data_34138 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR structure of an EphA2-Sam fragment ; _BMRB_accession_number 34138 _BMRB_flat_file_name bmr34138.str _Entry_type original _Submission_date 2017-05-12 _Accession_date 2017-12-12 _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 Mercurio F. A. . 2 Leone M. . . 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" 168 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-02-26 update BMRB 'update entry citation' 2017-12-13 original author 'original release' stop_ _Original_release_date 2017-12-12 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; The Sam-Sam interaction between Ship2 and the EphA2 receptor: design and analysis of peptide inhibitors ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29234063 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mercurio F. A. . 2 'Di Natale' C. . . 3 Pirone L. . . 4 Iannitti R. . . 5 Marasco D. . . 6 Pedone E. M. . 7 Palumbo R. . . 8 Leone M. . . stop_ _Journal_abbreviation 'Sci. Rep.' _Journal_volume 7 _Journal_issue 1 _Journal_ISSN 2045-2322 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 17474 _Page_last 17474 _Year 2017 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Ephrin type-A receptor 2 (E.C.2.7.10.1)' _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 2887.45 _Mol_thiol_state 'not present' _Details 'Fragment 945-969 of Human EphA2 receptor (Uniprot entry P29317)' ############################## # Polymer residue sequence # ############################## _Residue_count 27 _Mol_residue_sequence ; XKRIGVRLPGHQKRIAYSLL GLKDQVX ; loop_ _Residue_seq_code _Residue_label 1 ACE 2 LYS 3 ARG 4 ILE 5 GLY 6 VAL 7 ARG 8 LEU 9 PRO 10 GLY 11 HIS 12 GLN 13 LYS 14 ARG 15 ILE 16 ALA 17 TYR 18 SER 19 LEU 20 LEU 21 GLY 22 LEU 23 LYS 24 ASP 25 GLN 26 VAL 27 NH2 stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ###################### # Polymer residues # ###################### save_chem_comp_ACE _Saveframe_category polymer_residue _Mol_type NON-POLYMER _Name_common 'ACETYL GROUP' _BMRB_code ACE _PDB_code ACE _Standard_residue_derivative . _Molecular_mass 44.053 _Mol_paramagnetic . _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons C C C . 0 . ? O O O . 0 . ? CH3 CH3 C . 0 . ? H H H . 0 . ? H1 H1 H . 0 . ? H2 H2 H . 0 . ? H3 H3 H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name DOUB C O ? ? SING C CH3 ? ? SING C H ? ? SING CH3 H1 ? ? SING CH3 H2 ? ? SING CH3 H3 ? ? stop_ save_ save_chem_comp_NH2 _Saveframe_category polymer_residue _Mol_type NON-POLYMER _Name_common 'AMINO GROUP' _BMRB_code NH2 _PDB_code NH2 _Standard_residue_derivative . _Molecular_mass 16.023 _Mol_paramagnetic . _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons N N N . 0 . ? HN1 HN1 H . 0 . ? HN2 HN2 H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name SING N HN1 ? ? SING N HN2 ? ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 . . . . . . 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 'chemical synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '830 uM Peptide fragment of EphA2-Sam, trifluoroethanol/water' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 830 uM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name CYANA _Version 2.1 loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task refinement stop_ _Details . save_ save_software_2 _Saveframe_category software _Name VNMRJ _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_3 _Saveframe_category software _Name XEASY _Version . loop_ _Vendor _Address _Electronic_address 'Bartels et al.' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details 'Cold probe' 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_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_1 save_ save_2D_DQF-COSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D DQF-COSY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 3.5 . pH pressure 1 . atm temperature 298 . 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 TSP H 1 'methyl protons' ppm 0.000 internal direct . . . 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 NOESY' '2D DQF-COSY' stop_ loop_ _Sample_label $sample_1 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 ACE H1 H 2.05 0.01 1 2 2 2 LYS H H 7.88 0.01 1 3 2 2 LYS HA H 4.27 0.01 1 4 2 2 LYS HB2 H 1.84 0.01 1 5 2 2 LYS HB3 H 1.84 0.01 1 6 2 2 LYS HG2 H 1.52 0.01 2 7 2 2 LYS HG3 H 1.45 0.01 2 8 2 2 LYS HD2 H 1.72 0.01 1 9 2 2 LYS HD3 H 1.72 0.01 1 10 2 2 LYS HE2 H 3.00 0.01 1 11 2 2 LYS HE3 H 3.00 0.01 1 12 3 3 ARG H H 8.10 0.01 1 13 3 3 ARG HA H 4.39 0.01 1 14 3 3 ARG HB2 H 1.90 0.01 2 15 3 3 ARG HB3 H 1.79 0.01 2 16 3 3 ARG HG2 H 1.70 0.01 2 17 3 3 ARG HG3 H 1.63 0.01 2 18 3 3 ARG HD2 H 3.20 0.01 1 19 3 3 ARG HD3 H 3.20 0.01 1 20 3 3 ARG HE H 7.15 0.01 1 21 4 4 ILE H H 7.78 0.01 1 22 4 4 ILE HA H 4.20 0.01 1 23 4 4 ILE HB H 1.90 0.01 1 24 4 4 ILE HG12 H 1.52 0.01 2 25 4 4 ILE HG13 H 1.21 0.01 2 26 4 4 ILE HG2 H 0.96 0.01 1 27 4 4 ILE HD1 H 0.91 0.01 1 28 5 5 GLY H H 8.11 0.01 1 29 5 5 GLY HA2 H 3.97 0.01 2 30 5 5 GLY HA3 H 3.94 0.01 2 31 6 6 VAL H H 7.59 0.01 1 32 6 6 VAL HA H 4.09 0.01 1 33 6 6 VAL HB H 2.09 0.01 1 34 6 6 VAL HG1 H 0.96 0.01 1 35 6 6 VAL HG2 H 0.96 0.01 1 36 7 7 ARG H H 8.01 0.01 1 37 7 7 ARG HA H 4.45 0.01 1 38 7 7 ARG HB2 H 1.87 0.01 2 39 7 7 ARG HB3 H 1.80 0.01 2 40 7 7 ARG HG2 H 1.69 0.01 2 41 7 7 ARG HG3 H 1.63 0.01 2 42 7 7 ARG HD2 H 3.20 0.01 1 43 7 7 ARG HD3 H 3.20 0.01 1 44 7 7 ARG HE H 7.16 0.01 1 45 8 8 LEU H H 7.89 0.01 1 46 8 8 LEU HA H 4.69 0.01 1 47 8 8 LEU HB2 H 1.62 0.01 2 48 8 8 LEU HB3 H 1.63 0.01 2 49 8 8 LEU HG H 1.53 0.01 1 50 8 8 LEU HD1 H 0.93 0.01 1 51 8 8 LEU HD2 H 0.93 0.01 1 52 9 9 PRO HA H 4.46 0.01 1 53 9 9 PRO HB2 H 2.32 0.01 2 54 9 9 PRO HB3 H 1.99 0.01 2 55 9 9 PRO HG2 H 2.13 0.01 2 56 9 9 PRO HG3 H 2.07 0.01 2 57 9 9 PRO HD2 H 3.86 0.01 2 58 9 9 PRO HD3 H 3.68 0.01 2 59 10 10 GLY H H 8.27 0.01 1 60 10 10 GLY HA2 H 4.01 0.01 2 61 10 10 GLY HA3 H 3.92 0.01 2 62 11 11 HIS H H 8.23 0.01 1 63 11 11 HIS HA H 4.59 0.01 1 64 11 11 HIS HB2 H 3.36 0.01 2 65 11 11 HIS HB3 H 3.27 0.01 2 66 11 11 HIS HD2 H 7.22 0.01 1 67 11 11 HIS HE1 H 8.39 0.01 1 68 12 12 GLN H H 8.53 0.01 1 69 12 12 GLN HA H 4.18 0.01 1 70 12 12 GLN HB2 H 2.16 0.01 2 71 12 12 GLN HB3 H 2.11 0.01 2 72 12 12 GLN HG2 H 2.43 0.01 1 73 12 12 GLN HG3 H 2.43 0.01 1 74 12 12 GLN HE21 H 7.27 0.01 2 75 12 12 GLN HE22 H 6.64 0.01 2 76 13 13 LYS H H 8.11 0.01 1 77 13 13 LYS HA H 4.13 0.01 1 78 13 13 LYS HB2 H 1.86 0.01 1 79 13 13 LYS HB3 H 1.86 0.01 1 80 13 13 LYS HG2 H 1.52 0.01 2 81 13 13 LYS HG3 H 1.42 0.01 2 82 13 13 LYS HD2 H 1.72 0.01 1 83 13 13 LYS HD3 H 1.72 0.01 1 84 13 13 LYS HE2 H 2.99 0.01 1 85 13 13 LYS HE3 H 2.99 0.01 1 86 14 14 ARG H H 7.88 0.01 1 87 14 14 ARG HA H 4.21 0.01 1 88 14 14 ARG HB2 H 1.93 0.01 1 89 14 14 ARG HB3 H 1.93 0.01 1 90 14 14 ARG HG2 H 1.74 0.01 2 91 14 14 ARG HG3 H 1.71 0.01 2 92 14 14 ARG HD2 H 3.22 0.01 1 93 14 14 ARG HD3 H 3.22 0.01 1 94 14 14 ARG HE H 7.22 0.01 1 95 15 15 ILE H H 7.86 0.01 1 96 15 15 ILE HA H 3.92 0.01 1 97 15 15 ILE HB H 1.93 0.01 1 98 15 15 ILE HG12 H 1.61 0.01 2 99 15 15 ILE HG13 H 1.19 0.01 2 100 15 15 ILE HG2 H 0.92 0.01 1 101 15 15 ILE HD1 H 0.88 0.01 1 102 16 16 ALA H H 8.00 0.01 1 103 16 16 ALA HA H 4.14 0.01 1 104 16 16 ALA HB H 1.45 0.01 1 105 17 17 TYR H H 8.15 0.01 1 