.631 2.537 169463 >> 45.593 2.991 3.286 1457009 >> 45.590 3.283 2.991 1222355 >> 54.739 2.006 5.058 104188 >> 54.775 2.966 5.056 393939 >> 54.783 3.137 5.057 306425 >> 54.735 4.297 5.058 341694 >> 54.741 2.280 5.058 222221 >> 32.468 5.065 2.971 231849 >> 32.494 5.045 3.131 191546 >> 32.477 2.968 3.131 1461808 >> 32.482 3.128 2.965 1203587 >> 32.496 3.130 3.129 2217863 >> 50.440 4.793 5.204 633676 >> 50.443 1.255 5.203 932650 >> 46.486 4.486 1.260 88235 >> 46.413 0.671 1.253 835863 >> 46.427 0.788 1.256 630176 >> 46.416 4.792 1.252 169838 >> 46.380 2.103 1.257 185446 >> 45.890 5.049 1.291 272723 >> 46.402 5.198 1.254 884253 >> 45.903 1.293 1.293 7885682 >> 46.396 1.600 1.254 793682 >> 46.392 2.267 1.256 163400 >> 54.099 1.666 5.181 282155 >> 54.120 1.372 5.182 148138 >> 34.170 5.191 1.692 221865 >> 34.172 3.081 1.661 113937 >> 34.243 2.978 1.680 204030 >> 43.140 1.663 3.004 159168 >> 43.103 1.675 3.105 225236 >> 43.122 1.378 2.994 292226 >> 43.095 1.381 3.101 366063 >> 51.824 5.181 1.379 137185 >> 51.788 3.052 1.353 218624 >> 35.006 0.751 4.667 613220 >> 34.956 2.689 4.662 410116 >> 34.990 3.160 4.665 227030 >> 31.598 0.745 2.683 379915 >> 31.652 0.747 3.157 290399 >> 31.618 4.663 2.687 231957 >> 31.598 4.661 3.157 143650 >> 31.590 2.698 3.164 1159504 >> 31.607 3.160 2.687 1231290 >> 31.586 1.977 2.685 105553 >> 31.597 1.967 3.181 105951 >> 33.861 1.892 4.144 1011268 >> 33.889 3.227 4.142 160199 >> 33.853 1.705 4.141 496670 >> 54.692 0.871 1.906 459208 >> 54.352 4.140 1.869 403460 >> 54.347 4.138 1.914 391502 >> 54.350 3.228 1.863 261323 >> 54.332 3.228 1.908 291986 >> 43.378 0.859 3.215 207917 >> 43.375 1.879 3.221 1379839 >> 43.382 1.692 3.215 2998607 >> 51.152 3.197 1.677 637673 >> 51.166 4.403 1.677 220928 >> 35.892 3.090 4.362 498530 >> 35.824 3.856 4.386 1648237 >> 38.865 3.403 3.086 107648 >> 38.833 3.403 3.840 299567 >> 38.839 4.366 3.090 180860 >> 38.874 4.360 3.834 226554 >> 38.841 3.094 3.099 916211 >> 38.816 3.092 3.835 1358040 >> 38.833 3.832 3.081 879002 >> 35.954 2.926 4.138 602938 >> 35.927 3.104 4.139 960888 >> 49.938 4.138 2.924 478085 >> 49.931 4.139 3.103 681970 >> 49.928 2.923 2.924 15320901 >> 49.929 2.925 3.102 5761068 >> 49.931 3.101 2.925 5591584 >> 49.928 3.103 3.103 14650248 >> 45.992 3.813 4.230 1527466 >> 45.987 4.231 3.811 1867228 >> 33.602 1.987 4.283 173774 >> 33.517 2.047 4.287 188642 >> 54.170 4.298 1.967 301857 >> 54.190 4.300 2.043 314570 >> 33.050 5.231 5.236 3310328 >> 33.052 3.021 5.237 405007 >> 33.002 7.182 5.233 114823 >> 33.002 7.182 5.233 114823 >> 41.072 5.231 3.013 258786 >> 41.045 7.187 3.009 211404 >> 35.700 1.618 4.273 290802 >> 35.682 1.199 4.274 342204 >> 35.675 1.386 4.272 261295 >> 35.688 0.840 4.273 969538 >> 41.618 4.298 1.626 148465 >> 41.533 1.244 1.625 406897 >> 41.563 0.838 1.628 889802 >> 38.175 3.962 0.852 194171 >> 38.136 4.144 0.850 336901 >> 38.150 2.132 0.849 266786 >> 38.186 2.301 0.851 188574 >> 38.219 4.285 0.847 354028 >> 38.195 1.628 0.847 316243 >> 38.195 1.206 0.848 510538 >> 38.187 1.385 0.849 511884 >> 38.182 0.847 0.848 27367922 >> 51.896 2.250 1.390 92371 >> 51.827 4.278 1.191 210955 >> 51.769 4.276 1.388 233917 >> 51.786 1.633 1.196 248409 >> 51.784 1.195 1.193 3996877 >> 51.773 1.200 1.386 2056539 >> 51.786 1.385 1.194 1819075 >> 51.799 0.845 1.193 760932 >> 51.791 0.841 1.385 816979 >> 51.771 1.647 1.387 654592 >> 51.768 1.384 1.386 7911702 >> 42.447 4.279 0.840 761597 >> 42.452 1.624 0.841 936042 >> 42.451 1.210 0.840 587107 >> 42.436 1.384 0.840 413926 >> 42.442 2.018 0.841 183187 >> 42.410 2.271 0.841 135492 >> 32.188 5.051 4.307 271882 >> 32.169 2.002 4.309 1006050 >> 54.160 1.293 1.965 158843 >> 54.172 1.295 2.041 188849 >> 36.639 4.297 2.223 295744 >> 36.674 2.037 2.212 1315338 >> 36.662 1.314 2.230 132362 >> 55.080 1.559 4.845 0 >> 35.181 1.805 1.798 858679 >> 35.214 1.793 2.147 613139 >> 35.235 2.151 1.792 581606 >> 35.179 2.012 1.793 280403 >> 41.396 1.240 1.580 710519 >> 41.385 1.582 1.580 47190332 >> 41.377 2.034 1.579 481389 >> 41.396 2.248 1.580 428188 >> 41.386 2.705 1.578 243351 >> 41.404 2.893 1.580 362754 >> 41.368 6.968 1.580 116990 >> 41.393 4.710 1.581 402838 >> 41.392 2.141 1.579 692756 >> 41.384 0.803 1.582 1564360 >> 32.872 5.044 2.280 86445 >> 32.897 1.276 1.999 114712 >> 32.893 1.255 2.276 126966 >> 32.922 1.796 2.278 358822 >> 32.856 1.585 2.001 196249 >> 32.830 1.598 2.282 172553 >> 32.883 2.011 2.276 1187158 >> 32.863 4.701 1.999 174149 >> 32.914 4.696 2.275 154449 >> 32.916 0.827 2.280 197060 >> 31.174 1.440 4.628 126563 >> 31.174 1.689 4.637 682171 >> 34.301 4.637 1.688 566039 >> 34.270 1.436 1.688 838691 >> 34.383 0.582 1.685 118447 >> 34.321 0.804 1.687 703220 >> 34.306 1.307 1.687 705496 >> 53.377 0.776 1.681 551131 >> 53.381 0.576 1.680 309930 >> 53.324 4.054 1.688 140292 >> 53.377 4.641 1.677 131268 >> 53.392 2.937 1.676 1634962 >> 41.721 0.781 2.951 577475 >> 41.729 0.572 2.946 343432 >> 41.747 1.306 2.945 781672 >> 41.744 1.686 2.947 2176698 >> 48.616 4.642 1.297 203623 >> 48.628 4.639 1.451 265199 >> 48.675 1.295 1.295 8318430 >> 48.636 1.299 1.447 2668881 >> 48.637 1.449 1.298 2318157 >> 48.666 1.449 1.448 7446738 >> 48.688 2.960 1.297 156566 >> 48.605 2.956 1.449 179960 >> 48.596 0.575 1.298 232795 >> 48.702 0.554 1.445 142699 >> 48.639 1.686 1.296 1162588 >> 48.641 1.684 1.448 1405101 >> 48.676 0.795 1.290 203186 >> 48.631 0.793 1.452 202253 >> 50.892 4.202 4.206 6020384 >> 50.886 1.107 4.206 1216882 >> 50.868 -0.563 4.206 473316 >> 50.869 5.417 4.206 598111 >> 50.876 6.973 4.207 235642 >> 50.989 0.605 4.209 132474 >> 50.781 0.831 4.211 117876 >> 45.061 4.200 1.111 1005095 >> 45.073 1.505 1.110 372350 >> 45.059 6.970 1.112 556737 >> 45.061 6.772 1.111 