data_30625 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Antimicrobial lasso peptide ubonodin ; _BMRB_accession_number 30625 _BMRB_flat_file_name bmr30625.str _Entry_type original _Submission_date 2019-07-05 _Accession_date 2019-07-05 _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 Link A. J. . 2 Cheung-Lee W. L. . 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" 158 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-12-02 original BMRB . stop_ _Original_release_date 2019-11-26 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Discovery of ubonodin, an antimicrobial lasso peptide active against members of the Burkholderia cepacia complex ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 31765515 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Cheung-Lee W. L. . 2 Parry M. E. . 3 Zong C. . . 4 Cartagena A. J. . 5 Darst S. A. . 6 Connell N. D. . 7 Russo R. . . 8 Link A. J. . stop_ _Journal_abbreviation Chembiochem. _Journal_volume . _Journal_issue . _Journal_CSD 0353 _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year 2019 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Ubonodin _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label entity_1 $entity_1 stop_ _System_molecular_weight . _System_oligomer_state ? _System_paramagnetic no _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 entity_1 _Molecular_mass 3220.489 _Mol_thiol_state 'not present' _Details 'Isopeptide bond between N-terminus and glutamic acid side chain' ############################## # Polymer residue sequence # ############################## _Residue_count 28 _Mol_residue_sequence ; GGDGSIAEYFNRPMHIHDWQ IMDSGYYG ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 GLY 3 ASP 4 GLY 5 SER 6 ILE 7 ALA 8 GLU 9 TYR 10 PHE 11 ASN 12 ARG 13 PRO 14 MET 15 HIS 16 ILE 17 HIS 18 ASP 19 TRP 20 GLN 21 ILE 22 MET 23 ASP 24 SER 25 GLY 26 TYR 27 TYR 28 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_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 'Burkholderia ubonensis' 101571 Bacteria . Burkholderia ubonensis WJ58_02830 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' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '9 mg/mL Ubonodin, 95% H2O/5% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 9 mg/mL 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details '4.6 mg/mL Ubonodin, 95% H2O/5% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 4.6 mg/mL 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name 'MestreLab (Mnova / MestReNova / MestReC)' _Version 11.0 loop_ _Vendor _Address _Electronic_address 'Mestrelab Research' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_2 _Saveframe_category software _Name CYANA _Version 2.0 loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'structure calculation' stop_ _Details . save_ save_software_3 _Saveframe_category software _Name GROMACS _Version . loop_ _Vendor _Address _Electronic_address "HERMAN BERENDSEN'S GROUP" . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'AVANCE III' _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-1H_TOCSY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $sample_1 save_ save_2D_1H-1H_TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $sample_2 save_ save_2D_1H-1H_COSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H COSY' _Sample_label $sample_1 save_ save_2D_1H-1H_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_1 save_ save_2D_1H-1H_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_2 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' 0 . M pH 7 . pH pressure 1 . atm temperature 295.2 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_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 'Deuterium Oxide' H 2 protons ppm 4.8 na indirect . . . 1.0 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_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-1H TOCSY' '2D 1H-1H COSY' '2D 1H-1H NOESY' stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name entity_1 _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 1 GLY H H 7.834 0.000 . 2 1 1 GLY HA2 H 4.033 0.000 . 3 1 1 GLY HA3 H 3.817 0.000 . 4 2 2 GLY H H 8.545 0.000 . 5 2 2 GLY HA2 H 3.719 0.000 . 6 2 2 GLY HA3 H 4.407 0.000 . 7 3 3 ASP H H 8.635 0.000 . 8 3 3 ASP HA H 5.043 0.000 . 9 3 3 ASP HB2 H 2.742 0.000 . 10 3 3 ASP HB3 H 2.639 0.000 . 11 4 4 GLY H H 8.033 0.000 . 12 4 4 GLY HA2 H 3.959 0.000 . 13 4 4 GLY HA3 H 3.623 0.000 . 14 5 5 SER H H 7.208 0.000 . 15 5 5 SER HA H 4.287 0.000 . 16 5 5 SER HB2 H 3.676 0.000 . 17 5 5 SER HB3 H 3.615 0.000 . 18 6 6 ILE H H 8.609 0.000 . 19 6 6 ILE HA H 4.131 0.000 . 