106 17 17 TYR HA H 4.35 0.01 1 107 17 17 TYR HB2 H 3.14 0.01 1 108 17 17 TYR HB3 H 3.14 0.01 1 109 17 17 TYR HD1 H 7.13 0.01 3 110 17 17 TYR HD2 H 7.13 0.01 3 111 17 17 TYR HE1 H 6.81 0.01 3 112 17 17 TYR HE2 H 6.81 0.01 3 113 18 18 SER H H 7.97 0.01 1 114 18 18 SER HA H 4.35 0.01 1 115 18 18 SER HB2 H 4.15 0.01 2 116 18 18 SER HB3 H 3.98 0.01 2 117 19 19 LEU H H 8.12 0.01 1 118 19 19 LEU HA H 4.28 0.01 1 119 19 19 LEU HB2 H 1.82 0.01 2 120 19 19 LEU HB3 H 1.61 0.01 2 121 19 19 LEU HD1 H 0.93 0.01 2 122 19 19 LEU HD2 H 0.90 0.01 2 123 20 20 LEU H H 7.98 0.01 1 124 20 20 LEU HA H 4.21 0.01 1 125 20 20 LEU HB2 H 1.80 0.01 2 126 20 20 LEU HB3 H 1.61 0.01 2 127 20 20 LEU HG H 1.80 0.01 1 128 20 20 LEU HD1 H 0.91 0.01 1 129 20 20 LEU HD2 H 0.91 0.01 1 130 21 21 GLY H H 7.91 0.01 1 131 21 21 GLY HA2 H 3.95 0.01 2 132 21 21 GLY HA3 H 3.89 0.01 2 133 22 22 LEU H H 7.74 0.01 1 134 22 22 LEU HA H 4.29 0.01 1 135 22 22 LEU HB2 H 1.75 0.01 2 136 22 22 LEU HB3 H 1.65 0.01 2 137 22 22 LEU HG H 1.75 0.01 1 138 22 22 LEU HD1 H 0.93 0.01 2 139 22 22 LEU HD2 H 0.90 0.01 2 140 23 23 LYS H H 7.99 0.01 1 141 23 23 LYS HA H 4.22 0.01 1 142 23 23 LYS HB2 H 1.92 0.01 1 143 23 23 LYS HB3 H 1.92 0.01 1 144 23 23 LYS HG2 H 1.51 0.01 1 145 23 23 LYS HG3 H 1.51 0.01 1 146 23 23 LYS HD2 H 1.75 0.01 1 147 23 23 LYS HD3 H 1.75 0.01 1 148 23 23 LYS HE2 H 3.03 0.01 1 149 23 23 LYS HE3 H 3.03 0.01 1 150 24 24 ASP H H 8.10 0.01 1 151 24 24 ASP HA H 4.69 0.01 1 152 24 24 ASP HB2 H 2.90 0.01 2 153 24 24 ASP HB3 H 2.87 0.01 2 154 25 25 GLN H H 8.02 0.01 1 155 25 25 GLN HA H 4.38 0.01 1 156 25 25 GLN HB2 H 2.23 0.01 2 157 25 25 GLN HB3 H 2.12 0.01 2 158 25 25 GLN HG2 H 2.42 0.01 1 159 25 25 GLN HG3 H 2.42 0.01 1 160 25 25 GLN HE21 H 7.33 0.01 2 161 25 25 GLN HE22 H 6.53 0.01 2 162 26 26 VAL H H 7.84 0.01 1 163 26 26 VAL HA H 4.13 0.01 1 164 26 26 VAL HB H 2.15 0.01 1 165 26 26 VAL HG1 H 1.00 0.01 1 166 26 26 VAL HG2 H 1.00 0.01 1 167 27 27 NH2 HN1 H 7.34 0.01 2 168 27 27 NH2 HN2 H 6.78 0.01 2 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_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 34138 >> _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 2 >> _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 >># INAME 1 1H >># INAME 2 1H >> 2 7.588 7.588 1 U 0.000e+000 0.00e+000 - 0 89 89 0 >> 3 4.095 7.588 1 U 2.451e+003 0.00e+000 e 0 91 89 0 >> 4 2.087 7.588 1 U 3.869e+003 0.00e+000 e 0 93 89 0 >> 5 0.957 7.588 1 U 5.170e+003 0.00e+000 e 0 104 89 0 >> 6 4.095 4.095 1 U 0.000e+000 0.00e+000 - 0 91 91 0 >> 10 2.087 4.095 1 U 2.781e+003 0.00e+000 e 0 93 91 0 >> 11 0.957 4.095 1 U 7.342e+003 0.00e+000 e 0 104 91 0 >> 13 2.087 2.087 1 U 0.000e+000 0.00e+000 - 0 93 93 0 >> 14 0.957 0.957 1 U 0.000e+000 0.00e+000 - 0 104 104 0 >> 15 0.957 2.087 1 U 7.111e+003 0.00e+000 e 0 104 93 0 >> 16 4.095 2.087 1 U 1.111e+003 0.00e+000 e 0 91 93 0 >> 18 2.087 0.957 1 U 1.035e+004 0.00e+000 e 0 93 104 0 >> 19 4.095 0.957 1 U 3.930e+003 0.00e+000 e 0 91 104 0 >> 21 8.115 8.115 1 U 0.000e+000 0.00e+000 - 0 82 82 0 >> 22 7.588 8.115 1 U 1.683e+003 0.00e+000 e 0 89 82 0 >> 23 3.971 8.115 1 U 2.111e+003 0.00e+000 e 0 84 82 0 >> 24 3.943 8.115 1 U 4.406e+003 0.00e+000 e 0 85 82 0 >> 25 3.971 7.588 1 U 3.753e+003 0.00e+000 e 0 84 89 0 >> 26 3.939 7.588 1 U 3.179e+003 0.00e+000 e 0 85 89 0 >> 27 8.115 7.588 1 U 1.547e+003 0.00e+000 e 0 82 89 0 >> 28 3.971 3.971 1 U 0.000e+000 0.00e+000 - 0 84 84 0 >> 29 3.943 3.939 1 U 0.000e+000 0.00e+000 - 0 85 85 0 >> 32 7.838 7.838 1 U 0.000e+000 0.00e+000 - 0 460 460 0 >> 33 7.345 7.345 1 U 0.000e+000 0.00e+000 - 0 477 477 0 >> 34 6.776 6.776 1 U 0.000e+000 0.00e+000 - 0 478 478 0 >> 35 7.345 