464532 >> 45.056 -0.568 1.111 992900 >> 45.042 0.216 1.116 199981 >> 45.069 7.207 1.110 312893 >> 52.808 4.624 4.618 5056674 >> 52.786 1.876 4.617 410712 >> 52.823 0.838 4.618 791290 >> 52.800 0.577 4.618 1122734 >> 52.829 1.523 4.617 282184 >> 52.847 1.670 4.619 296893 >> 44.050 4.631 1.880 237341 >> 44.121 4.615 0.843 326094 >> 44.119 0.834 1.878 1543937 >> 44.159 0.577 1.871 202112 >> 44.189 0.576 0.840 303631 >> 44.119 1.535 1.878 273599 >> 44.113 1.525 0.840 246160 >> 44.095 4.498 1.878 153609 >> 44.136 4.504 0.847 251695 >> 44.105 1.875 1.878 1868568 >> 44.113 1.875 0.842 1432656 >> 49.979 4.477 0.754 126746 >> 50.065 3.336 0.764 125180 >> 45.931 1.300 0.576 274216 >> 45.920 1.686 0.576 626287 >> 45.924 2.964 0.579 210006 >> 45.923 1.883 0.576 726663 >> 45.923 0.774 0.577 2302322 >> 45.931 0.576 0.576 33016566 >> 45.908 1.527 0.576 1330411 >> 45.930 4.659 0.576 1930905 >> 45.874 2.069 0.576 176481 >> 45.901 2.328 0.577 385927 >> 45.881 3.898 0.574 179673 >> 50.806 1.284 1.552 208472 >> 50.732 4.620 1.531 115691 >> 50.677 1.874 1.531 277666 >> 32.549 2.836 4.381 486916 >> 32.549 3.301 4.378 267177 >> 32.549 3.407 4.381 523104 >> 32.548 0.593 4.382 465139 >> 32.558 0.892 4.380 554028 >> 32.548 1.253 4.378 103365 >> 31.455 4.371 2.842 323541 >> 31.442 4.373 3.279 336886 >> 31.447 3.278 2.842 2008790 >> 31.443 0.575 2.843 118479 >> 31.517 0.584 3.288 73618 >> 31.483 0.893 2.843 503164 >> 31.437 0.893 3.277 371576 >> 31.428 1.675 2.839 104929 >> 31.487 1.667 3.269 97154 >> 31.445 2.837 3.275 2196760 >> 39.794 4.241 4.243 7141226 >> 39.801 2.358 4.244 746227 >> 39.811 3.401 4.244 134788 >> 39.803 1.635 4.247 258746 >> 39.800 2.078 4.241 170489 >> 39.803 1.875 4.243 734267 >> 31.927 4.242 2.359 383606 >> 31.986 3.400 1.894 110009 >> 31.917 3.407 2.365 91683 >> 32.202 4.408 1.891 404958 >> 32.298 4.237 1.905 687624 >> 32.003 1.887 2.351 1697921 >> 50.945 3.402 3.405 1206947 >> 50.981 3.407 4.325 984561 >> 50.971 0.632 4.325 169541 >> 50.957 0.796 3.404 313659 >> 50.965 0.796 4.328 298316 >> 50.977 4.337 3.405 1225252 >> 50.991 4.340 4.325 1312372 >> 50.966 0.616 3.402 124549 >> 50.976 2.858 3.404 290356 >> 51.028 2.862 4.326 167229 >> 50.957 1.800 3.407 448622 >> 50.983 1.803 4.325 472115 >> 50.775 2.353 1.793 320544 >> 50.805 3.402 1.791 330938 >> 50.797 4.331 1.790 448499 >> 50.892 0.639 1.793 102588 >> 50.820 0.796 1.788 244339 >> 50.814 1.796 1.793 3040377 >> 32.323 1.102 4.530 480359 >> 32.328 1.597 4.530 710630 >> 40.762 4.533 1.093 276504 >> 40.744 4.528 1.591 380615 >> 40.743 1.099 1.096 2230238 >> 40.739 1.098 1.592 1949994 >> 40.742 1.596 1.096 1827817 >> 40.855 1.598 1.595 2078885 >> 34.246 2.965 4.909 671335 >> 34.234 3.296 4.909 724787 >> 34.188 7.676 4.906 154348 >> 32.727 4.910 2.963 397549 >> 32.728 4.907 3.294 410549 >> 32.749 3.291 2.964 1013444 >> 32.746 3.281 3.281 1991524 >> 32.751 7.679 2.966 392208 >> 32.757 7.681 3.295 316615 >> 33.573 1.875 4.492 347030 >> 33.562 0.834 4.491 752686 >> 33.570 0.575 4.489 143798 >> 33.521 6.916 4.490 67673 >> 33.565 3.339 4.493 1062224 >> 50.573 0.779 3.345 235033 >> 50.587 4.493 3.346 619825 >> 50.637 6.925 3.336 107977 >> 50.592 3.343 3.345 6524973 >> 53.542 2.071 4.826 611294 >> 53.517 2.252 4.821 346370 >> 53.540 3.909 4.825 1142200 >> 52.424 4.826 2.059 215335 >> 52.387 4.821 2.125 236371 >> 52.428 1.828 2.123 306470 >> 52.472 3.819 2.054 162056 >> 52.417 3.835 2.109 143629 >> 52.513 7.238 2.068 119516 >> 52.453 7.257 2.127 80719 >> 33.771 3.292 2.259 150338 >> 33.689 4.822 2.254 269932 >> 33.708 2.094 1.827 933187 >> 33.706 1.829 2.255 3090434 >> 33.706 2.249 1.825 2725921 >> 33.711 7.259 1.821 106225 >> 33.736 1.824 1.824 11507688 >> 39.926 1.671 4.690 166645 >> 39.909 0.833 4.694 191450 >> 39.938 0.577 4.691 1358783 >> 39.920 2.071 4.690 412259 >> 39.935 1.884 4.690 322404 >> 39.931 2.335 4.691 891549 >> 32.150 0.597 2.067 140371 >> 32.193 0.570 2.339 220691 >> 32.126 4.688 2.076 377410 >> 32.148 4.687 2.342 645352 >> 32.145 2.067 2.342 2447867 >> 32.192 3.902 2.341 117127 >> 32.257 3.898 2.059 451304 >> 50.940 0.574 3.815 78399 >> 50.932 0.580 3.915 133897 >> 50.938 4.819 3.810 609029 >> 50.943 4.822 3.909 788337 >> 51.014 2.216 3.933 82152 >> 50.851 3.803 3.799 6130489 >> 50.945 1.892 3.813 328151 >> 50.947 1.895 3.905 355900 >> 50.950 2.069 3.814 501031 >> 50.960 2.066 3.903 385198 >> 50.937 2.311 3.814 392956 >> 50.922 2.307 3.909 366656 >> 52.139 1.702 2.303 164336 >> 52.117 0.574 1.887 308806 >> 52.104 0.574 2.314 219017 >> 52.103 4.823 2.304 118394 >> 52.149 4.683 1.892 237569 >> 52.143 4.688 2.311 188339 >> 52.187 2.073 1.890 699964 >> 52.143 2.066 2.310 798347 >> 52.153 3.844 1.891 335794 >> 52.157 3.831 2.311 475264 >> 52.155 3.900 1.892 345544 >> 52.145 3.909 2.313 383069 >> 52.158 1.889 1.889 3026590 >> 52.142 1.888 2.310 2129849 >> 52.146 2.318 1.889 2300951 >> 52.142 2.317 2.311 4433606 >> 54.510 1.525 4.550 696829 >> 54.488 0.579 4.549 190179 >> 54.511 0.894 4.550 1121377 >> 54.508 1.650 4.549 500769 >> 54.649 4.816 4.550 320990 >> 54.475 2.779 4.557 130456 >> 43.386 4.557 1.496 196309 >> 43.387 4.553 1.545 221807 >> 43.481 1.541 1.555 1603381 >> 43.401 0.596 1.483 272175 >> 43.390 0.592 1.542 263431 >> 43.416 0.898 1.484 225460 >> 43.374 0.887 1.526 185491 >> 43.323 6.998 1.479 74776 >> 52.545 1.106 0.586 715776 >> 52.559 4.373 0.585 352858 >> 52.499 4.557 0.585 134169 >> 52.539 1.518 0.585 578401 >> 52.549 0.588 0.586 14082078 >> 52.546 0.893 0.585 769856 >> 52.418 1.651 0.586 348046 >> 52.514 5.143 0.576 73151 >> 52.551 2.773 0.586 537692 >> 52.564 3.078 0.584 233950 >> 52.587 6.982 0.584 186683 >> 52.548 -0.564 0.588 719276 >> 52.556 0.217 0.586 689908 >> 52.568 1.857 0.586 232480 >> 