20 6 6 ILE HB H 0.824 0.000 . 21 6 6 ILE HG12 H 1.243 0.000 . 22 6 6 ILE HG13 H 0.694 0.000 . 23 6 6 ILE HG2 H 0.768 0.000 . 24 6 6 ILE HD1 H 0.506 0.000 . 25 7 7 ALA H H 8.692 0.000 . 26 7 7 ALA HA H 3.730 0.000 . 27 7 7 ALA HB H 1.074 0.000 . 28 8 8 GLU H H 7.974 0.000 . 29 8 8 GLU HA H 3.904 0.000 . 30 8 8 GLU HB2 H 1.598 0.000 . 31 8 8 GLU HB3 H 1.447 0.000 . 32 8 8 GLU HG2 H 1.935 0.000 . 33 8 8 GLU HG3 H 1.815 0.000 . 34 9 9 TYR H H 7.773 0.000 . 35 9 9 TYR HA H 4.336 0.000 . 36 9 9 TYR HB2 H 2.775 0.000 . 37 9 9 TYR HB3 H 2.683 0.000 . 38 9 9 TYR HD1 H 6.783 0.000 . 39 9 9 TYR HD2 H 6.783 0.000 . 40 9 9 TYR HE1 H 6.590 0.000 . 41 9 9 TYR HE2 H 6.590 0.000 . 42 10 10 PHE H H 7.743 0.000 . 43 10 10 PHE HA H 4.366 0.000 . 44 10 10 PHE HB2 H 2.936 0.000 . 45 10 10 PHE HB3 H 2.786 0.000 . 46 10 10 PHE HD1 H 7.024 0.000 . 47 10 10 PHE HD2 H 7.024 0.000 . 48 10 10 PHE HE1 H 7.138 0.000 . 49 10 10 PHE HE2 H 7.138 0.000 . 50 10 10 PHE HZ H 7.065 0.000 . 51 11 11 ASN H H 8.125 0.000 . 52 11 11 ASN HA H 4.459 0.000 . 53 11 11 ASN HB2 H 2.604 0.000 . 54 11 11 ASN HB3 H 2.460 0.000 . 55 11 11 ASN HD21 H 7.310 0.000 . 56 11 11 ASN HD22 H 6.661 0.000 . 57 12 12 ARG H H 7.818 0.000 . 58 12 12 ARG HA H 4.328 0.000 . 59 12 12 ARG HB2 H 1.604 0.000 . 60 12 12 ARG HB3 H 1.486 0.000 . 61 12 12 ARG HG2 H 1.376 0.000 . 62 12 12 ARG HG3 H 1.376 0.000 . 63 12 12 ARG HD2 H 2.921 0.000 . 64 12 12 ARG HD3 H 2.921 0.000 . 65 12 12 ARG HE H 6.954 0.000 . 66 13 13 PRO HA H 4.168 0.000 . 67 13 13 PRO HB2 H 2.041 0.000 . 68 13 13 PRO HB3 H 1.645 0.000 . 69 13 13 PRO HG2 H 1.833 0.000 . 70 13 13 PRO HG3 H 1.776 0.000 . 71 13 13 PRO HD2 H 3.538 0.000 . 72 13 13 PRO HD3 H 3.359 0.000 . 73 14 14 MET H H 8.083 0.000 . 74 14 14 MET HA H 4.169 0.000 . 75 14 14 MET HB2 H 1.711 0.000 . 76 14 14 MET HB3 H 1.711 0.000 . 77 14 14 MET HG2 H 2.318 0.000 . 78 14 14 MET HG3 H 2.233 0.000 . 79 15 15 HIS H H 8.288 0.000 . 80 15 15 HIS HA H 4.484 0.000 . 81 15 15 HIS HB2 H 3.093 0.000 . 82 15 15 HIS HB3 H 2.979 0.000 . 83 15 15 HIS HD2 H 7.045 0.000 . 84 16 16 ILE H H 7.762 0.000 . 85 16 16 ILE HA H 3.974 0.000 . 86 16 16 ILE HB H 1.614 0.000 . 87 16 16 ILE HG12 H 1.124 0.000 . 88 16 16 ILE HG13 H 0.900 0.000 . 89 16 16 ILE HG2 H 0.626 0.000 . 90 16 16 ILE HD1 H 0.647 0.000 . 91 17 17 HIS H H 8.460 0.000 . 92 17 17 HIS HA H 4.427 0.000 . 93 17 17 HIS HB2 H 2.862 0.000 . 94 17 17 HIS HB3 H 2.862 0.000 . 95 17 17 HIS HD2 H 7.066 0.000 . 96 18 18 ASP H H 8.320 0.000 . 97 18 18 ASP HA H 4.466 0.000 . 98 18 18 ASP HB2 H 2.764 0.000 . 99 18 18 ASP HB3 H 2.642 0.000 . 100 19 19 TRP H H 7.809 0.000 . 101 19 19 TRP HA H 4.390 0.000 . 102 19 19 TRP HB2 H 3.146 0.000 . 103 19 19 TRP HB3 H 3.146 0.000 . 104 19 19 TRP HD1 H 7.123 0.000 . 105 19 19 TRP HE1 H 10.002 0.000 . 106 19 19 TRP HE3 H 7.371 0.000 . 107 19 19 TRP HZ2 H 7.219 0.000 . 108 19 19 TRP HZ3 H 6.955 0.000 . 109 19 19 TRP HH2 H 7.010 0.000 . 110 20 20 GLN H H 7.811 0.000 . 111 20 20 GLN HA H 3.983 0.000 . 112 20 20 GLN HB2 H 1.611 0.000 . 113 20 20 GLN HB3 H 1.731 0.000 . 114 20 20 GLN HG2 H 1.908 0.000 . 115 20 20 GLN HG3 H 1.694 0.000 . 116 21 21 ILE H H 7.689 0.000 . 117 21 21 ILE HA H 3.897 0.000 . 118 21 21 ILE HB H 1.657 0.000 . 119 21 21 ILE HG12 H 1.260 0.000 . 120 21 21 ILE HG13 H 0.963 0.000 . 121 21 21 ILE HG2 H 0.700 0.000 . 122 21 21 ILE HD1 H 0.685 0.000 . 123 22 22 MET H H 8.090 0.000 . 124 22 22 MET HA H 4.338 0.000 . 125 22 22 MET HB2 H 1.903 0.000 . 126 22 22 MET HB3 H 1.812 0.000 . 127 22 22 MET HG2 H 2.394 0.000 . 128 22 22 MET HG3 H 2.326 0.000 . 129 23 23 ASP H H 8.213 0.000 . 130 23 23 ASP HA H 4.629 0.000 . 131 23 23 ASP HB2 H 2.709 0.000 . 132 23 23 ASP HB3 H 2.614 0.000 . 133 24 24 SER H H 7.913 0.000 . 134 24 24 SER HA H 4.344 0.000 . 135 24 24 SER HB2 H 3.730 0.000 . 136 24 24 SER HB3 H 3.641 0.000 . 137 25 25 GLY H H 7.896 0.000 . 138 25 25 GLY HA2 H 3.837 0.000 . 139 25 25 GLY HA3 H 3.726 0.000 . 140 26 26 TYR H H 8.406 0.000 . 141 26 26 TYR HA H 5.241 0.000 . 142 26 26 TYR HB2 H 2.332 0.000 . 143 26 26 TYR HB3 H 2.332 0.000 . 144 26 26 TYR HD1 H 6.652 0.000 . 145 26 26 TYR HD2 H 6.652 0.000 . 146 26 26 TYR HE1 H 7.234 0.000 . 147 26 26 TYR HE2 H 7.234 0.000 . 148 27 27 TYR H H 9.512 0.000 . 149 27 27 TYR HA H 4.835 0.000 . 150 27 27 TYR HB2 H 2.971 0.000 . 151 27 27 TYR HB3 H 2.971 0.000 . 152 27 27 TYR HD1 H 6.832 0.000 . 153 27 27 TYR HD2 H 6.832 0.000 . 154 27 27 TYR HE1 H 6.638 0.000 . 155 27 27 TYR HE2 H 6.638 0.000 . 156 28 28 GLY H H 8.527 0.000 . 157 28 28 GLY HA2 H 3.837 0.000 . 