6.776 1 U 2.669e+004 0.00e+000 e 0 477 478 0 >> 36 6.776 7.345 1 U 3.184e+004 0.00e+000 e 0 478 477 0 >> 37 7.345 7.838 1 U 3.820e+002 0.00e+000 e 0 477 460 0 >> 38 4.133 7.838 1 U 2.954e+003 0.00e+000 e 0 462 460 0 >> 39 2.146 7.838 1 U 2.857e+003 0.00e+000 e 0 464 460 0 >> 40 1.004 7.838 1 U 2.596e+003 0.00e+000 e 0 475 460 0 >> 41 4.133 4.133 1 U 0.000e+000 0.00e+000 - 0 462 462 0 >> 42 2.146 2.146 1 U 0.000e+000 0.00e+000 - 0 464 464 0 >> 43 1.004 1.004 1 U 0.000e+000 0.00e+000 - 0 475 475 0 >> 44 2.146 4.133 1 U 1.830e+003 0.00e+000 e 0 464 462 0 >> 45 1.004 4.133 1 U 1.457e+003 0.00e+000 e 0 475 462 0 >> 46 1.004 2.146 1 U 2.471e+003 0.00e+000 e 0 475 464 0 >> 48 4.133 1.004 1 U 1.788e+003 0.00e+000 e 0 462 475 0 >> 49 4.133 2.146 1 U 1.059e+003 0.00e+000 e 0 462 464 0 >> 54 4.133 7.345 1 U 1.073e+003 0.00e+000 e 0 462 477 0 >> 55 2.146 7.345 1 U 1.250e+002 0.00e+000 e 0 464 477 0 >> 56 1.004 7.345 1 U 2.780e+002 0.00e+000 e 0 475 477 0 >> 57 7.838 7.345 1 U 1.295e+003 0.00e+000 e 0 460 477 0 >> 59 8.019 8.019 1 U 0.000e+000 0.00e+000 - 0 442 442 0 >> 60 4.385 8.019 1 U 2.606e+003 0.00e+000 e 0 444 442 0 >> 61 2.424 8.019 1 U 2.309e+003 0.00e+000 e 0 452 442 0 >> 62 2.227 8.019 1 U 1.870e+003 0.00e+000 e 0 446 442 0 >> 63 2.119 8.019 1 U 1.855e+003 0.00e+000 e 0 447 442 0 >> 64 7.838 8.019 1 U 2.795e+003 0.00e+000 e 0 460 442 0 >> 65 8.019 7.838 1 U 2.385e+003 0.00e+000 e 0 442 460 0 >> 66 4.385 4.398 1 U 0.000e+000 0.00e+000 - 0 444 444 0 >> 67 2.424 2.424 1 U 0.000e+000 0.00e+000 - 0 452 452 0 >> 68 2.227 2.230 1 U 0.000e+000 0.00e+000 - 0 446 446 0 >> 69 2.119 2.117 1 U 0.000e+000 0.00e+000 - 0 447 447 0 >> 70 2.227 2.424 1 U 9.327e+003 0.00e+000 e 0 446 452 0 >> 71 2.119 2.424 1 U 7.027e+003 0.00e+000 e 0 447 452 0 >> 72 2.119 2.230 1 U 2.696e+004 0.00e+000 e 0 447 446 0 >> 73 2.229 2.117 1 U 1.986e+004 0.00e+000 e 0 446 447 0 >> 74 2.424 2.117 1 U 5.204e+003 0.00e+000 e 0 452 447 0 >> 75 4.374 2.424 1 U 2.380e+003 0.00e+000 e 0 444 452 0 >> 76 4.378 2.230 1 U 2.323e+003 0.00e+000 e 0 444 446 0 >> 77 4.378 2.117 1 U 1.780e+003 0.00e+000 e 0 444 447 0 >> 87 4.383 7.838 1 U 3.191e+003 0.00e+000 e 0 444 460 0 >> 88 8.096 8.096 1 U 0.000e+000 0.00e+000 - 0 432 432 0 >> 90 8.096 8.019 1 U 3.281e+003 0.00e+000 e 0 432 442 0 >> 91 4.686 8.096 1 U 4.662e+003 0.00e+000 e 0 434 432 0 >> 92 2.899 8.096 1 U 3.524e+003 0.00e+000 e 0 436 432 0 >> 93 2.871 8.096 1 U 3.997e+003 0.00e+000 e 0 437 432 0 >> 94 4.686 4.686 1 U 0.000e+000 0.00e+000 - 0 434 434 0 >> 95 2.899 2.899 1 U 0.000e+000 0.00e+000 - 0 436 436 0 >> 96 2.871 2.871 1 U 0.000e+000 0.00e+000 - 0 437 437 0 >> 99 4.686 2.899 1 U 3.989e+003 0.00e+000 e 0 434 436 0 >> 100 4.686 2.871 1 U 2.905e+003 0.00e+000 e 0 434 437 0 >> 104 7.989 7.989 1 U 0.000e+000 0.00e+000 - 0 406 406 0 >> 105 4.224 7.989 1 U 4.523e+003 0.00e+000 e 0 408 406 0 >> 107 1.918 7.989 1 U 2.218e+003 0.00e+000 e 0 411 406 0 >> 108 1.512 7.989 1 U 2.306e+003 0.00e+000 e 0 416 406 0 >> 109 4.224 4.224 1 U 0.000e+000 0.00e+000 - 0 408 408 0 >> 110 3.034 3.034 1 U 0.000e+000 0.00e+000 - 0 424 424 0 >> 112 1.918 1.918 1 U 0.000e+000 0.00e+000 - 0 411 411 0 >> 113 1.512 1.512 1 U 0.000e+000 0.00e+000 - 0 416 416 0 >> 114 1.749 1.749 1 U 0.000e+000 0.00e+000 - 0 420 420 0 >> 119 1.749 3.034 1 U 8.290e+002 0.00e+000 e 0 420 424 0 >> 120 1.512 3.034 1 U 1.649e+003 0.00e+000 e 0 416 424 0 >> 122 4.224 1.918 1 U 3.302e+003 0.00e+000 e 0 408 411 0 >> 123 3.034 1.749 1 U 3.639e+003 0.00e+000 e 0 424 420 0 >> 126 4.224 1.512 1 U 1.155e+003 0.00e+000 e 0 408 416 0 >> 130 8.096 7.989 1 U 3.993e+003 0.00e+000 e 0 432 406 0 >> 131 8.226 8.226 1 U 0.000e+000 0.00e+000 - 0 180 180 0 >> 132 8.393 8.393 1 U 0.000e+000 0.00e+000 - 0 194 194 0 >> 133 7.220 7.220 1 U 0.000e+000 0.00e+000 - 0 193 193 0 >> 134 4.594 8.226 1 U 6.600e+003 0.00e+000 e 0 182 180 0 >> 135 3.360 8.226 1 U 2.422e+003 0.00e+000 e 0 184 180 0 >> 136 3.266 8.226 1 U 2.809e+003 0.00e+000 e 0 185 180 0 >> 137 3.360 3.360 1 U 0.000e+000 0.00e+000 - 0 184 184 0 >> 138 3.279 3.278 1 U 0.000e+000 0.00e+000 - 0 185 185 0 >> 139 4.594 3.360 1 U 5.886e+003 0.00e+000 e 0 182 184 0 >> 140 4.594 3.278 1 U 5.572e+003 0.00e+000 e 0 182 185 0 >> 141 3.360 3.278 1 U 1.761e+004 0.00e+000 e 0 184 185 0 >> 142 3.270 3.360 1 U 1.820e+004 0.00e+000 e 0 185 184 0 >> 149 3.360 7.220 1 U 1.866e+003 0.00e+000 e 0 184 193 0 >> 150 3.259 7.220 1 U 1.626e+003 0.00e+000 e 0 185 193 0 >> 152 8.533 8.533 1 U 0.000e+000 0.00e+000 - 0 197 197 0 >> 153 8.226 8.533 1 U 1.386e+003 0.00e+000 e 0 180 197 0 >> 154 8.533 8.226 1 U 1.183e+003 0.00e+000 e 0 197 180 0 >> 155 7.268 7.274 1 U 0.000e+000 0.00e+000 - 0 210 210 0 >> 156 6.637 6.640 1 U 0.000e+000 0.00e+000 - 0 211 211 0 >> 157 7.275 6.640 1 U 2.433e+004 0.00e+000 e 0 210 211 0 >> 158 6.633 7.274 1 U 2.970e+004 0.00e+000 e 0 211 210 0 >> 159 4.183 8.533 1 U 2.694e+003 0.00e+000 e 0 199 197 0 >> 160 2.444 8.533 1 U 4.350e+002 0.00e+000 e 0 207 197 0 >> 161 2.156 8.533 1 U 1.225e+003 0.00e+000 e 0 201 197 0 >> 162 2.111 8.533 1 U 1.421e+003 0.00e+000 e 0 202 197 0 >> 163 2.424 7.268 1 U 2.392e+003 0.00e+000 e 0 207 210 0 >> 164 2.429 6.640 1 U 9.860e+002 0.00e+000 e 0 207 211 0 >> 165 4.183 4.183 1 U 0.000e+000 0.00e+000 - 0 199 199 0 >> 166 2.429 2.432 1 U 0.000e+000 0.00e+000 - 0 207 207 0 >> 167 2.156 2.156 1 U 0.000e+000 0.00e+000 - 0 201 201 0 >> 168 2.111 2.107 1 U 0.000e+000 0.00e+000 - 0 202 202 0 >> 169 2.429 4.183 1 U 1.483e+003 0.00e+000 e 0 207 199 0 >> 170 2.156 4.183 1 U 1.391e+003 0.00e+000 e 0 201 199 0 >> 171 2.111 4.183 1 U 1.897e+003 0.00e+000 e 0 202 199 0 >> 172 2.156 2.432 1 U 2.985e+003 0.00e+000 e 0 201 207 0 >> 173 2.111 2.432 1 U 2.836e+003 0.00e+000 e 0 202 207 0 >> 175 2.434 2.156 1 U 2.941e+003 0.00e+000 e 0 207 201 0 >> 184 3.360 8.533 1 U 1.332e+003 0.00e+000 e 0 184 197 0 >> 185 3.267 8.533 1 U 1.091e+003 0.00e+000 e 0 185 197 0 >> 186 4.686 8.019 1 U 2.352e+003 0.00e+000 e 0 434 442 0 >> 187 2.902 8.019 1 U 8.930e+002 0.00e+000 e 0 436 442 0 >> 188 2.874 8.019 1 U 1.085e+003 0.00e+000 e 0 437 442 0 >> 189 8.111 8.111 1 U 0.000e+000 0.00e+000 - 0 215 215 0 >> 190 1.864 8.111 1 U 7.147e+003 0.00e+000 e 0 221 215 0 >> 191 1.520 8.111 1 U 2.383e+003 0.00e+000 e 0 223 215 0 >> 192 2.106 8.111 1 U 1.842e+003 0.00e+000 e 0 202 215 0 >> 193 2.156 8.111 1 U 1.616e+003 0.00e+000 e 0 201 215 0 >> 194 2.429 8.111 1 U 9.300e+002 0.00e+000 e 0 207 215 0 >> 195 4.183 8.111 1 U 2.377e+003 0.00e+000 e 0 199 215 0 >> 197 4.132 8.111 1 U 1.664e+003 0.00e+000 e 0 217 215 0 >> 198 4.132 4.132 1 U 0.000e+000 0.00e+000 - 0 217 217 0 >> 199 1.864 1.864 1 U 0.000e+000 0.00e+000 - 0 221 221 0 >> 200 1.520 1.520 1 U 0.000e+000 0.00e+000 - 0 223 223 0 >> 201 1.864 4.132 1 U 5.632e+003 0.00e+000 e 0 221 217 0 >> 202 1.520 4.132 1 U 1.527e+003 0.00e+000 e 0 223 217 0 >> 204 1.724 1.723 1 U 0.000e+000 0.00e+000 - 0 229 229 0 >> 205 4.132 1.864 1 U 1.035e+004 0.00e+000 e 0 217 221 0 >> 208 4.132 1.520 1 U 1.472e+003 0.00e+000 e 0 217 223 0 >> 210 2.988 2.988 1 U 0.000e+000 0.00e+000 - 0 233 233 0 >> 211 1.726 2.988 1 U 2.722e+003 0.00e+000 e 0 229 233 0 >> 212 1.520 2.988 1 U 1.100e+003 0.00e+000 e 0 223 233 0 >> 213 2.988 1.520 1 U 4.880e+002 0.00e+000 e 0 233 223 0 >> 214 2.988 1.723 1 U 2.480e+003 0.00e+000 e 0 233 229 0 >> 215 8.111 8.533 1 U 2.095e+003 