49.487 4.372 0.896 656089 >> 49.456 3.275 0.895 328278 >> 49.474 4.551 0.895 1046820 >> 49.485 0.588 0.896 1281584 >> 49.355 0.892 0.893 20479586 >> 49.488 1.672 0.896 876744 >> 49.369 3.078 0.895 106105 >> 49.476 4.813 0.896 839268 >> 49.465 2.817 0.896 1347897 >> 49.410 1.260 0.895 397963 >> 49.462 1.854 0.896 511323 >> 51.750 4.563 1.673 221684 >> 52.064 0.580 1.671 265250 >> 51.778 0.894 1.673 387496 >> 31.650 2.218 4.542 816979 >> 31.666 2.370 4.541 786510 >> 31.657 2.509 4.542 441841 >> 53.696 4.544 2.390 413763 >> 53.699 2.217 2.388 2067922 >> 53.699 2.381 2.389 3632197 >> 53.714 2.502 2.203 629400 >> 53.714 2.502 2.389 852181 >> 53.639 0.669 2.214 152906 >> 53.714 0.667 2.383 172400 >> 53.701 2.983 2.206 199970 >> 53.679 2.976 2.387 231840 >> 53.735 2.216 2.204 6449876 >> 33.923 4.547 2.519 387724 >> 33.930 2.321 2.518 3862342 >> 33.932 2.516 2.311 3266268 >> 33.940 2.517 2.519 10870740 >> 33.925 0.668 2.308 219841 >> 33.987 0.654 2.521 180350 >> 33.861 1.393 2.303 95212 >> 33.918 1.418 2.522 68009 >> 33.967 2.974 2.310 79895 >> 33.890 2.963 2.520 98546 >> 33.741 6.988 2.290 160004 >> 33.981 2.044 2.512 160416 >> 33.946 4.548 2.314 296945 >> 33.737 7.281 2.284 178169 >> 38.234 4.316 4.315 9139362 >> 38.247 2.020 4.314 433919 >> 38.230 0.707 4.314 1101292 >> 38.236 1.055 4.315 1017659 >> 38.213 1.421 4.315 115002 >> 38.235 5.145 4.313 567743 >> 38.231 6.976 4.313 182716 >> 32.136 0.711 2.022 1154097 >> 32.147 1.056 2.023 1095367 >> 45.598 4.314 0.709 957060 >> 45.595 2.021 0.710 1594080 >> 45.594 0.709 0.710 45893548 >> 45.599 1.057 0.710 1985111 >> 45.561 1.378 0.710 383333 >> 45.601 1.688 0.711 179170 >> 45.602 2.926 0.711 268046 >> 45.616 1.838 0.710 168998 >> 45.609 6.980 0.708 117096 >> 45.590 6.768 0.710 305927 >> 44.889 0.586 1.057 621626 >> 44.863 4.543 1.054 167258 >> 44.864 4.315 1.055 1053885 >> 44.871 2.022 1.054 1788433 >> 44.869 0.710 1.054 2457492 >> 44.863 5.136 1.055 146208 >> 44.882 6.977 1.056 632398 >> 44.880 6.771 1.055 845259 >> 44.861 0.228 1.055 173917 >> 53.626 1.361 4.560 1024833 >> 53.618 0.672 4.558 1190708 >> 42.527 4.555 1.352 335512 >> 42.549 4.554 1.613 270185 >> 42.545 2.391 1.354 127910 >> 42.565 2.396 1.612 264593 >> 42.543 2.503 1.613 143588 >> 42.569 0.660 1.354 468225 >> 42.561 0.659 1.613 611313 >> 49.467 4.554 0.652 110737 >> 49.496 1.350 0.649 429521 >> 49.482 1.620 0.649 506961 >> 49.518 2.391 0.650 243007 >> 49.519 2.509 0.650 173727 >> 49.490 2.694 0.649 339214 >> 49.488 2.981 0.648 234104 >> 49.478 6.997 0.652 101168 >> 49.509 0.976 0.650 357626 >> 49.508 0.653 0.650 42555980 >> 47.442 4.557 0.675 1228064 >> 47.423 1.614 0.677 244428 >> 47.436 1.396 0.674 1200240 >> 47.445 2.344 0.675 279002 >> 50.982 4.560 1.414 237395 >> 50.951 1.602 1.415 634582 >> 50.907 2.365 1.414 116732 >> 50.903 2.697 1.414 99916 >> 51.017 0.678 1.413 354864 >> 31.751 1.327 4.884 558204 >> 31.771 4.623 4.884 813991 >> 31.746 0.578 4.881 262319 >> 31.799 0.750 4.882 269710 >> 31.742 1.705 4.883 621416 >> 31.763 1.823 4.884 757093 >> 33.658 4.879 1.706 270162 >> 33.710 4.867 1.825 485984 >> 33.722 1.816 1.710 3940390 >> 33.721 1.369 1.709 425077 >> 33.729 1.348 1.823 443084 >> 33.803 1.707 1.708 6267382 >> 33.717 2.960 1.830 77767 >> 53.451 4.881 1.674 126355 >> 53.391 1.348 1.677 1530742 >> 49.448 4.880 1.308 257384 >> 49.483 4.879 1.385 238671 >> 49.434 1.338 1.307 7354046 >> 49.466 1.366 1.386 7861704 >> 49.437 2.931 1.308 271963 >> 49.471 2.932 1.384 259670 >> 49.382 4.592 1.386 98775 >> 49.418 0.748 1.305 308901 >> 49.453 0.752 1.387 262219 >> 49.472 1.688 1.306 779953 >> 49.461 1.687 1.386 798686 >> 49.461 1.821 1.306 344740 >> 49.455 1.821 1.383 329199 >> 52.068 1.364 4.568 1514556 >> 44.838 4.563 1.361 1505420 >> 45.604 3.734 4.116 6218152 >> 45.602 4.113 3.734 5713701 >> 51.182 1.422 4.666 1818126 >> 51.139 0.770 4.665 145333 >> 45.346 4.661 1.422 1825276 >> 37.495 4.880 4.622 1006292 >> 37.483 1.345 4.622 235708 >> 37.509 1.836 4.621 619251 >> 37.489 0.573 4.621 937430 >> 37.503 0.764 4.621 739290 >> 34.167 4.627 1.839 431806 >> 34.156 0.575 1.838 993958 >> 34.173 0.764 1.838 962841 >> 45.306 4.882 0.572 230963 >> 45.322 1.348 0.574 216958 >> 45.320 4.617 0.573 763358 >> 45.321 1.835 0.573 1467697 >> 45.322 0.572 0.573 64339772 >> 45.323 6.772 0.573 328382 >> 45.321 0.732 0.574 2910865 >> 45.109 4.882 0.769 308597 >> 45.112 1.348 0.767 355496 >> 45.091 4.627 0.768 818772 >> 45.083 1.836 0.768 1547135 >> 45.068 0.601 0.768 2552848 >> 45.082 0.770 0.768 60401568 >> 52.822 2.399 5.084 585887 >> 52.817 2.520 5.083 1001252 >> 52.797 6.985 5.087 172358 >> 52.823 6.754 5.085 75960 >> 52.754 1.006 5.085 174609 >> 45.579 1.356 2.529 81069 >> 45.501 1.618 2.396 335899 >> 45.510 1.616 2.526 278814 >> 45.511 0.650 2.394 179389 >> 45.488 0.646 2.525 204921 >> 45.498 5.088 2.394 364514 >> 45.474 5.082 2.525 465382 >> 45.495 2.393 2.394 3235810 >> 45.492 2.394 2.524 2645149 >> 45.495 2.517 2.395 2587213 >> 45.488 2.521 2.525 3525233 >> 45.489 0.997 2.396 229162 >> 45.459 1.000 2.523 383184 >> 45.501 1.371 2.393 130816 >> 33.372 1.564 5.150 116765 >> 33.308 0.612 5.146 157743 >> 33.352 4.316 5.146 583189 >> 33.341 1.057 5.147 140263 >> 33.374 5.144 5.147 8220660 >> 33.358 2.758 5.147 616798 >> 33.412 3.072 5.148 439996 >> 33.370 6.980 5.147 436204 >> 33.348 0.693 5.143 157885 >> 41.254 1.504 3.070 75625 >> 41.221 1.559 2.772 124700 >> 41.168 0.587 2.762 315495 >> 41.169 0.590 3.076 233850 >> 41.219 0.909 2.757 142177 >> 41.199 5.150 2.765 238822 >> 41.129 5.143 3.074 212337 >> 41.155 6.974 2.737 371849 >> 41.151 6.975 3.079 288686 >> 41.145 1.843 2.749 91402 >> 41.164 1.854 3.067 141156 >> 41.182 0.229 2.766 88489 >> 41.186 0.209 3.071 161665 >> 