158 28 28 GLY HA3 H 3.728 0.000 . stop_ save_ save_spectral_peak_list_1 _Saveframe_category spectral_peak_list _Details . _Experiment_label '2D 1H-1H NOESY' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H H 2 H H stop_ _Sample_label $sample_2 _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 30625 >> _Spectral_peak_list.ID 1 >> _Spectral_peak_list.Name . >> _Spectral_peak_list.Sample_ID 2 >> _Spectral_peak_list.Sample_label $sample_2 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 >> _Spectral_peak_list.Experiment_ID 5 >> _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' >> _Spectral_peak_list.Experiment_class . >> _Spectral_peak_list.Experiment_type . >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Chemical_shift_list . >> _Spectral_peak_list.Assigned_chem_shift_list_ID 1 >> _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 >> _Spectral_peak_list.Details . >> _Spectral_peak_list.Text_data_format text >> _Spectral_peak_list.Text_data >>; >># Number of dimensions 2 >> 1 7.223 10.003 1 U 27.630 0 e 0 0 0 >> 2 7.123 10.002 1 U 63.850 0 e 0 0 0 >> 3 7.114 9.979 1 U 18.750 0 e 0 0 0 >> 4 8.536 9.513 1 U 1.520 0 e 0 0 0 >> 5 7.210 9.513 1 U 2.710 0 e 0 0 0 >> 6 3.960 9.513 1 U 4.450 0 e 0 0 0 >> 7 8.609 9.512 1 U 46.690 0 e 0 0 0 >> 8 6.838 9.512 1 U 35.400 0 e 0 0 0 >> 9 6.655 9.512 1 U 17.490 0 e 0 0 0 >> 10 5.241 9.512 1 U 90.150 0 e 0 0 0 >> 11 4.835 9.512 1 U 26.080 0 e 0 0 0 >> 12 3.730 9.512 1 U 11.820 0 e 0 0 0 >> 13 2.971 9.512 1 U 23.030 0 e 0 0 0 >> 14 2.352 9.512 1 U 95.270 0 e 0 0 0 >> 15 1.813 9.512 1 U 6.010 0 e 0 0 0 >> 16 0.824 9.512 1 U 12.310 0 e 0 0 0 >> 17 7.974 9.511 1 U 2.210 0 e 0 0 0 >> 18 0.767 9.511 1 U 6.480 0 e 0 0 0 >> 19 6.657 8.692 1 U 24.460 0 e 0 0 0 >> 20 4.132 8.692 1 U 174.600 0 e 0 0 0 >> 21 3.730 8.692 1 U 39.310 0 e 0 0 0 >> 22 1.074 8.692 1 U 138.810 0 e 0 0 0 >> 23 0.823 8.692 1 U 6.530 0 e 0 0 0 >> 24 0.764 8.692 1 U 60.660 0 e 0 0 0 >> 25 0.697 8.691 1 U 2.910 0 e 0 0 0 >> 26 0.505 8.691 1 U 2.690 0 e 0 0 0 >> 27 8.032 8.635 1 U 2.640 0 e 0 0 0 >> 28 5.043 8.635 1 U 36.000 0 e 0 0 0 >> 29 2.742 8.635 1 U 26.790 0 e 0 0 0 >> 30 2.639 8.635 1 U 61.860 0 e 0 0 0 >> 31 4.404 8.634 1 U 63.790 0 e 0 0 0 >> 32 3.717 8.634 1 U 179.830 0 e 0 0 0 >> 33 2.335 8.633 1 U 1.520 0 e 0 0 0 >> 34 6.657 8.629 1 U 7.150 0 e 0 0 0 >> 35 3.609 8.610 1 U 15.220 0 e 0 0 0 >> 36 7.209 8.609 1 U 110.920 0 e 0 0 0 >> 37 6.657 8.609 1 U 18.250 0 e 0 0 0 >> 38 5.240 8.609 1 U 0.510 0 e 0 0 0 >> 39 4.288 8.609 1 U 11.600 0 e 0 0 0 >> 40 3.960 8.609 1 U 10.610 0 e 0 0 0 >> 41 3.680 8.609 1 U 22.830 0 e 0 0 0 >> 42 2.351 8.609 1 U 29.260 0 e 0 0 0 >> 43 1.243 8.609 1 U 38.810 0 e 0 0 0 >> 44 0.824 8.609 1 U 66.430 0 e 0 0 0 >> 45 0.768 8.609 1 U 29.860 0 e 0 0 0 >> 46 0.694 8.609 1 U 19.590 0 e 0 0 0 >> 47 0.506 8.609 1 U 9.000 0 e 0 0 0 >> 48 4.131 8.607 1 U 41.300 0 e 0 0 0 >> 49 3.727 8.607 1 U 53.060 0 e 0 0 0 >> 50 8.409 8.549 1 U 99.460 0 e 0 0 0 >> 51 7.895 8.548 1 U 0.550 0 e 0 0 0 >> 52 7.833 8.548 1 U 49.030 0 e 0 0 0 >> 53 4.035 8.548 1 U 16.430 0 e 0 0 0 >> 54 3.829 8.547 1 U 83.420 0 e 0 0 0 >> 55 2.339 8.547 1 U 1.080 0 e 0 0 0 >> 56 1.937 8.547 1 U 0.400 0 e 0 0 0 >> 57 1.813 8.547 1 U 4.380 0 e 0 0 0 >> 58 6.655 8.546 1 U 5.190 0 e 0 0 0 >> 59 4.407 8.545 1 U 45.200 0 e 0 0 0 >> 60 3.719 8.545 1 U 110.920 0 e 0 0 0 >> 61 2.977 8.544 1 U 46.530 0 e 0 0 0 >> 62 3.623 8.533 1 U 4.310 0 e 0 0 0 >> 63 6.650 8.531 1 U 4.390 0 e 0 0 0 >> 64 6.838 8.528 1 U 24.310 0 e 0 0 0 >> 65 4.834 8.528 1 U 95.540 0 e 0 0 0 >> 66 3.964 8.528 1 U 4.410 0 e 0 0 0 >> 67 2.980 8.528 1 U 113.200 0 e 0 0 0 >> 68 3.837 8.527 1 U 96.580 0 e 0 0 0 >> 69 3.728 8.527 1 U 111.350 0 e 0 0 0 >> 70 4.100 8.482 1 U 8.950 0 e 0 0 0 >> 71 7.764 8.462 1 U 15.020 0 e 0 0 0 >> 72 3.974 8.462 1 U 105.730 0 e 0 0 0 >> 73 2.862 8.462 1 U 61.580 0 e 0 0 0 >> 74 1.615 8.462 1 U 28.290 0 e 0 0 0 >> 75 1.124 8.462 1 U 0.880 0 e 0 0 0 >> 76 0.647 8.461 1 U 10.340 0 e 0 0 0 >> 77 4.427 8.460 1 U 47.850 0 e 0 0 0 >> 78 0.626 8.460 1 U 24.680 0 e 0 0 0 >> 79 8.318 8.459 1 U 37.670 0 e 0 0 0 >> 80 7.066 8.457 1 U 4.860 0 e 0 0 0 >> 81 4.697 8.454 1 U 5.160 0 e 0 0 0 >> 82 2.805 8.453 1 U 7.780 0 e 0 0 0 >> 83 3.972 8.443 1 U 47.840 0 e 0 0 0 >> 84 0.623 8.438 1 U 9.260 0 e 0 0 0 >> 85 7.045 8.434 1 U 3.130 0 e 0 0 0 >> 86 4.696 8.433 1 U 6.190 0 e 0 0 0 >> 87 5.043 8.407 1 U 1.710 0 e 0 0 0 >> 88 7.896 8.406 1 U 16.520 0 e 0 0 0 >> 89 6.658 8.406 1 U 41.930 0 e 0 0 0 >> 90 3.836 8.406 1 U 60.720 0 e 0 0 0 >> 91 3.722 8.406 1 U 113.350 0 e 0 0 0 >> 92 2.332 8.406 1 U 67.740 0 e 0 0 0 >> 93 7.833 8.405 1 U 5.980 0 e 0 0 0 >> 94 5.241 8.405 1 U 33.140 0 e 0 0 0 >> 95 1.811 8.405 1 U 1.470 0 e 0 0 0 >> 96 4.409 8.404 1 U 5.460 0 e 0 0 