0.00e+000 e 0 215 197 0 >> 216 8.533 8.111 1 U 1.615e+003 0.00e+000 e 0 197 215 0 >> 217 8.001 8.001 1 U 0.000e+000 0.00e+000 - 0 290 290 0 >> 218 4.136 8.001 1 U 3.760e+003 0.00e+000 e 0 292 290 0 >> 219 1.450 8.001 1 U 7.237e+003 0.00e+000 e 0 293 290 0 >> 220 4.136 4.136 1 U 0.000e+000 0.00e+000 - 0 292 292 0 >> 221 1.450 1.450 1 U 0.000e+000 0.00e+000 - 0 293 293 0 >> 222 1.450 4.136 1 U 8.190e+003 0.00e+000 e 0 293 292 0 >> 223 4.136 1.450 1 U 1.737e+004 0.00e+000 e 0 292 293 0 >> 227 8.147 8.147 1 U 0.000e+000 0.00e+000 - 0 300 300 0 >> 228 8.001 8.147 1 U 5.104e+003 0.00e+000 e 0 290 300 0 >> 229 4.354 8.147 1 U 4.034e+003 0.00e+000 e 0 302 300 0 >> 230 3.137 8.147 1 U 1.001e+004 0.00e+000 e 0 306 300 0 >> 231 3.137 3.137 1 U 0.000e+000 0.00e+000 - 0 306 306 0 >> 232 4.354 4.354 1 U 0.000e+000 0.00e+000 - 0 302 302 0 >> 236 3.137 4.354 1 U 3.830e+002 0.00e+000 e 0 306 302 0 >> 237 4.136 8.147 1 U 1.465e+003 0.00e+000 e 0 292 300 0 >> 238 7.126 7.126 1 U 0.000e+000 0.00e+000 - 0 307 307 0 >> 239 6.815 6.815 1 U 0.000e+000 0.00e+000 - 0 308 308 0 >> 240 6.815 7.126 1 U 2.088e+004 0.00e+000 e 0 308 307 0 >> 241 7.126 6.815 1 U 2.980e+004 0.00e+000 e 0 307 308 0 >> 242 8.147 7.126 1 U 1.397e+003 0.00e+000 e 0 300 307 0 >> 243 4.354 7.126 1 U 1.180e+003 0.00e+000 e 0 302 307 0 >> 244 3.137 7.126 1 U 2.076e+003 0.00e+000 e 0 306 307 0 >> 247 4.354 6.815 1 U 2.240e+002 0.00e+000 e 0 302 308 0 >> 248 3.137 6.815 1 U 5.550e+002 0.00e+000 e 0 306 308 0 >> 249 7.126 8.147 1 U 9.530e+002 0.00e+000 e 0 307 300 0 >> 250 1.450 8.147 1 U 4.208e+003 0.00e+000 e 0 293 300 0 >> 251 7.975 7.975 1 U 0.000e+000 0.00e+000 - 0 323 323 0 >> 252 4.354 7.975 1 U 4.187e+003 0.00e+000 e 0 325 323 0 >> 254 3.137 7.975 1 U 5.583e+003 0.00e+000 e 0 306 323 0 >> 255 4.362 7.975 1 U 2.588e+003 0.00e+000 e 0 302 323 0 >> 256 8.147 7.975 1 U 2.921e+003 0.00e+000 e 0 300 323 0 >> 257 7.975 7.126 1 U 6.510e+002 0.00e+000 e 0 323 307 0 >> 258 7.126 7.975 1 U 3.380e+002 0.00e+000 e 0 307 323 0 >> 260 8.275 8.275 1 U 0.000e+000 0.00e+000 - 0 173 173 0 >> 261 4.015 8.275 1 U 5.406e+003 0.00e+000 e 0 175 173 0 >> 262 3.918 8.275 1 U 5.087e+003 0.00e+000 e 0 176 173 0 >> 263 4.015 8.226 1 U 2.780e+003 0.00e+000 e 0 175 180 0 >> 264 3.918 8.226 1 U 2.996e+003 0.00e+000 e 0 176 180 0 >> 265 4.015 4.015 1 U 0.000e+000 0.00e+000 - 0 175 175 0 >> 266 3.918 3.918 1 U 0.000e+000 0.00e+000 - 0 176 176 0 >> 269 4.458 4.458 1 U 0.000e+000 0.00e+000 - 0 159 159 0 >> 270 3.860 3.860 1 U 0.000e+000 0.00e+000 - 0 168 168 0 >> 271 3.679 3.679 1 U 0.000e+000 0.00e+000 - 0 169 169 0 >> 272 3.860 3.679 1 U 1.751e+004 0.00e+000 e 0 168 169 0 >> 273 3.679 3.860 1 U 2.342e+004 0.00e+000 e 0 169 168 0 >> 274 4.458 3.679 1 U 1.443e+003 0.00e+000 e 0 159 169 0 >> 275 2.325 3.860 1 U 1.319e+003 0.00e+000 e 0 161 168 0 >> 276 2.130 3.860 1 U 3.881e+003 0.00e+000 e 0 165 168 0 >> 277 2.072 3.860 1 U 3.845e+003 0.00e+000 e 0 166 168 0 >> 278 1.995 3.860 1 U 1.824e+003 0.00e+000 e 0 162 168 0 >> 279 2.325 3.679 1 U 7.420e+002 0.00e+000 e 0 161 169 0 >> 280 2.130 3.679 1 U 3.794e+003 0.00e+000 e 0 165 169 0 >> 281 2.072 3.679 1 U 3.601e+003 0.00e+000 e 0 166 169 0 >> 282 1.995 3.679 1 U 1.740e+003 0.00e+000 e 0 162 169 0 >> 283 2.325 2.325 1 U 0.000e+000 0.00e+000 - 0 161 161 0 >> 284 2.130 2.130 1 U 0.000e+000 0.00e+000 - 0 165 165 0 >> 285 2.072 2.072 1 U 0.000e+000 0.00e+000 - 0 166 166 0 >> 286 1.995 1.995 1 U 0.000e+000 0.00e+000 - 0 162 162 0 >> 287 1.995 2.325 1 U 1.402e+004 0.00e+000 e 0 162 161 0 >> 288 3.679 2.325 1 U 9.680e+002 0.00e+000 e 0 169 161 0 >> 289 3.860 2.325 1 U 1.358e+003 0.00e+000 e 0 168 161 0 >> 290 4.458 2.325 1 