32.523 5.090 5.090 6574293 >> 32.505 2.697 5.089 713049 >> 32.516 2.979 5.089 436006 >> 32.520 6.994 5.090 382616 >> 32.503 4.734 5.089 1166039 >> 32.511 0.986 5.088 226468 >> 32.476 1.722 5.090 148615 >> 32.542 1.865 5.089 108038 >> 32.498 0.643 5.089 139906 >> 44.390 2.213 2.694 143177 >> 44.374 2.210 2.980 151537 >> 44.354 2.372 2.696 128421 >> 44.420 2.381 2.984 212059 >> 44.385 5.092 2.698 378027 >> 44.402 5.098 2.982 305628 >> 44.422 2.695 2.697 2653319 >> 44.405 2.695 2.981 1846814 >> 44.403 2.980 2.697 1853071 >> 44.371 2.979 2.979 2469414 >> 44.411 6.989 2.694 374518 >> 44.391 6.991 2.979 360083 >> 44.420 4.722 2.696 78204 >> 44.443 0.999 2.695 154099 >> 44.405 0.659 2.697 356258 >> 44.421 0.656 2.988 281057 >> 34.202 4.539 4.812 587702 >> 34.203 0.896 4.811 1018564 >> 34.202 2.804 4.811 814642 >> 53.671 0.891 2.792 331139 >> 53.658 4.813 2.812 271467 >> 53.620 3.101 2.791 266697 >> 53.673 3.417 2.793 102739 >> 53.582 3.425 2.834 97917 >> 53.700 3.044 2.833 187121 >> 53.667 0.642 2.790 134105 >> 53.722 0.642 2.832 148839 >> 32.736 6.973 4.204 94624 >> 32.729 7.296 4.196 494182 >> 32.686 1.889 4.195 618388 >> 32.705 2.286 4.194 379450 >> 32.696 2.025 4.195 993376 >> 52.919 4.193 1.893 331661 >> 52.916 4.196 2.026 332457 >> 52.913 1.888 1.891 3019225 >> 52.933 1.889 2.027 2475898 >> 52.926 2.287 1.891 386965 >> 52.958 2.287 2.026 606694 >> 52.923 2.024 1.891 3228617 >> 52.930 2.024 2.027 4199327 >> 33.700 7.000 2.027 119457 >> 33.709 7.264 2.034 95639 >> 33.733 4.195 2.030 239055 >> 33.731 4.200 2.286 225522 >> 33.707 2.288 2.029 3347419 >> 33.719 2.028 2.287 4253348 >> 31.252 3.091 4.600 701998 >> 31.330 3.316 4.594 615502 >> 54.417 4.600 3.094 187205 >> 54.445 4.596 3.312 285936 >> 54.412 3.093 3.313 1286076 >> 54.376 3.319 3.091 1136717 >> 54.396 3.317 3.315 1442221 >> 54.394 7.243 3.090 116020 >> 54.353 7.252 3.317 84521 >> 45.053 3.485 3.488 2453426 >> 45.053 3.487 4.179 2080909 >> 45.056 4.179 3.488 2212872 >> 35.804 4.681 4.678 4642445 >> 35.801 3.102 4.678 391304 >> 35.829 3.426 4.677 696712 >> 35.818 7.182 4.679 417712 >> 54.090 2.821 3.105 362553 >> 54.074 2.822 3.423 308888 >> 54.113 4.675 3.099 151737 >> 54.060 4.681 3.427 267164 >> 54.095 3.101 3.426 1114387 >> 54.104 3.421 3.105 958500 >> 54.089 3.426 3.428 1323626 >> 54.058 0.645 3.106 198720 >> 54.133 0.650 3.426 222406 >> 45.663 7.298 3.025 222327 >> 45.626 7.307 3.781 240861 >> 45.658 3.022 3.779 2519978 >> 45.658 3.779 3.025 2441128 >> 31.770 5.090 4.738 1053290 >> 31.736 2.704 4.743 117099 >> 31.780 1.717 4.738 1070197 >> 31.775 0.991 4.738 845199 >> 42.400 4.737 1.718 615230 >> 42.414 6.988 1.715 114816 >> 42.406 1.003 1.719 1066853 >> 48.964 1.013 1.011 73230376 >> 48.959 1.724 1.011 1726770 >> 48.979 2.392 1.008 121557 >> 48.829 2.526 0.994 295749 >> 48.686 5.096 0.987 340428 >> 48.668 2.703 0.985 270493 >> 48.665 6.990 0.985 403462 >> 49.008 7.315 1.013 89373 >> 48.663 4.737 0.986 776632 >> 51.379 6.990 1.724 152317 >> 51.362 4.738 1.723 223667 >> 51.231 1.710 1.719 24379066 >> 51.412 0.996 1.728 968104 >> 33.145 1.265 4.296 154689 >> 33.202 0.789 4.297 1399288 >> 33.190 1.704 4.292 126372 >> 33.142 1.860 4.294 559277 >> 37.918 2.772 1.855 118358 >> 37.906 3.074 1.854 177487 >> 37.945 4.305 1.855 156296 >> 37.883 1.262 1.855 342928 >> 37.893 0.796 1.854 698197 >> 37.941 0.228 1.858 189462 >> 37.903 1.855 1.854 3331816 >> 37.883 0.615 1.852 301676 >> 33.778 3.099 0.639 386196 >> 33.779 4.300 0.641 1254456 >> 33.783 0.644 0.641 24342012 >> 33.780 1.261 0.640 825395 >> 33.776 2.815 0.640 398216 >> 33.781 3.417 0.640 557620 >> 33.771 1.855 0.641 1321835 >> 51.205 0.865 1.262 305536 >> 51.207 0.871 1.859 306646 >> 51.158 0.642 1.261 441126 >> 51.197 0.637 1.860 441823 >> 51.205 1.264 1.859 1051471 >> 51.206 0.810 1.260 302126 >> 51.207 1.859 1.261 1418404 >> 51.234 4.330 1.842 104095 >> 42.172 3.402 0.795 421203 >> 42.196 1.262 0.795 438008 >> 42.168 1.703 0.796 593200 >> 42.158 2.853 0.795 383202 >> 42.174 0.215 0.794 979298 >> 42.175 4.309 0.794 1115482 >> 42.172 1.850 0.794 1584595 >> 34.588 3.865 4.453 2157376 >> 34.401 4.099 4.445 1234820 >> 34.460 1.690 4.446 111302 >> 39.676 4.449 3.845 1929460 >> 39.579 4.443 4.098 1054632 >> 39.596 3.843 4.098 5839638 >> 39.582 4.098 3.843 5547288 >> 39.575 4.097 4.097 16185354 >> 39.657 1.889 3.843 201602 >> 39.587 1.926 4.102 97413 >> 39.541 3.207 3.844 159926 >> 39.528 1.538 3.844 263728 >> 39.594 1.526 4.093 181121 >> 39.590 1.658 3.842 402795 >> 39.582 1.670 4.102 189152 >> 36.421 6.973 3.888 144522 >> 36.466 6.764 3.893 92282 >> 36.403 2.050 3.890 512638 >> 36.412 2.220 3.889 624152 >> 36.397 1.689 3.889 465638 >> 36.434 1.347 3.886 220049 >> 36.431 -0.546 3.899 89872 >> 36.402 0.213 3.889 939401 >> 32.236 6.767 2.221 118764 >> 32.243 3.894 2.057 453625 >> 32.263 3.889 2.220 447017 >> 32.297 1.698 2.219 567143 >> 53.469 6.987 1.947 82101 >> 53.540 6.774 1.960 109819 >> 53.470 2.205 1.958 323088 >> 53.461 3.171 1.960 604228 >> 53.458 1.702 1.961 1414249 >> 42.129 1.963 3.142 783359 >> 42.149 1.962 3.199 717149 >> 42.144 1.700 3.145 423133 >> 42.146 1.695 3.193 407019 >> 49.522 6.966 1.674 112734 >> 49.447 6.770 1.688 166205 >> 49.453 3.896 1.698 307415 >> 49.473 2.219 1.698 344416 >> 49.457 3.174 1.698 260235 >> 49.469 1.961 1.698 1044972 >> 49.461 1.695 1.699 13290984 >> 33.837 1.509 4.223 492628 >> 33.835 1.884 4.223 1460177 >> 33.844 1.711 4.223 263538 >> 32.366 4.219 1.851 446782 >> 32.334 1.511 1.851 754187 >> 32.360 1.520 1.917 890525 >> 53.070 4.226 1.743 138703 >> 53.066 1.742 1.741 51501416 >> 53.048 3.043 1.740 1009566 >> 53.050 1.514 1.742 2586349 >> 41.866 1.871 3.044 172588 >> 41.879 1.746 3.042 1738353 >> 41.880 1.506 3.041 715965 >> 49.073 4.225 1.500 337472 >> 49.069 1.872 1.502 1001814 >> 49.074 1.741 1.501 1833753 >> 49.088 3.047 1.500 259505 >> 49.070 1.506 1.503 24683960 >> 32.398 0.796 1.688 229957 >> 32.440 0.795 1.945 243148 >> 32.415 4.341 1.686 257823 >> 32.424 4.337 1.942 429753 >> 32.354 1.684 1.687 2110116 >> 32.410 1.940 1.688 1426408 >> 32.397 3.205 1.689 191964 >> 32.418 3.203 1.940 160804 >> 32.418 3.341 1.683 116178 >> 32.409 3.362 1.953 108465 >> 32.412 1.542 1.681 562093 >> 43.486 3.840 3.197 128991 >> 43.448 4.334 3.346 113079 >> 43.455 1.942 3.347 269808 >> 43.496 1.520 3.210 453876 >> 43.496 1.528 3.349 595727 >> 43.447 1.653 3.347 1024114 >> 53.030 3.840 1.638 110944 >> 53.036 4.350 1.534 301715 >> 53.060 4.340 1.641 281648 >> 53.031 3.204 1.531 272959 >> 53.058 3.208 1.641 268047 >> 53.074 3.351 1.535 307767 >> 53.057 3.346 1.645 401293 >> 53.025 1.548 1.534 2932420 >> 53.050 1.640 1.533 2522298 >> 53.047 1.932 1.528 399784 >> 53.043 1.928 1.644 376924 >> 41.099 3.408 2.857 377337 >> 41.092 4.337 2.851 252975 >> 41.109 0.580 2.847 210173 >> 41.094 0.797 2.856 426980 >> 41.079 1.347 2.853 245740 >> 41.096 -0.566 2.852 612273 >> 41.080 0.216 2.854 717527 >> 41.171 1.635 2.848 82031 >> 41.109 1.810 2.857 155999 >> 32.224 3.899 1.360 78109 >> 32.272 2.857 1.344 153498 >> 32.259 1.341 1.341 4042523 >> 32.249 -0.567 1.341 723987 >> 32.262 0.212 1.343 727540 >> 32.256 7.197 1.351 126930 >> 32.189 6.987 1.352 90181 >> 45.091 4.202 -0.568 257561 >> 45.082 1.112 -0.570 867161 >> 45.110 0.586 -0.569 595096 >> 45.068 2.855 -0.570 360949 >> 45.097 1.341 -0.569 761340 >> 45.087 -0.568 -0.570 18860724 >> 45.071 0.211 -0.570 1115072 >> 45.062 7.195 -0.573 171769 >> 45.089 6.963 -0.570 301031 >> 47.069 1.106 0.211 169483 >> 47.126 0.589 0.213 644797 >> 47.112 3.081 0.216 151327 >> 47.118 6.970 0.213 307158 >> 47.071 1.853 0.209 277071 >> 47.100 0.794 0.214 710483 >> 47.098 3.887 0.212 643580 >> 47.102 2.842 0.211 544991 >> 47.105 1.342 0.212 1058358 >> 47.104 -0.567 0.211 1417605 >> 47.107 0.212 0.212 20479000 >> 47.121 1.694 0.215 168286 >> 47.091 6.787 0.214 75604 >> 54.494 1.625 4.384 716500 >> 54.526 1.833 4.384 671234 >> 54.517 2.016 4.382 387756 >> 54.567 0.832 4.387 86363 >> 54.644 0.829 1.624 193637 >> 54.632 4.380 1.626 487960 >> 54.597 4.377 1.832 430691 >> 54.680 1.620 1.622 4276198 >> 54.622 1.626 1.830 2120926 >> 54.694 2.079 1.621 405023 >> 54.629 1.835 1.624 2399038 >> 54.631 0.836 1.825 281634 >> 36.076 4.376 1.986 295675 >> 35.850 4.383 2.055 363323 >> 36.043 1.633 1.986 490857 >> 36.050 1.629 2.086 409063 >> 36.032 1.839 1.987 991600 >> 36.054 1.843 2.088 799899 >> 36.025 0.837 1.990 310889 >> 36.062 0.842 2.086 270260 >> 33.740 4.205 5.422 577353 >> 33.697 1.109 5.426 133095 >> 33.787 -0.546 5.413 64462 >> 33.736 5.419 5.423 4792824 >> 33.728 2.713 5.424 232724 >> 33.747 2.892 5.423 349053 >> 33.756 6.965 5.423 326338 >> 33.754 0.809 5.411 139103 >> 41.070 2.089 2.722 389938 >> 41.072 2.109 2.889 138127 >> 41.164 1.571 2.717 99005 >> 41.108 1.574 2.898 90450 >> 41.158 5.416 2.706 178575 >> 41.138 5.418 2.896 207224 >> 41.130 6.975 2.720 376063 >> 41.155 6.972 2.897 257148 >> 34.974 1.581 4.710 173862 >> 34.934 2.267 4.718 1047712 >> 34.935 0.845 4.716 1375072 >> 34.927 1.731 4.717 110025 >> 35.777 4.715 2.266 645336 >> 35.847 2.267 2.266 7020551 >> 35.820 0.830 2.267 1658409 >> 45.710 1.676 0.857 133526 >> 45.587 1.841 0.879 108635 >> 45.734 1.546 0.860 213153 >> 45.706 4.381 0.856 121095 >> 45.739 1.994 0.856 184981 >> 45.735 4.712 0.860 870900 >> 45.734 2.265 0.858 1352582 >> 42.977 1.292 0.804 231737 >> 42.998 1.691 0.804 1410756 >> 42.940 2.959 0.801 155826 >> 42.985 1.525 0.803 540016 >> 42.986 4.704 0.802 285668 >> 42.989 2.266 0.803 1380923 >> 43.035 4.062 0.810 68971 >> 43.011 0.802 0.804 37510704 >> 31.727 1.674 4.473 235567 >> 31.716 0.827 4.473 217100 >> 41.686 0.964 1.661 611872 >> 41.713 0.824 1.666 622620 >> 49.701 3.961 0.963 199877 >> 49.632 4.138 0.971 63860 >> 49.754 2.124 0.967 192665 >> 49.747 0.968 0.965 46631508 >> 49.714 1.673 0.965 1051573 >> 51.647 4.145 1.725 156154 >> 51.222 0.827 1.744 714105 >> 53.781 1.689 4.059 748014 >> 53.796 2.955 4.058 240724 >> 53.771 0.817 4.061 202688 >> 53.769 1.294 4.060 1781450 >> 44.495 2.016 1.291 356268 >> 44.449 2.223 1.296 169142 >> 44.501 1.684 1.295 602631 >> 44.472 4.059 1.295 1421545 >> >>d2o_c13_noesy_arom.list >> w1 w2 w3 Data Height >> >> 119.675 3.069 6.941 142880 >> 132.019 7.305 6.989 356249 >> 129.075 1.147 6.963 91868 >> 131.872 2.059 6.984 99846 >> 131.529 0.664 7.295 67337 >> 120.676 0.876 6.882 183979 >> 117.562 6.976 6.767 2592443 >> 131.566 2.701 6.987 462329 >> 131.532 4.734 6.990 212074 >> 137.446 3.292 7.675 479896 >> 131.922 2.901 6.977 258027 >> 120.687 4.832 6.878 86897 >> 120.660 2.670 6.878 66699 >> 120.553 3.913 6.884 112565 >> 120.676 0.876 6.882 183979 >> 123.762 7.255 7.250 4460328 >> 123.679 3.384 7.252 113956 >> 131.572 1.661 7.182 117713 >> 131.656 5.219 7.182 144704 >> 131.636 3.026 7.185 300980 >> 131.622 6.973 7.206 1176357 >> 129.168 6.961 6.958 3196244 >> 129.178 7.206 6.959 804832 >> 119.704 4.485 6.931 114544 >> 119.713 6.940 6.936 25309256 >> 119.585 3.340 6.930 259914 >> 133.318 1.522 6.973 207272 >> 133.237 0.583 6.977 324400 >> 133.177 4.312 6.972 100428 >> 133.293 5.133 6.975 407622 >> 133.232 2.761 6.976 452131 >> 133.229 3.079 6.976 441548 >> 133.269 6.978 6.976 8128190 >> 133.239 6.771 6.976 2655838 >> 133.194 3.894 6.978 98511 >> 133.322 1.683 6.979 123766 >> 133.194 0.214 6.978 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156671 >> 131.567 7.298 7.296 8330254 >> 131.616 2.014 7.296 88058 >> 131.564 3.006 7.296 279362 >> 131.546 1.001 7.297 120448 >> 121.098 2.098 7.246 305832 >> 121.052 3.084 7.245 106068 >> 121.329 3.343 7.256 70475 >> 121.091 7.247 7.246 3902630 >> 117.889 4.678 7.181 424517 >> 117.945 3.107 7.184 107833 >> 117.828 3.425 7.183 165426 >> 117.872 7.184 7.182 4456732 >> 137.440 4.911 7.676 191507 >> 137.434 2.964 7.676 903296 >> 137.446 3.292 7.675 479896 >> 137.434 7.679 7.676 3754449 >> 128.997 1.341 6.951 83544 >> 129.090 -0.573 6.960 81376 >> 132.043 5.412 6.975 204167 >> 131.976 2.693 6.984 284296 >> 131.922 2.901 6.977 258027 >> 131.464 1.104 7.211 204713 >> 131.458 1.350 7.206 135458 >> 131.496 -0.533 7.207 53762 >> >>4d_ccnoesy.list >> w1 w2 w3 w4 Data Height >> >> 23.715 23.705 0.818 2.841 -55549 >> 34.070 21.781 1.557 4.363 98437 >> 34.070 23.670 0.821 4.363 -81431 >> 14.453 34.070 1.774 4.860 59234 >> 14.521 24.077 0.800 4.346 99641 >> 14.612 21.093 1.647 4.346 -84191 >> 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22.497 4.668 4.589 -86195 >> 23.563 16.136 4.478 0.831 -29023 >> 23.662 23.666 0.821 0.818 32572800 >> 26.100 23.512 1.855 0.744 -62420 >> 26.134 21.927 0.560 0.744 217432 >> 26.307 16.159 4.469 0.750 32794 >> 26.103 26.885 3.324 0.747 25051 >> 26.078 21.742 0.842 0.744 135389 >> 26.059 19.141 0.783 0.744 107133 >> 21.810 29.460 1.665 0.561 73432 >> 21.906 21.073 2.926 0.557 -39588 >> 21.934 32.170 4.595 0.559 -169122 >> 22.006 23.453 1.871 0.565 -34389 >> 21.951 23.513 0.835 0.560 -65014 >> 21.923 26.137 0.743 0.560 223189 >> 21.937 26.711 1.510 0.558 109326 >> 21.885 16.141 4.446 0.561 23254 >> 21.943 22.557 4.667 0.560 211246 >> 21.906 32.127 2.042 0.558 36178 >> 22.053 32.200 2.324 0.561 45959 >> 22.009 30.137 3.867 0.563 -23968 >> 21.989 28.214 1.863 0.562 47785 >> 21.841 28.052 2.282 0.563 26462 >> 21.892 19.076 0.789 0.560 87908 >> 21.644 21.628 0.561 0.559 15416826 >> 26.797 26.183 0.724 1.513 97845 >> 26.798 21.924 0.566 1.512 74480 >> 26.880 21.751 0.828 1.512 24550 >> 26.885 19.179 0.783 1.511 51323 >> 15.314 31.488 2.809 4.357 42485 >> 15.369 31.532 3.242 4.354 30928 >> 15.300 30.198 3.391 4.362 -42897 >> 15.264 30.223 4.282 4.359 -49222 >> 15.251 28.636 0.567 4.354 33731 >> 15.138 25.679 0.878 4.358 62413 >> 14.857 18.528 0.786 4.348 40000 >> 31.489 15.283 4.347 2.807 35029 >> 31.463 31.479 3.228 2.819 250589 >> 31.467 25.473 0.887 2.821 58247 >> 31.539 27.922 1.696 2.823 17001 >> 22.453 22.449 4.222 4.221 1237702 >> 22.491 31.971 1.879 4.220 67391 >> 22.489 32.045 2.350 4.223 75263 >> 22.392 30.794 1.600 4.230 31735 >> 22.374 15.346 2.047 4.223 -31140 >> 32.067 22.487 4.228 2.324 58295 >> 32.160 32.154 2.330 2.321 1233302 >> 30.360 15.189 4.358 4.302 -57141 >> 30.317 30.329 3.390 4.303 98616 >> 30.269 30.257 4.298 4.297 146985 >> 30.334 30.233 0.646 4.298 18808 >> 30.098 18.287 0.789 4.306 -33517 >> 30.267 30.303 3.401 3.397 335275 >> 30.089 26.864 1.814 4.306 -39738 >> 27.007 15.210 4.375 1.781 22783 >> 26.829 30.381 3.381 1.768 -32341 >> 26.920 30.258 4.285 1.772 -43314 >> 27.125 30.413 0.626 1.763 -25375 >> 26.899 18.254 0.779 1.783 35541 >> 26.933 32.083 1.887 1.779 72605 >> 15.209 15.210 4.533 4.532 15670224 >> 14.862 19.894 1.068 4.507 -41521 >> 15.053 20.024 1.585 4.500 -56732 >> 16.885 16.874 4.883 4.885 830157 >> 16.821 32.778 2.942 4.883 71027 >> 17.001 32.757 3.261 4.885 84383 >> 17.064 34.070 0.633 4.884 -25124 >> 32.701 16.966 4.893 2.940 46020 >> 32.662 16.966 4.879 3.277 56710 >> 32.712 32.762 2.940 3.260 106924 >> 32.818 34.070 0.666 2.934 -51649 >> 16.142 26.599 3.317 4.470 93246 >> 26.616 16.236 4.466 3.323 83727 >> 26.672 26.683 3.322 3.322 664832 >> 16.204 16.193 -0.078 6.913 3868332 >> 28.589 32.744 4.827 2.086 -33973 >> 28.201 17.923 0.257 2.074 -22363 >> 22.529 32.135 4.592 4.666 -92928 >> 22.572 21.942 0.562 4.671 141936 >> 22.560 22.542 4.666 4.668 780251 >> 22.464 32.232 2.051 4.665 42429 >> 22.588 32.109 2.335 4.664 71690 >> 32.180 21.881 0.559 2.321 30939 >> 32.186 22.555 4.662 2.320 78391 >> 32.080 30.302 3.801 2.331 -18441 >> 32.191 28.187 1.883 2.316 58607 >> 32.163 28.219 2.288 2.319 70358 >> 28.183 32.176 2.057 2.291 109253 >> 28.252 32.180 2.319 2.291 84185 >> 28.181 30.224 3.815 2.293 -69305 >> 28.195 28.201 1.872 2.292 246462 >> 28.203 28.203 2.292 2.292 650221 >> 34.070 34.070 4.533 4.531 1368944 >> 34.070 22.729 1.500 4.523 45830 >> 34.070 28.834 0.575 4.529 -26825 >> 34.070 25.564 0.881 4.528 -118270 >> 34.070 27.639 1.660 4.525 -36749 >> 34.070 16.764 4.776 4.534 -38219 >> 22.686 34.070 4.510 1.525 35184 >> 22.737 28.533 0.561 1.520 -26462 >> 22.558 25.656 0.865 1.493 -27516 >> 28.623 21.097 1.089 0.570 120367 >> 28.657 15.281 4.367 0.570 55639 >> 28.537 34.070 4.542 0.571 -25205 >> 28.623 28.621 0.569 0.569 2436841 >> 28.602 25.553 0.885 0.570 136447 >> 28.415 27.743 1.662 0.566 76518 >> 28.608 20.495 2.738 0.567 -61938 >> 28.793 20.480 3.051 0.564 -47593 >> 28.699 29.952 -0.038 0.575 -40382 >> 28.436 17.292 1.833 0.568 -29956 >> 28.692 18.208 0.792 0.570 27895 >> 28.686 21.171 6.418 0.568 131715 >> 28.663 23.135 0.193 0.567 118705 >> 28.695 22.657 1.508 0.570 -66298 >> 25.520 15.228 4.356 0.878 71596 >> 25.494 31.467 2.817 0.877 73033 >> 25.603 31.487 3.256 0.875 53049 >> 25.539 34.070 4.522 0.878 -124012 >> 25.558 28.615 0.569 0.878 132836 >> 25.547 27.693 1.663 0.877 88771 >> 25.537 20.546 2.747 0.872 -29520 >> 25.512 16.830 4.779 0.878 114768 >> 25.511 29.706 2.757 0.880 56137 >> 25.460 17.279 1.857 0.873 -17715 >> 27.859 28.526 0.538 1.708 24880 >> 20.922 20.930 4.291 4.291 1191128 >> 20.742 32.250 2.004 4.290 44536 >> 20.898 21.690 0.693 4.293 124681 >> 20.959 20.973 1.040 4.292 114195 >> 20.973 16.065 5.134 4.294 68111 >> 21.031 29.608 -0.040 4.288 -33080 >> 21.698 20.956 4.290 0.693 159911 >> 21.689 