0 >> 97 4.430 8.370 1 U 15.830 0 e 0 0 0 >> 98 4.389 8.363 1 U 7.090 0 e 0 0 0 >> 99 1.765 8.363 1 U 1.570 0 e 0 0 0 >> 100 4.193 8.322 1 U 2.580 0 e 0 0 0 >> 101 4.431 8.320 1 U 104.670 0 e 0 0 0 >> 102 3.977 8.320 1 U 1.840 0 e 0 0 0 >> 103 2.868 8.320 1 U 26.250 0 e 0 0 0 >> 104 2.764 8.320 1 U 23.430 0 e 0 0 0 >> 105 2.642 8.320 1 U 29.070 0 e 0 0 0 >> 106 0.629 8.320 1 U 6.370 0 e 0 0 0 >> 107 7.807 8.319 1 U 29.150 0 e 0 0 0 >> 108 4.466 8.318 1 U 88.250 0 e 0 0 0 >> 109 8.149 8.288 1 U 2.140 0 e 0 0 0 >> 110 8.083 8.288 1 U 43.360 0 e 0 0 0 >> 111 7.763 8.288 1 U 24.560 0 e 0 0 0 >> 112 7.047 8.288 1 U 1.410 0 e 0 0 0 >> 113 4.484 8.288 1 U 62.670 0 e 0 0 0 >> 114 4.172 8.288 1 U 93.410 0 e 0 0 0 >> 115 3.093 8.288 1 U 20.060 0 e 0 0 0 >> 116 2.979 8.288 1 U 34.420 0 e 0 0 0 >> 117 1.711 8.288 1 U 31.580 0 e 0 0 0 >> 118 1.635 8.288 1 U 2.570 0 e 0 0 0 >> 119 8.095 8.213 1 U 68.860 0 e 0 0 0 >> 120 7.915 8.213 1 U 39.520 0 e 0 0 0 >> 121 4.339 8.213 1 U 106.580 0 e 0 0 0 >> 122 2.709 8.213 1 U 21.950 0 e 0 0 0 >> 123 2.614 8.213 1 U 33.720 0 e 0 0 0 >> 124 1.903 8.213 1 U 17.360 0 e 0 0 0 >> 125 1.812 8.213 1 U 12.870 0 e 0 0 0 >> 126 0.698 8.213 1 U 6.480 0 e 0 0 0 >> 127 4.629 8.211 1 U 40.740 0 e 0 0 0 >> 128 4.106 8.205 1 U 0.590 0 e 0 0 0 >> 129 3.964 8.172 1 U 0.580 0 e 0 0 0 >> 130 4.327 8.159 1 U 16.670 0 e 0 0 0 >> 131 4.459 8.126 1 U 47.230 0 e 0 0 0 >> 132 7.029 8.125 1 U 2.750 0 e 0 0 0 >> 133 2.460 8.125 1 U 31.130 0 e 0 0 0 >> 134 7.819 8.124 1 U 35.430 0 e 0 0 0 >> 135 7.745 8.124 1 U 23.230 0 e 0 0 0 >> 136 4.365 8.124 1 U 103.150 0 e 0 0 0 >> 137 2.935 8.124 1 U 14.200 0 e 0 0 0 >> 138 2.788 8.124 1 U 11.730 0 e 0 0 0 >> 139 2.604 8.124 1 U 25.580 0 e 0 0 0 >> 140 4.464 8.093 1 U 4.060 0 e 0 0 0 >> 141 7.690 8.090 1 U 22.570 0 e 0 0 0 >> 142 4.338 8.090 1 U 55.670 0 e 0 0 0 >> 143 3.982 8.090 1 U 0.760 0 e 0 0 0 >> 144 3.895 8.090 1 U 95.170 0 e 0 0 0 >> 145 2.394 8.090 1 U 9.720 0 e 0 0 0 >> 146 2.326 8.090 1 U 21.030 0 e 0 0 0 >> 147 1.903 8.090 1 U 26.690 0 e 0 0 0 >> 148 1.812 8.090 1 U 56.460 0 e 0 0 0 >> 149 0.696 8.090 1 U 26.780 0 e 0 0 0 >> 150 1.613 8.088 1 U 10.710 0 e 0 0 0 >> 151 1.651 8.086 1 U 38.150 0 e 0 0 0 >> 152 4.169 8.083 1 U 145.880 0 e 0 0 0 >> 153 2.233 8.083 1 U 8.840 0 e 0 0 0 >> 154 1.711 8.083 1 U 73.610 0 e 0 0 0 >> 155 2.318 8.082 1 U 24.770 0 e 0 0 0 >> 156 2.042 8.082 1 U 6.020 0 e 0 0 0 >> 157 1.824 8.061 1 U 3.170 0 e 0 0 0 >> 158 3.873 8.059 1 U 8.800 0 e 0 0 0 >> 159 7.212 8.033 1 U 0.900 0 e 0 0 0 >> 160 3.959 8.033 1 U 32.290 0 e 0 0 0 >> 161 6.657 8.032 1 U 12.760 0 e 0 0 0 >> 162 5.043 8.032 1 U 117.270 0 e 0 0 0 >> 163 3.623 8.032 1 U 42.230 0 e 0 0 0 >> 164 2.744 8.032 1 U 32.090 0 e 0 0 0 >> 165 2.640 8.032 1 U 17.170 0 e 0 0 0 >> 166 2.333 8.032 1 U 60.860 0 e 0 0 0 >> 167 3.726 8.030 1 U 8.030 0 e 0 0 0 >> 168 1.910 8.020 1 U 2.380 0 e 0 0 0 >> 169 3.904 7.975 1 U 29.230 0 e 0 0 0 >> 170 6.838 7.974 1 U 1.670 0 e 0 0 0 >> 171 5.241 7.974 1 U 61.800 0 e 0 0 0 >> 172 3.731 7.974 1 U 174.260 0 e 0 0 0 >> 173 2.344 7.974 1 U 0.550 0 e 0 0 0 >> 174 1.935 7.974 1 U 16.360 0 e 0 0 0 >> 175 1.815 7.974 1 U 50.300 0 e 0 0 0 >> 176 1.598 7.974 1 U 57.220 0 e 0 0 0 >> 177 1.447 7.974 1 U 17.120 0 e 0 0 0 >> 178 1.075 7.974 1 U 34.930 0 e 0 0 0 >> 179 7.830 7.973 1 U 32.810 0 e 0 0 0 >> 180 7.774 7.973 1 U 31.390 0 e 0 0 0 >> 181 6.656 7.973 1 U 15.730 0 e 0 0 0 >> 182 1.073 7.955 1 U 4.130 0 e 0 0 0 >> 183 1.927 7.954 1 U 0.770 0 e 0 0 0 >> 184 1.593 7.954 1 U 22.070 0 e 0 0 0 >> 185 1.814 7.953 1 U 11.590 0 e 0 0 0 >> 186 5.240 7.948 1 U 4.990 0 e 0 0 0 >> 187 4.624 7.948 1 U 3.790 0 e 0 0 0 >> 188 4.686 7.915 1 U 1.440 0 e 0 0 0 >> 189 4.630 7.915 1 U 74.580 0 e 0 0 0 >> 190 4.344 7.914 1 U 70.520 0 e 0 0 0 >> 191 2.711 7.914 1 U 10.630 0 e 0 0 0 >> 192 2.615 7.914 1 U 9.280 0 e 0 0 0 >> 193 6.657 7.913 1 U 2.310 0 e 0 0 0 >> 194 3.730 7.913 1 U 70.470 0 e 0 0 0 >> 195 3.641 7.913 1 U 27.410 0 e 0 0 0 >> 196 1.600 7.911 1 U 4.630 0 e 0 0 0 >> 197 4.412 7.902 1 U 2.780 0 e 0 0 0 >> 198 6.658 7.896 1 U 11.910 0 e 0 0 0 >> 199 3.837 7.896 1 U 78.500 0 e 0 0 0 >> 200 3.726 7.896 1 U 109.580 0 e 0 0 0 >> 201 4.345 7.895 1 U 103.570 0 e 0 0 0 >> 202 3.643 7.895 1 U 17.720 0 e 0 0 0 >> 203 1.594 7.892 1 U 12.290 0 e 0 0 0 >> 204 4.552 7.887 1 U 2.740 0 e 0 0 0 >> 205 4.624 7.883 1 U 11.170 0 e 0 0 0 >> 206 4.033 7.834 1 U 75.690 0 e 0 0 0 >> 207 3.817 7.834 1 U 77.720 0 e 0 0 0 >> 208 3.724 7.834 1 U 29.290 0 e 0 0 0 >> 209 1.937 7.833 1 U 61.380 0 e 0 0 0 >> 210 1.602 7.833 1 U 80.490 0 e 0 0 0 >> 211 1.445 7.833 1 U 18.000 0 e 0 0 0 >> 212 3.904 7.832 1 U 4.790 0 e 0 0 0 >> 213 1.813 7.832 1 U 28.640 0 e 0 0 0 >> 214 2.961 7.831 1 U 9.760 0 e 0 0 0 >> 215 6.654 7.830 1 U 7.460 0 e 0 0 0 >> 216 3.145 7.830 1 U 14.030 0 e 0 0 0 >> 217 4.328 7.819 1 U 59.030 0 e 0 0 0 >> 218 3.540 7.819 1 U 5.910 0 e 0 0 0 >> 219 3.359 7.818 1 U 0.890 0 e 0 0 0 >> 220 2.930 7.818 1 U 13.830 0 e 0 0 0 >> 221 2.606 7.818 1 U 13.810 0 e 0 0 0 >> 222 2.462 7.818 1 U 4.320 0 e 0 0 0 >> 223 1.604 7.818 1 U 109.190 0 e 0 0 0 >> 224 1.486 7.818 1 U 44.720 0 e 0 0 0 >> 225 1.376 7.818 1 U 28.830 0 e 0 0 0 >> 226 1.815 7.817 1 U 25.080 0 e 0 0 0 >> 227 6.654 7.813 1 U 7.530 0 e 0 0 0 >> 228 3.902 7.812 1 U 12.990 0 e 0 0 0 >> 229 0.687 7.812 1 U 4.710 0 e 0 0 0 >> 230 4.461 7.811 1 U 176.690 0 e 0 0 0 >> 231 3.983 7.811 1 U 51.500 0 e 0 0 0 >> 232 1.731 7.811 1 U 33.150 0 e 0 0 0 >> 233 1.694 7.811 1 U 24.240 0 e 0 0 0 >> 234 1.908 7.810 1 U 44.350 0 e 0 0 0 >> 235 4.390 7.809 1 U 127.140 0 e 0 0 0 >> 236 0.631 7.808 1 U 6.690 0 e 0 0 0 >> 237 7.369 7.806 1 U 7.670 0 e 0 0 0 >> 238 7.124 7.806 1 U 24.580 0 e 0 0 0 >> 239 3.146 7.806 1 U 99.030 0 e 0 0 0 >> 240 2.860 7.806 1 U 4.920 0 e 0 0 0 >> 241 2.638 7.806 1 U 18.650 0 e 0 0 0 >> 242 2.769 7.805 1 U 29.130 0 e 0 0 0 >> 243 6.790 7.774 1 U 16.140 0 e 0 0 0 >> 244 3.905 7.774 1 U 87.070 0 e 0 0 0 >> 245 3.729 7.774 1 U 2.470 0 e 0 0 0 >> 246 1.932 7.774 1 U 0.860 0 e 0 0 0 >> 247 1.447 7.774 1 U 20.000 0 e 0 0 0 >> 248 4.336 7.773 1 U 97.050 0 e 0 0 0 >> 249 2.775 7.773 1 U 50.520 0 e 0 0 0 >> 250 2.683 7.773 1 U 39.350 0 e 0 0 0 >> 251 1.815 7.773 1 U 0.810 0 e 0 0 0 >> 252 1.075 7.773 1 U 19.460 0 e 0 0 0 >> 253 7.123 7.768 1 U 0.610 0 e 0 0 0 >> 254 3.146 7.768 1 U 28.000 0 e 0 0 0 >> 255 1.710 7.763 1 U 6.980 0 e 0 0 0 >> 256 0.647 7.763 1 U 11.680 0 e 0 0 0 >> 257 4.484 7.762 1 U 82.960 0 e 0 0 0 >> 258 3.974 7.762 1 U 43.240 0 e 0 0 0 >> 259 3.093 7.762 1 U 10.570 0 e 0 0 0 >> 260 2.975 7.762 1 U 13.120 0 e 0 0 0 >> 261 1.614 7.762 1 U 77.880 0 e 0 0 0 >> 262 1.124 7.762 1 U 15.230 0 e 0 0 0 >> 263 0.900 7.762 1 U 23.970 0 e 0 0 0 >> 264 0.626 7.762 1 U 30.780 0 e 0 0 0 >> 265 4.170 7.761 1 U 0.610 0 e 0 0 0 >> 266 7.035 7.756 1 U 9.330 0 e 0 0 0 >> 267 1.075 7.748 1 U 7.380 0 e 0 0 0 >> 268 6.790 7.745 1 U 6.860 0 e 0 0 0 >> 269 2.683 7.744 1 U 20.270 0 e 0 0 0 >> 270 7.028 7.743 1 U 12.520 0 e 0 0 0 >> 271 4.366 7.743 1 U 67.840 0 e 0 0 0 >> 272 4.337 7.743 1 U 144.050 0 e 0 0 0 >> 273 3.905 7.743 1 U 13.990 0 e 0 0 0 >> 274 2.786 7.743 1 U 75.450 0 e 0 0 0 >> 275 2.936 7.742 1 U 27.020 0 e 0 0 0 >> 276 4.417 7.697 1 U 7.840 0 e 0 0 0 >> 277 1.906 7.690 1 U 0.640 0 e 0 0 0 >> 278 1.603 7.690 1 U 11.920 0 e 0 0 0 >> 279 7.593 7.689 1 U 2.710 0 e 0 0 0 >> 280 3.983 7.689 1 U 76.970 0 e 0 0 0 >> 281 1.735 7.689 1 U 11.330 0 e 0 0 0 >> 282 1.657 7.689 1 U 55.210 0 e 0 0 0 >> 283 1.260 7.689 1 U 17.650 0 e 0 0 0 >> 284 0.963 7.689 1 U 18.720 0 e 0 0 0 >> 285 0.700 7.689 1 U 22.270 0 e 0 0 0 >> 286 0.685 7.689 1 U 17.140 0 e 0 0 0 >> 287 3.897 7.688 1 U 27.730 0 e 0 0 0 >> 288 4.325 7.682 1 U 9.700 0 e 0 0 0 >> 289 1.658 7.657 1 U 2.680 0 e 0 0 0 >> 290 3.976 7.651 1 U 6.310 0 e 0 0 0 >> 291 6.773 7.436 1 U 6.170 0 e 0 0 0 >> 292 6.955 7.371 1 U 89.280 0 e 0 0 0 >> 293 7.007 7.370 1 U 5.520 0 e 0 0 0 >> 294 4.390 7.370 1 U 13.740 0 e 0 0 0 >> 295 3.982 7.369 1 U 6.190 0 e 0 0 0 >> 296 3.146 7.369 1 U 54.450 0 e 0 0 0 >> 297 0.632 7.369 1 U 0.390 0 e 0 0 0 >> 298 7.137 7.310 1 U 4.870 0 e 0 0 0 >> 299 6.661 7.310 1 U 538.860 0 e 0 0 0 >> 300 2.603 7.310 1 U 15.150 0 e 0 0 0 >> 301 2.460 7.310 1 U 16.160 0 e 0 0 0 >> 302 6.665 7.267 1 U 192.360 0 e 0 0 0 >> 303 7.141 7.265 1 U 15.770 0 e 0 0 0 >> 304 6.652 7.234 1 U 530.420 0 e 0 0 0 >> 305 1.909 7.234 1 U 19.440 0 e 0 0 0 >> 306 1.692 7.234 1 U 10.360 0 e 0 0 0 >> 307 4.692 7.232 1 U 9.930 0 e 0 0 0 >> 308 3.968 7.229 1 U 25.030 0 e 0 0 0 >> 309 6.955 7.219 1 U 14.310 0 e 0 0 0 >> 310 0.688 7.216 1 U 5.980 0 e 0 0 0 >> 311 7.010 7.215 1 U 68.670 0 e 0 0 0 >> 312 0.765 7.210 1 U 1.120 0 e 0 0 0 >> 313 1.244 7.209 1 U 1.370 0 e 0 0 0 >> 314 3.959 7.208 1 U 85.640 0 e 0 0 0 >> 315 3.729 7.208 1 U 1.580 0 e 0 0 0 >> 316 3.676 7.208 1 U 27.660 0 e 0 0 0 >> 317 3.615 7.208 1 U 78.290 0 e 0 0 0 >> 318 2.347 7.208 1 U 7.800 0 e 0 0 0 >> 319 4.287 7.207 1 U 17.490 0 e 0 0 0 >> 320 2.786 7.140 1 U 8.310 0 e 0 0 0 >> 321 1.075 7.140 1 U 1.730 0 e 0 0 0 >> 322 6.654 7.139 1 U 15.350 0 e 0 0 0 >> 323 4.354 7.139 1 U 13.270 0 e 0 0 0 >> 324 2.946 7.139 1 U 5.480 0 e 0 0 0 >> 325 2.933 7.139 1 U 7.570 0 e 0 0 0 >> 326 7.065 7.138 1 U 68.670 0 e 0 0 0 >> 327 7.024 7.138 1 U 68.670 0 e 0 0 0 >> 328 0.689 7.130 1 U 7.510 0 e 0 0 0 >> 329 