U 5.593e+003 0.00e+000 e 0 159 161 0 >> 291 3.679 2.130 1 U 3.906e+003 0.00e+000 e 0 169 165 0 >> 292 3.860 2.130 1 U 3.480e+003 0.00e+000 e 0 168 165 0 >> 293 4.458 2.130 1 U 2.130e+003 0.00e+000 e 0 159 165 0 >> 294 3.860 2.072 1 U 3.316e+003 0.00e+000 e 0 168 166 0 >> 295 3.679 2.072 1 U 3.333e+003 0.00e+000 e 0 169 166 0 >> 296 4.458 2.072 1 U 1.668e+003 0.00e+000 e 0 159 166 0 >> 297 2.325 1.995 1 U 1.077e+004 0.00e+000 e 0 161 162 0 >> 298 3.679 1.995 1 U 1.905e+003 0.00e+000 e 0 169 162 0 >> 299 3.860 1.995 1 U 2.165e+003 0.00e+000 e 0 168 162 0 >> 300 4.458 1.995 1 U 1.888e+003 0.00e+000 e 0 159 162 0 >> 301 1.995 2.130 1 U 8.360e+003 0.00e+000 e 0 162 165 0 >> 302 2.325 2.130 1 U 2.917e+003 0.00e+000 e 0 161 165 0 >> 303 4.458 8.275 1 U 3.274e+003 0.00e+000 e 0 159 173 0 >> 304 2.325 8.275 1 U 8.990e+002 0.00e+000 e 0 161 173 0 >> 305 2.118 8.275 1 U 4.690e+002 0.00e+000 e 0 165 173 0 >> 306 2.070 8.275 1 U 2.050e+002 0.00e+000 e 0 166 173 0 >> 307 1.995 8.275 1 U 8.510e+002 0.00e+000 e 0 162 173 0 >> 309 4.594 8.533 1 U 2.720e+003 0.00e+000 e 0 182 197 0 >> 310 7.895 7.895 1 U 0.000e+000 0.00e+000 - 0 135 135 0 >> 311 4.694 7.895 1 U 3.160e+003 0.00e+000 e 0 137 135 0 >> 312 1.622 7.895 1 U 3.192e+003 0.00e+000 e 0 139 135 0 >> 313 1.627 7.895 1 U 2.233e+003 0.00e+000 e 0 140 135 0 >> 314 1.524 7.895 1 U 3.046e+003 0.00e+000 e 0 143 135 0 >> 315 0.927 7.895 1 U 3.487e+003 0.00e+000 e 0 154 135 0 >> 316 1.622 1.622 1 U 0.000e+000 0.00e+000 - 0 139 139 0 >> 317 1.524 1.534 1 U 0.000e+000 0.00e+000 - 0 143 143 0 >> 318 1.627 1.617 1 U 0.000e+000 0.00e+000 - 0 140 140 0 >> 319 0.927 0.927 1 U 0.000e+000 0.00e+000 - 0 154 154 0 >> 320 4.694 1.622 1 U 3.005e+003 0.00e+000 e 0 137 139 0 >> 321 4.694 1.524 1 U 1.242e+003 0.00e+000 e 0 137 143 0 >> 323 4.694 1.627 1 U 3.444e+003 0.00e+000 e 0 137 140 0 >> 324 4.694 0.927 1 U 4.769e+003 0.00e+000 e 0 137 154 0 >> 326 1.627 0.927 1 U 7.893e+003 0.00e+000 e 0 140 154 0 >> 331 1.622 3.860 1 U 1.345e+003 0.00e+000 e 0 139 168 0 >> 332 1.627 3.860 1 U 1.954e+003 0.00e+000 e 0 140 168 0 >> 334 0.927 3.860 1 U 2.508e+003 0.00e+000 e 0 154 168 0 >> 335 1.622 3.679 1 U 1.007e+003 0.00e+000 e 0 139 169 0 >> 336 1.627 3.679 1 U 1.793e+003 0.00e+000 e 0 140 169 0 >> 338 0.927 3.679 1 U 2.162e+003 0.00e+000 e 0 154 169 0 >> 339 4.694 3.860 1 U 6.006e+003 0.00e+000 e 0 137 168 0 >> 340 4.694 3.679 1 U 4.307e+003 0.00e+000 e 0 137 169 0 >> 341 3.679 1.627 1 U 2.037e+003 0.00e+000 e 0 169 140 0 >> 342 3.860 1.627 1 U 1.563e+003 0.00e+000 e 0 168 140 0 >> 345 3.679 0.927 1 U 1.770e+003 0.00e+000 e 0 169 154 0 >> 346 3.860 0.927 1 U 8.250e+002 0.00e+000 e 0 168 154 0 >> 348 8.015 8.015 1 U 0.000e+000 0.00e+000 - 0 107 107 0 >> 349 7.895 8.015 1 U 3.932e+003 0.00e+000 e 0 135 107 0 >> 350 8.015 7.895 1 U 4.025e+003 0.00e+000 e 0 107 135 0 >> 351 7.588 8.015 1 U 1.952e+003 0.00e+000 e 0 89 107 0 >> 352 8.015 7.588 1 U 1.578e+003 0.00e+000 e 0 107 89 0 >> 353 4.446 8.015 1 U 2.652e+003 0.00e+000 e 0 109 107 0 >> 354 1.875 8.015 1 U 2.354e+003 0.00e+000 e 0 111 107 0 >> 355 1.800 8.015 1 U 1.781e+003 0.00e+000 e 0 112 107 0 >> 356 1.688 8.015 1 U 2.282e+003 0.00e+000 e 0 115 107 0 >> 357 1.630 8.015 1 U 1.968e+003 0.00e+000 e 0 116 107 0 >> 358 3.202 3.202 1 U 0.000e+000 0.00e+000 - 0 121 121 0 >> 359 7.158 7.158 1 U 0.000e+000 0.00e+000 - 0 123 123 0 >> 360 1.875 1.875 1 U 0.000e+000 0.00e+000 - 0 111 111 0 >> 361 1.800 1.800 1 U 0.000e+000 0.00e+000 - 0 112 112 0 >> 362 1.688 1.688 1 U 0.000e+000 0.00e+000 - 0 115 115 0 >> 363 1.630 1.630 1 U 0.000e+000 0.00e+000 - 0 116 116 0 >> 364 4.446 3.202 1 U 1.216e+003 0.00e+000 e 0 109 121 0 >> 365 1.875 