32.166 2.002 0.692 258435 >> 21.677 21.681 0.692 0.693 10233246 >> 21.592 21.164 2.918 0.692 -68722 >> 21.555 25.499 1.332 0.692 67371 >> 21.681 15.907 5.130 0.693 22927 >> 21.700 14.036 -0.255 0.694 -55522 >> 20.975 20.936 4.291 1.035 175742 >> 20.959 32.175 2.001 1.033 215475 >> 20.995 21.667 0.690 1.033 371862 >> 20.937 20.940 1.038 1.036 11559670 >> 20.933 16.031 5.113 1.034 23569 >> 20.981 29.824 -0.046 1.035 -84603 >> 21.020 14.036 -0.252 1.037 -114727 >> 32.983 21.849 1.336 4.536 68366 >> 33.065 21.843 1.601 4.536 46579 >> 32.981 25.609 0.686 4.548 -32589 >> 33.006 23.550 0.660 4.533 -137100 >> 32.843 26.919 1.377 4.534 -39860 >> 32.951 32.945 4.548 4.546 2200747 >> 25.567 29.484 2.371 0.637 27822 >> 25.652 32.954 4.533 0.634 -25770 >> 25.592 21.859 1.600 0.632 -88981 >> 25.598 26.957 1.393 0.630 152865 >> 25.421 24.779 2.491 0.632 -24111 >> 25.607 23.759 2.693 0.637 -54732 >> 25.579 23.840 2.953 0.637 -29811 >> 25.470 28.270 -0.032 0.651 -20874 >> 23.619 29.646 2.375 0.654 25732 >> 23.634 34.070 2.298 0.654 29804 >> 23.851 21.744 0.691 0.693 269380 >> 23.526 32.922 4.536 0.657 -162106 >> 23.523 21.878 1.334 0.657 -66315 >> 23.622 21.879 1.604 0.656 -49388 >> 23.555 26.949 1.389 0.654 130725 >> 26.863 34.070 2.277 1.386 19894 >> 27.027 21.861 1.595 1.398 -112244 >> 26.982 25.589 0.636 1.398 105781 >> 26.994 23.578 0.663 1.385 74317 >> 14.461 25.453 1.308 4.859 48720 >> 14.409 20.183 4.601 4.854 74521 >> 14.492 21.218 0.576 4.855 30042 >> 14.528 21.132 0.747 4.862 37116 >> 31.435 31.436 4.545 4.544 3418776 >> 31.414 20.940 1.342 4.544 -222025 >> 20.914 31.428 4.543 1.342 -311482 >> 20.926 20.928 1.342 1.343 14055340 >> 30.568 30.563 4.642 4.642 2074944 >> 30.567 21.365 1.400 4.642 -208119 >> 30.547 20.997 0.791 4.648 -18825 >> 21.393 30.545 4.640 1.403 -264854 >> 21.368 21.353 1.401 1.403 12765458 >> 20.260 14.490 4.864 4.596 96408 >> 20.146 20.138 4.600 4.598 1502673 >> 20.145 34.070 1.811 4.597 54132 >> 20.155 21.391 0.566 4.597 91453 >> 20.153 21.162 0.747 4.598 122742 >> 21.652 14.467 4.869 0.555 35090 >> 21.324 20.173 4.599 0.557 128943 >> 21.377 34.070 1.817 0.556 211061 >> 21.101 14.541 4.868 0.748 40234 >> 21.176 25.546 1.308 0.753 66120 >> 21.145 30.223 4.647 0.753 -23831 >> 21.156 20.165 4.600 0.751 145759 >> 21.154 34.070 1.817 0.749 214107 >> 21.151 21.148 0.752 0.751 15416688 >> 32.178 24.891 2.505 5.059 96644 >> 32.346 24.881 0.959 5.054 -21171 >> 24.942 25.601 0.650 2.512 -24344 >> 24.853 32.190 5.054 2.510 84343 >> 24.886 24.899 2.496 2.509 425802 >> 24.982 24.913 0.952 2.502 -108778 >> 16.006 20.961 4.299 5.110 56224 >> 16.019 16.010 5.122 5.122 1254871 >> 16.008 20.468 2.734 5.128 -59467 >> 16.087 20.400 3.034 5.122 -64827 >> 15.987 29.947 -0.044 5.125 -51787 >> 29.932 28.494 0.563 6.959 -30134 >> 30.283 21.070 4.273 6.954 -17727 >> 30.076 15.999 5.134 6.953 -51674 >> 29.655 20.522 2.744 6.951 65529 >> 29.923 20.533 3.059 6.951 58402 >> 29.884 29.878 -0.040 6.952 1123082 >> 29.883 14.036 -0.251 6.953 281934 >> 29.973 23.058 0.202 6.954 -38482 >> 29.801 21.031 1.059 6.953 -114733 >> 14.036 21.673 0.689 6.747 -62030 >> 14.036 21.365 0.571 6.740 -48357 >> 14.036 16.227 5.100 6.747 -16081 >> 14.036 29.893 -0.041 6.743 368299 >> 14.036 14.036 -0.251 6.744 2618571 >> 14.036 19.206 3.869 6.742 -24892 >> 14.036 32.285 2.200 6.744 -37869 >> 14.036 29.535 1.930 6.746 -33121 >> 14.409 25.459 1.665 6.736 -22468 >> 14.036 23.216 0.168 6.742 -27805 >> 14.036 21.032 1.059 6.744 -183085 >> 15.236 15.233 5.066 5.066 866867 >> 15.219 23.770 2.679 5.067 -85561 >> 15.241 23.660 2.960 5.068 -49050 >> 15.283 28.097 -0.032 5.075 -28837 >> 15.278 14.404 4.729 5.064 88398 >> 15.262 24.931 0.953 5.067 28346 >> 26.514 26.488 0.283 7.275 524630 >> 28.254 25.623 0.645 6.962 -24593 >> 28.259 15.253 5.043 6.967 -31524 >> 28.080 23.715 2.674 6.960 43073 >> 28.201 23.760 2.954 6.969 35642 >> 28.316 15.345 4.161 6.966 -23531 >> 27.854 14.378 4.707 6.960 -29641 >> 28.301 21.906 1.702 6.968 18442 >> 28.108 27.467 1.704 6.975 -18913 >> 28.025 24.920 0.974 6.965 -44055 >> 28.278 28.257 -0.033 6.961 1086759 >> 27.973 26.583 0.280 7.272 235416 >> 28.584 28.196 -0.020 7.280 38470 >> 28.220 28.220 0.288 7.273 521753 >> 28.412 15.322 4.165 7.269 -33931 >> 28.192 25.133 2.983 7.277 21869 >> 29.662 25.543 0.890 2.767 53695 >> 29.714 16.847 4.780 2.794 35798 >> 29.820 30.315 3.394 2.776 25669 >> 29.481 30.424 0.622 2.766 -23016 >> 15.386 28.290 0.279 4.175 -31335 >> 15.320 15.319 4.178 4.174 1984513 >> 15.364 28.982 1.991 4.172 85408 >> 15.242 33.585 1.992 4.177 30526 >> 15.511 34.070 2.271 4.167 40013 >> 28.957 33.706 2.008 2.010 243148 >> 28.946 34.070 2.257 2.011 142100 >> 14.036 30.360 3.293 4.567 69359 >> 14.036 14.036 4.601 4.603 1822150 >> 18.442 18.406 4.655 4.652 802268 >> 18.577 30.303 3.065 4.669 42363 >> 18.570 30.191 3.405 4.659 72652 >> 18.461 14.573 0.166 4.653 -40965 >> 30.205 18.527 4.660 3.073 31463 >> 30.158 18.551 4.659 3.403 64435 >> 30.197 30.153 3.084 3.407 115435 >> 30.259 30.441 0.617 3.089 -32903 >> 14.557 18.482 4.659 7.161 -90994 >> 14.609 30.143 3.417 7.161 -31341 >> 14.565 14.567 0.167 7.160 779178 >> 34.070 16.911 4.893 7.649 -22324 >> 34.070 32.757 2.934 7.645 -49548 >> 34.070 32.677 3.237 7.644 -33545 >> 14.537 15.084 5.065 4.715 106801 >> 14.473 14.468 4.717 4.713 1270920 >> 14.511 21.768 1.700 4.713 -133635 >> 14.512 24.923 0.982 4.714 125639 >> 24.991 24.989 0.989 0.985 21055650 >> 25.011 27.491 1.702 0.981 192995 >> 24.953 32.235 5.072 0.989 -24506 >> 24.907 24.890 2.513 0.979 -58848 >> 24.765 15.134 5.072 0.971 33447 >> 24.732 23.784 2.679 0.975 -39292 >> 25.098 23.863 2.943 0.967 -33676 >> 24.911 21.748 1.700 0.981 -268780 >> 24.893 28.266 -0.036 0.976 -39994 >> 24.781 14.486 4.716 0.971 116062 >> 27.541 14.446 4.703 1.706 27853 >> 27.335 21.740 1.699 1.704 -692338 >> 27.483 25.006 0.984 1.711 197013 >> 15.847 17.381 1.832 4.267 -38363 >> 15.914 30.540 0.627 4.271 -105071 >> 15.816 18.279 0.781 4.271 108666 >> 30.524 30.323 4.303 0.625 31896 >> 30.668 25.465 0.890 0.626 -42192 >> 30.561 29.658 2.789 0.619 -34687 >> 30.622 30.072 3.079 0.624 -23487 >> 30.525 29.923 3.417 0.621 -20223 >> 30.554 15.879 4.275 0.623 -155275 >> 30.556 30.554 0.624 0.624 4370716 >> 30.556 27.235 1.238 0.623 -74334 >> 30.505 27.110 1.822 0.622 -92487 >> 30.577 18.263 0.785 0.624 -157603 >> 27.219 30.565 0.618 1.831 -40523 >> 27.294 27.237 1.242 1.835 81396 >> 18.303 15.075 4.349 0.777 64468 >> 18.372 30.261 3.396 0.778 -39736 >> 18.288 30.339 4.297 0.780 -36713 >> 18.355 28.621 0.571 0.779 29660 >> 18.301 15.852 4.273 0.778 119970 >> 18.322 17.245 1.833 0.779 -131194 >> 18.236 30.582 0.621 0.776 -113635 >> 18.303 27.126 1.258 0.777 33329 >> 18.403 32.676 1.679 0.782 43403 >> 18.341 32.478 1.924 0.778 41405 >> 18.124 23.744 2.852 0.782 67263 >> 18.259 23.137 0.195 0.779 141863 >> 18.275 27.017 1.814 0.779 54385 >> 17.253 17.252 4.438 4.436 21994380 >> 17.248 22.383 3.845 4.433 663149 >> 17.092 22.265 4.066 4.424 218105 >> 22.384 17.224 4.425 3.821 411396 >> 22.311 17.070 4.425 4.077 166979 >> 22.296 22.309 3.806 4.080 572754 >> 22.273 22.283 4.074 4.074 2857244 >> 22.683 22.679 3.193 4.099 -56340 >> 19.085 19.093 3.868 3.868 1286265 >> 19.210 32.347 2.211 3.878 83290 >> 19.070 23.071 0.200 3.868 109321 >> 32.378 16.532 4.193 1.832 75963 >> 32.393 25.072 1.491 1.835 109061 >> 14.675 14.668 4.329 4.330 3731732 >> 14.638 32.411 1.668 4.324 47583 >> 14.649 32.442 1.930 4.321 82996 >> 14.576 29.012 1.521 4.318 68929 >> 23.806 28.419 0.564 2.853 27971 >> 23.635 18.278 0.775 2.830 51900 >> 23.738 23.732 2.840 2.836 962290 >> 23.771 32.262 1.338 2.852 35500 >> 23.695 21.184 6.415 2.842 82770 >> 23.733 23.171 0.201 2.836 114778 >> 32.281 32.267 1.331 1.328 594898 >> 32.278 21.110 6.414 1.329 107643 >> 32.270 23.154 0.200 1.332 99453 >> 21.137 30.296 4.170 -0.586 -53316 >> 21.179 21.140 1.100 -0.583 155799 >> 21.158 28.635 0.568 -0.585 90846 >> 21.300 18.420 0.771 -0.574 25815 >> 21.158 23.719 2.837 -0.582 67882 >> 21.132 32.269 1.326 -0.583 139450 >> 21.149 21.145 6.412 -0.583 4249194 >> 21.152 23.126 0.194 -0.583 199358 >> 21.058 25.855 -0.055 -0.579 -19722 >> 22.825 29.989 4.187 0.197 -17236 >> 23.041 21.011 1.088 0.205 36064 >> 23.129 28.637 0.572 0.198 92335 >> 23.120 30.030 -0.037 0.207 -44865 >> 23.193 17.257 1.832 0.200 -38008 >> 23.120 18.213 0.782 0.199 110166 >> 23.180 19.064 3.868 0.199 125620 >> 23.103 23.739 2.840 0.199 131746 >> 23.124 32.273 1.326 0.198 146088 >> 23.137 21.165 6.416 0.198 230320 >> 23.137 23.131 0.197 0.198 4535481 >> 34.070 30.689 1.600 4.362 -71317 >> 34.070 30.733 1.812 4.363 -72031 >> 34.070 15.345 2.012 4.363 51935 >> 15.325 22.394 4.235 2.078 -21983 >> 15.421 34.070 4.364 2.071 31339 >> 15.325 30.798 1.606 2.077 -59790 >> 15.502 30.689 1.839 2.083 -120791 >> 15.378 15.381 2.066 2.073 979724 >> 16.473 30.245 4.186 5.395 -76385 >> 16.498 21.240 1.098 5.402 17909 >> 16.426 16.443 5.390 5.392 624814 >> 16.681 20.479 2.691 5.393 -29259 >> 16.461 20.494 2.878 5.393 -43402 >> 16.371 28.671 -0.057 5.386 -29481 >> 20.705 17.329 1.571 2.855 -25621 >> 20.547 16.523 5.374 2.859 -50591 >> 25.699 21.058 6.401 6.932 -24561 >> 28.663 20.551 2.849 6.946 31504 >> 28.195 28.135 0.158 6.962 196793 >> 28.023 21.133 1.085 7.185 -43154 >> 28.300 14.036 -0.244 7.183 25474 >> 28.172 21.048 6.414 7.189 -29851 >> 17.812 17.683 1.545 4.685 19666 >> 17.531 15.208 2.247 4.690 -113496 >> 17.610 21.770 0.841 4.690 145034 >> 17.658 19.154 0.786 4.687 55009 >> 15.254 17.592 4.691 2.242 -80812 >> 15.247 21.780 0.843 2.244 -178550 >> 15.173 19.102 0.785 2.243 -126227 >> 21.800 23.670 1.891 0.837 -14735 >> 21.727 23.908 0.849 0.844 -439478 >> 21.828 26.113 0.742 0.841 128849 >> 21.794 26.618 1.501 0.848 25488 >> 21.799 15.285 2.011 0.842 -51339 >> 21.811 17.628 4.687 0.842 141541 >> 21.799 15.232 2.238 0.842 -245033 >> 19.122 14.036 1.663 0.786 -116982 >> 18.968 29.459 1.648 0.788 42788 >> 19.100 21.061 2.928 0.785 -47326 >> 19.153 24.783 1.428 0.785 31157 >> 19.085 26.142 0.745 0.785 117886 >> 19.080 26.709 1.506 0.784 49585 >> 19.076 17.647 4.686 0.788 63626 >> 19.090 15.200 2.243 0.785 -196573 >> 19.063 21.671 0.851 0.785 242493 >> 18.948 20.956 1.632 0.780 -22383 >> 18.675 18.699 0.786 0.785 7568708 >> 14.627 21.084 1.626 4.452 -23155 >> 21.121 25.579 0.948 1.651 -109068 >> 25.645 32.727 2.419 0.941 15338 >> 25.710 30.981 3.934 0.950 -31037 >> 25.727 27.413 2.109 0.944 37953 >> 25.846 18.492 0.833 0.942 46634 >> 25.657 21.149 1.657 0.948 -186406 >> 25.416 27.388 1.717 0.948 151145 >> 23.758 17.380 1.575 0.839 41336 >> 27.231 24.031 0.813 1.738 64692 >> 33.271 29.504 1.685 4.044 -29025 >> 33.367 21.063 2.956 4.040 37425 >> 32.931 32.927 4.034 4.034 3279814 >> 33.140 20.499 1.278 4.040 -207970 >> 20.490 30.262 1.999 1.275 52898 >> 20.605 16.103 2.198 1.276 -48085 >> 20.515 34.070 1.668 1.281 37753 >> 20.409 29.541 1.680 1.276 48831 >> 20.534 21.144 2.944 1.273 -30119 >> 20.547 33.137 4.040 1.276 -221122 >> 20.533 20.527 1.278 1.278 16942376 >>; >> >> loop_ >> _Spectral_dim.ID >> _Spectral_dim.Atom_type >> _Spectral_dim.Atom_isotope_number >> _Spectral_dim.Spectral_region >> _Spectral_dim.Magnetization_linkage_ID >> _Spectral_dim.Sweep_width >> _Spectral_dim.Sweep_width_units >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 H . 18 . . . 15100 1 >> 2 H 1 H . 13 . . . 15100 1 >> 3 N 15 HN . 16.6 . . . 15100 1 >> >> stop_ >> >>save_ >> ; save_