1.901 7.125 1 U 0.390 0 e 0 0 0 >> 330 4.388 7.124 1 U 15.400 0 e 0 0 0 >> 331 1.611 7.124 1 U 0.790 0 e 0 0 0 >> 332 0.634 7.124 1 U 2.230 0 e 0 0 0 >> 333 4.465 7.123 1 U 4.640 0 e 0 0 0 >> 334 3.976 7.123 1 U 0.790 0 e 0 0 0 >> 335 3.146 7.123 1 U 51.170 0 e 0 0 0 >> 336 4.427 7.066 1 U 6.450 0 e 0 0 0 >> 337 2.861 7.065 1 U 23.510 0 e 0 0 0 >> 338 2.781 7.065 1 U 1.470 0 e 0 0 0 >> 339 0.627 7.065 1 U 8.060 0 e 0 0 0 >> 340 1.614 7.064 1 U 0.630 0 e 0 0 0 >> 341 6.654 7.063 1 U 9.110 0 e 0 0 0 >> 342 4.691 7.061 1 U 4.890 0 e 0 0 0 >> 343 0.629 7.053 1 U 1.700 0 e 0 0 0 >> 344 3.091 7.047 1 U 8.000 0 e 0 0 0 >> 345 1.713 7.047 1 U 5.790 0 e 0 0 0 >> 346 4.482 7.046 1 U 9.100 0 e 0 0 0 >> 347 2.976 7.046 1 U 17.400 0 e 0 0 0 >> 348 4.691 7.042 1 U 4.910 0 e 0 0 0 >> 349 4.364 7.028 1 U 53.200 0 e 0 0 0 >> 350 2.936 7.028 1 U 57.210 0 e 0 0 0 >> 351 2.789 7.028 1 U 52.960 0 e 0 0 0 >> 352 1.075 7.028 1 U 8.660 0 e 0 0 0 >> 353 0.762 7.028 1 U 1.830 0 e 0 0 0 >> 354 6.655 7.027 1 U 7.830 0 e 0 0 0 >> 355 2.763 7.002 1 U 2.100 0 e 0 0 0 >> 356 4.331 6.958 1 U 0.420 0 e 0 0 0 >> 357 2.921 6.955 1 U 56.290 0 e 0 0 0 >> 358 1.375 6.955 1 U 25.160 0 e 0 0 0 >> 359 6.659 6.954 1 U 20.940 0 e 0 0 0 >> 360 1.487 6.954 1 U 0.600 0 e 0 0 0 >> 361 1.606 6.953 1 U 5.070 0 e 0 0 0 >> 362 3.834 6.838 1 U 10.510 0 e 0 0 0 >> 363 5.241 6.837 1 U 5.360 0 e 0 0 0 >> 364 4.835 6.837 1 U 18.300 0 e 0 0 0 >> 365 3.730 6.837 1 U 19.050 0 e 0 0 0 >> 366 2.974 6.837 1 U 138.950 0 e 0 0 0 >> 367 1.938 6.837 1 U 45.820 0 e 0 0 0 >> 368 1.813 6.837 1 U 31.360 0 e 0 0 0 >> 369 1.448 6.837 1 U 2.680 0 e 0 0 0 >> 370 0.824 6.837 1 U 11.890 0 e 0 0 0 >> 371 3.906 6.836 1 U 49.300 0 e 0 0 0 >> 372 1.599 6.836 1 U 0.860 0 e 0 0 0 >> 373 0.765 6.836 1 U 22.300 0 e 0 0 0 >> 374 0.505 6.836 1 U 6.290 0 e 0 0 0 >> 375 6.638 6.832 1 U 325.080 0 e 0 0 0 >> 376 4.335 6.806 1 U 12.280 0 e 0 0 0 >> 377 4.335 6.789 1 U 43.730 0 e 0 0 0 >> 378 2.777 6.789 1 U 65.190 0 e 0 0 0 >> 379 2.683 6.789 1 U 74.070 0 e 0 0 0 >> 380 1.074 6.788 1 U 5.850 0 e 0 0 0 >> 381 6.590 6.783 1 U 308.560 0 e 0 0 0 >> 382 1.247 6.663 1 U 0.950 0 e 0 0 0 >> 383 2.745 6.661 1 U 4.420 0 e 0 0 0 >> 384 2.614 6.660 1 U 14.090 0 e 0 0 0 >> 385 3.730 6.659 1 U 135.600 0 e 0 0 0 >> 386 3.624 6.659 1 U 10.200 0 e 0 0 0 >> 387 2.343 6.659 1 U 218.920 0 e 0 0 0 >> 388 1.810 6.659 1 U 14.870 0 e 0 0 0 >> 389 1.075 6.659 1 U 78.000 0 e 0 0 0 >> 390 0.504 6.659 1 U 3.780 0 e 0 0 0 >> 391 4.339 6.658 1 U 14.680 0 e 0 0 0 >> 392 4.288 6.658 1 U 14.450 0 e 0 0 0 >> 393 4.132 6.658 1 U 19.210 0 e 0 0 0 >> 394 3.837 6.658 1 U 50.550 0 e 0 0 0 >> 395 2.963 6.658 1 U 6.630 0 e 0 0 0 >> 396 2.458 6.658 1 U 7.180 0 e 0 0 0 >> 397 1.598 6.658 1 U 5.510 0 e 0 0 0 >> 398 0.822 6.658 1 U 1.950 0 e 0 0 0 >> 399 0.766 6.658 1 U 38.820 0 e 0 0 0 >> 400 3.967 6.657 1 U 5.940 0 e 0 0 0 >> 401 0.691 6.657 1 U 16.690 0 e 0 0 0 >> 402 5.043 6.656 1 U 17.620 0 e 0 0 0 >> 403 4.696 6.656 1 U 30.590 0 e 0 0 0 >> 404 5.241 6.655 1 U 42.010 0 e 0 0 0 >> 405 4.625 6.654 1 U 2.510 0 e 0 0 0 >> 406 4.398 6.654 1 U 2.480 0 e 0 0 0 >> 407 1.908 6.653 1 U 17.820 0 e 0 0 0 >> 408 4.828 6.652 1 U 2.980 0 e 0 0 0 >> 409 2.774 6.652 1 U 6.250 0 e 0 0 0 >> 410 1.691 6.652 1 U 6.060 0 e 0 0 0 >> 411 2.973 6.638 1 U 16.000 0 e 0 0 0 >> 412 1.815 6.638 1 U 5.490 0 e 0 0 0 >> 413 4.694 6.637 1 U 2.240 0 e 0 0 0 >> 414 3.905 6.637 1 U 47.200 0 e 0 0 0 >> 415 3.836 6.637 1 U 12.800 0 e 0 0 0 >> 416 3.730 6.637 1 U 48.860 0 e 0 0 0 >> 417 2.340 6.637 1 U 38.080 0 e 0 0 0 >> 418 1.929 6.637 1 U 6.820 0 e 0 0 0 >> 419 0.824 6.637 1 U 11.480 0 e 0 0 0 >> 420 0.764 6.637 1 U 75.660 0 e 0 0 0 >> 421 0.690 6.637 1 U 7.900 0 e 0 0 0 >> 422 0.506 6.637 1 U 22.880 0 e 0 0 0 >> 423 1.074 6.636 1 U 14.100 0 e 0 0 0 >> 424 2.683 6.594 1 U 5.470 0 e 0 0 0 >> 425 4.336 6.593 1 U 9.290 0 e 0 0 0 >> 426 2.777 6.593 1 U 7.110 0 e 0 0 0 >> 427 1.074 6.590 1 U 11.940 0 e 0 0 0 >> 428 2.352 5.243 1 U 45.820 0 e 0 0 0 >> 429 1.812 5.242 1 U 24.530 0 e 0 0 0 >> 430 3.730 5.241 1 U 48.000 0 e 0 0 0 >> 431 2.643 5.045 1 U 16.190 0 e 0 0 0 >> 432 2.745 5.043 1 U 26.050 0 e 0 0 0 >> 433 2.621 5.042 1 U 1.670 0 e 0 0 0 >> 434 2.332 5.042 1 U 0.600 0 e 0 0 0 >> 435 2.625 4.468 1 U 2.420 0 e 0 0 0 >> 436 2.879 4.438 1 U 1.840 0 e 0 0 0 >> 437 2.848 4.426 1 U 16.400 0 e 0 0 0 >> 438 3.716 4.413 1 U 71.010 0 e 0 0 0 >> 439 3.715 4.385 1 U 39.940 0 e 0 0 0 >> 440 3.145 4.384 1 U 28.520 0 e 0 0 0 >> 441 2.788 4.366 1 U 22.760 0 e 0 0 0 >> 442 3.144 4.365 1 U 3.040 0 e 0 0 0 >> 443 2.939 4.364 1 U 18.170 0 e 0 0 0 >> 444 3.641 4.346 1 U 17.410 0 e 0 0 0 >> 445 3.729 4.345 1 U 27.370 0 e 0 0 0 >> 446 1.814 4.342 1 U 21.580 0 e 0 0 0 >> 447 1.608 4.341 1 U 6.270 0 e 0 0 0 >> 448 1.489 4.339 1 U 3.200 0 e 0 0 0 >> 449 1.906 4.338 1 U 22.930 0 e 0 0 0 >> 450 2.687 4.334 1 U 17.520 0 e 0 0 0 >> 451 2.777 4.332 1 U 25.410 0 e 0 0 0 >> 452 2.927 4.326 1 U 1.930 0 e 0 0 0 >> 453 1.606 4.326 1 U 19.990 0 e 0 0 0 >> 454 1.374 4.325 1 U 8.890 0 e 0 0 0 >> 455 3.540 4.323 1 U 30.850 0 e 0 0 0 >> 456 3.357 4.322 1 U 17.430 0 e 0 0 0 >> 457 3.677 4.286 1 U 29.030 0 e 0 0 0 >> 458 3.598 4.286 1 U 35.420 0 e 0 0 0 >> 459 1.711 4.175 1 U 75.060 0 e 0 0 0 >> 460 2.308 4.170 1 U 1.850 0 e 0 0 0 >> 461 2.234 4.170 1 U 7.090 0 e 0 0 0 >> 462 1.833 4.169 1 U 4.560 0 e 0 0 0 >> 463 1.776 4.168 1 U 8.950 0 e 0 0 0 >> 464 1.645 4.168 1 U 29.250 0 e 0 0 0 >> 465 1.613 4.168 1 U 4.710 0 e 0 0 0 >> 466 4.069 4.167 1 U 6.970 0 e 0 0 0 >> 467 2.041 4.166 1 U 55.210 0 e 0 0 0 >> 468 0.825 4.134 1 U 20.310 0 e 0 0 0 >> 469 0.764 4.132 1 U 68.220 0 e 0 0 0 >> 470 1.243 4.131 1 U 13.800 0 e 0 0 0 >> 471 0.693 4.131 1 U 28.320 0 e 0 0 0 >> 472 0.506 4.131 1 U 8.640 0 e 0 0 0 >> 473 1.075 4.130 1 U 12.390 0 e 0 0 0 >> 474 0.760 4.101 1 U 4.150 0 e 0 0 0 >> 475 3.820 4.042 1 U 171.490 0 e 0 0 0 >> 476 3.818 4.022 1 U 242.370 0 e 0 0 0 >> 477 1.611 3.983 1 U 88.310 0 e 0 0 0 >> 478 1.738 3.982 1 U 44.530 0 e 0 0 0 >> 479 1.907 3.981 1 U 25.250 0 e 0 0 0 >> 480 1.697 3.981 1 U 32.520 0 e 0 0 0 >> 481 0.687 3.978 1 U 10.700 0 e 0 0 0 >> 482 1.123 3.974 1 U 10.960 0 e 0 0 0 >> 483 0.629 3.974 1 U 65.160 0 e 0 0 0 >> 484 2.335 3.973 1 U 2.820 0 e 0 0 0 >> 485 0.899 3.973 1 U 10.660 0 e 0 0 0 >> 486 3.623 3.971 1 U 290.650 0 e 0 0 0 >> 487 0.766 3.965 1 U 2.890 0 e 0 0 0 >> 488 3.621 3.948 1 U 178.970 0 e 0 0 0 >> 489 2.339 3.945 1 U 0.560 0 e 0 0 0 >> 490 1.925 3.913 1 U 31.440 0 e 0 0 0 >> 491 1.601 3.912 1 U 32.180 0 e 0 0 0 >> 492 1.446 3.909 1 U 37.340 0 e 0 0 0 >> 493 1.935 3.905 1 U 44.020 0 e 0 0 0 >> 494 1.813 3.904 1 U 27.270 0 e 0 0 0 >> 495 1.658 3.899 1 U 32.840 0 e 0 0 0 >> 496 1.448 3.896 1 U 24.310 0 e 0 0 0 >> 497 1.259 3.895 1 U 9.880 0 e 0 0 0 >> 498 0.964 3.895 1 U 15.580 0 e 0 0 0 >> 499 0.695 3.895 1 U 64.590 0 e 0 0 0 >> 500 1.657 3.870 1 U 1.910 0 e 0 0 0 >> 501 0.699 3.866 1 U 18.630 0 e 0 0 0 >> 502 0.691 3.830 1 U 0.410 0 e 0 0 0 >> 503 2.973 3.828 1 U 2.780 0 e 0 0 0 >> 504 0.505 3.828 1 U 9.600 0 e 0 0 0 >> 505 0.505 3.740 1 U 17.370 0 e 0 0 0 >> 506 2.970 3.737 1 U 5.970 0 e 0 0 0 >> 507 0.766 3.731 1 U 9.400 0 e 0 0 0 >> 508 1.927 3.730 1 U 6.150 0 e 0 0 0 >> 509 1.906 3.730 1 U 5.800 0 e 0 0 0 >> 510 1.814 3.730 1 U 13.640 0 e 0 0 0 >> 511 1.600 3.730 1 U 16.310 0 e 0 0 0 >> 512 0.691 3.730 1 U 11.070 0 e 0 0 0 >> 513 2.341 3.729 1 U 17.450 0 e 0 0 0 >> 514 1.446 3.729 1 U 0.420 0 e 0 0 0 >> 515 1.079 3.728 1 U 124.880 0 e 0 0 0 >> 516 2.969 3.726 1 U 1.710 0 e 0 0 0 >> 517 2.756 3.726 1 U 4.450 0 e 0 0 0 >> 518 2.635 3.725 1 U 2.780 0 e 0 0 0 >> 519 0.505 3.718 1 U 8.500 0 e 0 0 0 >> 520 2.333 3.717 1 U 8.450 0 e 0 0 0 >> 521 3.380 3.680 1 U 2.410 0 e 0 0 0 >> 522 0.507 3.672 1 U 1.380 0 e 0 0 0 >> 523 1.243 3.671 1 U 1.690 0 e 0 0 0 >> 524 0.691 3.671 1 U 0.610 0 e 0 0 0 >> 525 0.694 3.642 1 U 0.580 0 e 0 0 0 >> 526 2.336 3.632 1 U 0.420 0 e 0 0 0 >> 527 3.248 3.624 1 U 0.380 0 e 0 0 0 >> 528 2.340 3.606 1 U 4.450 0 e 0 0 0 >> 529 1.243 3.601 1 U 0.640 0 e 0 0 0 >> 530 0.691 3.601 1 U 0.390 0 e 0 0 0 >> 531 0.503 3.601 1 U 0.440 0 e 0 0 0 >> 532 1.823 3.550 1 U 15.160 0 e 0 0 0 >> 533 2.041 3.538 1 U 6.380 0 e 0 0 0 >> 534 1.641 3.537 1 U 10.890 0 e 0 0 0 >> 535 1.609 3.537 1 U 19.520 0 e 0 0 0 >> 536 1.488 3.537 1 U 5.870 0 e 0 0 0 >> 537 1.376 3.537 1 U 1.440 0 e 0 0 0 >> 538 1.820 3.536 1 U 29.670 0 e 0 0 0 >> 539 1.775 3.536 1 U 54.490 0 e 0 0 0 >> 540 3.359 3.533 1 U 299.500 0 e 0 0 0 >> 541 1.827 3.525 1 U 20.700 0 e 0 0 0 >> 542 3.277 3.385 1 U 65.330 0 e 0 0 0 >> 543 1.603 3.376 1 U 11.120 0 e 0 0 0 >> 544 1.773 3.374 1 U 10.740 0 e 0 0 0 >> 545 1.824 3.369 1 U 35.740 0 e 0 0 0 >> 546 1.611 3.360 1 U 32.500 0 e 0 0 0 >> 547 2.041 3.359 1 U 0.600 0 e 0 0 0 >> 548 1.776 3.359 1 U 25.710 0 e 0 0 0 >> 549 1.488 3.359 1 U 7.670 0 e 0 0 0 >> 550 1.825 3.358 1 U 40.790 0 e 0 0 0 >> 551 1.641 3.358 1 U 21.170 0 e 0 0 0 >> 552 1.376 3.358 1 U 5.170 0 e 0 0 0 >> 553 0.630 3.146 1 U 12.510 0 e 0 0 0 >> 554 1.901 3.145 1 U 1.450 0 e 0 0 0 >> 555 1.611 3.145 1 U 9.510 0 e 0 0 0 >> 556 0.683 3.145 1 U 2.700 0 e 0 0 0 >> 557 1.603 2.977 1 U 2.970 0 e 0 0 0 >> 558 1.935 2.970 1 U 26.320 0 e 0 0 0 >> 559 1.816 2.970 1 U 12.030 0 e 0 0 0 >> 560 1.928 2.949 1 U 10.690 0 e 0 0 0 >> 561 1.824 2.948 1 U 2.150 0 e 0 0 0 >> 562 1.380 2.926 1 U 56.050 0 e 0 0 0 >> 563 1.605 2.919 1 U 37.420 0 e 0 0 0 >> 564 1.487 2.919 1 U 27.790 0 e 0 0 0 >> 565 1.371 2.910 1 U 67.180 0 e 0 0 0 >> 566 1.608 2.872 1 U 2.650 0 e 0 0 0 >> 567 0.629 2.865 1 U 1.300 0 e 0 0 0 >> 568 0.764 2.792 1 U 0.610 0 e 0 0 0 >> 569 1.074 2.784 1 U 2.310 0 e 0 0 0 >> 570 1.075 2.772 1 U 2.540 0 e 0 0 0 >> 571 0.690 2.772 1 U 2.320 0 e 0 0 0 >> 572 0.686 2.756 1 U 6.390 0 e 0 0 0 >> 573 2.326 2.734 1 U 1.460 0 e 0 0 0 >> 574 1.906 2.699 1 U 1.450 0 e 0 0 0 >> 575 1.602 2.698 1 U 2.210 0 e 0 0 0 >> 576 0.693 2.696 1 U 4.490 0 e 0 0 0 >> 577 1.074 2.690 1 U 2.380 0 e 0 0 0 >> 578 0.684 2.650 1 U 2.690 0 e 0 0 0 >> 579 1.906 2.626 1 U 0.830 0 e 0 0 0 >> 580 0.691 2.626 1 U 1.000 0 e 0 0 0 >> 581 2.400 2.559 1 U 62.440 0 e 0 0 0 >> 582 0.695 2.389 1 U 0.640 0 e 0 0 0 >> 583 1.814 2.387 1 U 21.860 0 e 0 0 0 >> 584 1.904 2.386 1 U 46.530 0 e 0 0 0 >> 585 1.818 2.346 1 U 20.710 0 e 0 0 0 >> 586 1.907 2.341 1 U 61.570 0 e 0 0 0 >> 587 0.696 2.335 1 U 6.750 0 e 0 0 0 >> 588 1.831 2.334 1 U 27.830 0 e 0 0 0 >> 589 1.716 2.330 1 U 16.770 0 e 0 0 0 >> 590 1.907 2.321 1 U 65.240 0 e 0 0 0 >> 591 1.801 2.307 1 U 13.130 0 e 0 0 0 >> 592 1.842 2.303 1 U 18.350 0 e 0 0 0 >> 593 1.716 2.284 1 U 21.290 0 e 0 0 0 >> 594 1.721 2.245 1 U 32.170 0 e 0 0 0 >> 595 1.716 2.237 1 U 21.580 0 e 0 0 0 >> 596 1.853 2.234 1 U 10.920 0 e 0 0 0 >> 597 1.711 2.205 1 U 14.750 0 e 0 0 0 >> 598 1.856 2.156 1 U 19.170 0 e 0 0 0 >> 599 1.864 2.138 1 U 33.080 0 e 0 0 0 >> 600 1.658 2.099 1 U 5.360 0 e 0 0 0 >> 601 1.777 2.045 1 U 23.370 0 e 0 0 0 >> 602 1.645 2.043 1 U 268.870 0 e 0 0 0 >> 603 1.835 2.036 1 U 23.850 0 e 0 0 0 >> 604 1.599 1.954 1 U 51.080 0 e 0 0 0 >> 605 1.447 1.954 1 U 11.520 0 e 0 0 0 >> 606 1.452 1.940 1 U 24.310 0 e 0 0 0 >> 607 1.605 1.928 1 U 58.840 0 e 0 0 0 >> 608 1.447 1.918 1 U 10.260 0 e 0 0 0 >> 609 0.787 1.913 1 U 36.600 0 e 0 0 0 >> 610 0.701 1.912 1 U 2.900 0 e 0 0 0 >> 611 1.603 1.904 1 U 40.250 0 e 0 0 0 >> 612 0.794 1.901 1 U 35.930 0 e 0 0 0 >> 613 0.700 1.898 1 U 13.900 0 e 0 0 0 >> 614 0.631 1.891 1 U 5.200 0 e 0 0 0 >> 615 0.687 1.890 1 U 17.800 0 e 0 0 0 >> 616 0.766 1.861 1 U 6.660 0 e 0 0 0 >> 617 0.676 1.857 1 U 13.690 0 e 0 0 0 >> 618 0.648 1.854 1 U 17.100 0 e 0 0 0 >> 619 1.447 1.825 1 U 82.340 0 e 0 0 0 >> 620 0.696 1.825 1 U 7.010 0 e 0 0 0 >> 621 0.695 1.718 1 U 15.490 0 e 0 0 0 >> 622 0.639 1.710 1 U 18.250 0 e 0 0 0 >> 623 0.968 1.678 1 U 8.980 0 e 0 0 0 >> 624 1.260 1.658 1 U 47.060 0 e 0 0 0 >> 625 0.696 1.652 1 U 167.200 0 e 0 0 0 >> 626 0.964 1.641 1 U 8.200 0 e 0 0 0 >> 627 1.125 1.635 1 U 9.870 0 e 0 0 0 >> 628 1.261 1.615 1 U 10.350 0 e 0 0 0 >> 629 0.630 1.613 1 U 153.400 0 e 0 0 0 >> 630 1.144 1.612 1 U 9.460 0 e 0 0 0 >> 631 0.900 1.612 1 U 23.800 0 e 0 0 0 >> 632 1.099 1.610 1 U 15.290 0 e 0 0 0 >> 633 1.121 1.595 1 U 15.970 0 e 0 0 0 >> 634 0.795 1.527 1 U 9.540 0 e 0 0 0 >> 635 0.735 1.503 1 U 2.180 0 e 0 0 0 >> 636 1.058 1.372 1 U 13.990 0 e 0 0 0 >> 637 0.695 1.372 1 U 15.820 0 e 0 0 0 >> 638 1.052 1.352 1 U 11.530 0 e 0 0 0 >> 639 0.682 1.286 1 U 61.660 0 e 0 0 0 >> 640 0.510 1.267 1 U 11.990 0 e 0 0 0 >> 641 0.965 1.265 1 U 243.990 0 e 0 0 0 >> 642 0.702 1.254 1 U 138.100 0 e 0 0 0 >> 643 0.765 1.244 1 U 59.360 0 e 0 0 0 >> 644 0.821 1.240 1 U 49.810 0 e 0 0 0 >> 645 0.690 1.231 1 U 202.880 0 e 0 0 0 >> 646 0.505 1.227 1 U 67.380 0 e 0 0 0 >> 647 0.653 1.141 1 U 33.690 0 e 0 0 0 >> 648 0.902 1.116 1 U 245.880 0 e 0 0 0 >> 649 0.647 1.099 1 U 35.180 0 e 0 0 0 >> 650 0.660 1.080 1 U 16.360 0 e 0 0 0 >> 651 0.743 1.076 1 U 18.890 0 e 0 0 0 >> 652 0.817 1.075 1 U 14.320 0 e 0 0 0 >> 653 0.769 1.075 1 U 26.290 0 e 0 0 0 >> 654 0.702 1.073 1 U 17.520 0 e 0 0 0 >> 655 0.685 0.973 1 U 113.430 0 e 0 0 0 >> 656 0.660 0.903 1 U 37.260 0 e 0 0 0 >> 657 0.628 0.902 1 U 72.370 0 e 0 0 0 >> 658 0.507 0.816 1 U 57.870 0 e 0 0 0 >> 659 0.506 0.764 1 U 129.290 0 e 0 0 0 >>; >> >> loop_ >> _Spectral_dim.ID >> _Spectral_dim.Axis_code >> _Spectral_dim.Spectrometer_frequency >> _Spectral_dim.Atom_type >> _Spectral_dim.Atom_isotope_number >> _Spectral_dim.Spectral_region >> _Spectral_dim.Magnetization_linkage_ID >> _Spectral_dim.Under_sampling_type >> _Spectral_dim.Sweep_width >> _Spectral_dim.Sweep_width_units >> _Spectral_dim.Value_first_point >> _Spectral_dim.Absolute_peak_positions >> _Spectral_dim.Acquisition >> _Spectral_dim.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_reduced_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 . . H 1 H . . 12.015 ppm . . . 4.71 . . 30625 1 >> 2 . . H 1 H . . 12.015 ppm . . . 4.71 . . 30625 1 >> >> stop_ >> >>save_ >> ; save_