3.202 1 U 2.113e+003 0.00e+000 e 0 111 121 0 >> 366 1.800 3.202 1 U 6.580e+002 0.00e+000 e 0 112 121 0 >> 367 1.688 3.202 1 U 3.163e+003 0.00e+000 e 0 115 121 0 >> 368 1.643 3.202 1 U 2.430e+003 0.00e+000 e 0 116 121 0 >> 369 1.688 1.875 1 U 9.924e+003 0.00e+000 e 0 115 111 0 >> 370 1.630 1.875 1 U 9.844e+003 0.00e+000 e 0 116 111 0 >> 371 3.202 1.875 1 U 3.018e+003 0.00e+000 e 0 121 111 0 >> 372 4.446 1.875 1 U 3.787e+003 0.00e+000 e 0 109 111 0 >> 373 1.875 1.800 1 U 2.724e+004 0.00e+000 e 0 111 112 0 >> 375 3.202 1.800 1 U 8.640e+002 0.00e+000 e 0 121 112 0 >> 376 4.446 1.800 1 U 3.212e+003 0.00e+000 e 0 109 112 0 >> 377 3.202 1.688 1 U 4.058e+003 0.00e+000 e 0 121 115 0 >> 378 4.446 1.688 1 U 3.170e+003 0.00e+000 e 0 109 115 0 >> 381 3.202 1.630 1 U 1.384e+003 0.00e+000 e 0 121 116 0 >> 382 4.446 1.630 1 U 2.994e+003 0.00e+000 e 0 109 116 0 >> 384 3.202 7.158 1 U 1.185e+003 0.00e+000 e 0 121 123 0 >> 387 1.688 7.158 1 U 2.430e+002 0.00e+000 e 0 115 123 0 >> 388 1.630 7.158 1 U 2.210e+002 0.00e+000 e 0 116 123 0 >> 389 0.957 8.015 1 U 3.362e+003 0.00e+000 e 0 104 107 0 >> 390 4.095 8.015 1 U 2.691e+003 0.00e+000 e 0 91 107 0 >> 391 7.333 7.333 1 U 0.000e+000 0.00e+000 - 0 455 455 0 >> 392 6.535 6.535 1 U 0.000e+000 0.00e+000 - 0 456 456 0 >> 393 7.333 6.535 1 U 2.303e+004 0.00e+000 e 0 455 456 0 >> 394 6.535 7.333 1 U 2.913e+004 0.00e+000 e 0 456 455 0 >> 395 2.424 7.333 1 U 3.340e+002 0.00e+000 e 0 452 455 0 >> 396 8.105 8.105 1 U 0.000e+000 0.00e+000 - 0 33 33 0 >> 397 7.884 7.884 1 U 0.000e+000 0.00e+000 - 0 7 7 0 >> 398 8.105 7.884 1 U 8.870e+002 0.00e+000 e 0 33 7 0 >> 399 7.884 8.105 1 U 2.789e+003 0.00e+000 e 0 7 33 0 >> 400 4.272 7.884 1 U 1.413e+003 0.00e+000 e 0 9 7 0 >> 401 4.394 8.105 1 U 2.962e+003 0.00e+000 e 0 35 33 0 >> 402 2.048 7.884 1 U 4.076e+003 0.00e+000 e 0 1 7 0 >> 403 7.741 7.741 1 U 0.000e+000 0.00e+000 - 0 384 384 0 >> 404 4.292 7.741 1 U 3.770e+003 0.00e+000 e 0 386 384 0 >> 405 1.755 7.741 1 U 1.361e+003 0.00e+000 e 0 388 384 0 >> 406 1.646 7.741 1 U 7.040e+002 0.00e+000 e 0 389 384 0 >> 407 0.928 7.741 1 U 6.200e+002 0.00e+000 e 0 393 384 0 >> 408 0.901 7.741 1 U 6.170e+002 0.00e+000 e 0 394 384 0 >> 410 4.292 4.283 1 U 0.000e+000 0.00e+000 - 0 386 386 0 >> 411 1.739 4.283 1 U 1.943e+003 0.00e+000 e 0 388 386 0 >> 412 1.646 4.283 1 U 8.650e+002 0.00e+000 e 0 389 386 0 >> 413 0.928 4.286 1 U 7.250e+002 0.00e+000 e 0 393 386 0 >> 414 0.901 4.286 1 U 9.690e+002 0.00e+000 e 0 394 386 0 >> 416 1.739 1.753 1 U 0.000e+000 0.00e+000 - 0 388 388 0 >> 417 1.646 1.646 1 U 0.000e+000 0.00e+000 - 0 389 389 0 >> 418 0.928 0.928 1 U 0.000e+000 0.00e+000 - 0 393 393 0 >> 419 0.901 0.901 1 U 0.000e+000 0.00e+000 - 0 394 394 0 >> 424 1.747 1.747 1 U 0.000e+000 0.00e+000 - 0 392 392 0 >> 425 0.928 1.747 1 U 3.603e+003 0.00e+000 e 0 393 392 0 >> 426 0.901 1.747 1 U 5.880e+003 0.00e+000 e 0 394 392 0 >> 431 7.906 7.906 1 U 0.000e+000 0.00e+000 - 0 377 377 0 >> 433 7.906 7.741 1 U 2.789e+003 0.00e+000 e 0 377 384 0 >> 434 3.954 7.906 1 U 6.281e+003 0.00e+000 e 0 379 377 0 >> 435 3.885 7.906 1 U 7.343e+003 0.00e+000 e 0 380 377 0 >> 436 3.954 3.954 1 U 0.000e+000 0.00e+000 - 0 379 379 0 >> 437 3.885 3.894 1 U 0.000e+000 0.00e+000 - 0 380 380 0 >> 440 3.894 7.741 1 U 2.000e+003 0.00e+000 e 0 380 384 0 >> 441 3.954 7.741 1 U 2.042e+003 0.00e+000 e 0 379 384 0 >> 442 7.978 7.978 1 U 0.000e+000 0.00e+000 - 0 355 355 0 >> 443 4.210 7.978 1 U 3.853e+003 0.00e+000 e 0 357 355 0 >> 444 1.804 7.978 1 U 1.843e+003 0.00e+000 e 0 359 355 0 >> 445 1.608 7.978 1 U 1.158e+003 0.00e+000 e 0 360 355 0 >> 446 0.909 7.978 1 U 1.181e+003 0.00e+000 e 0 374 355 0 >> 447 4.210 4.210 1 U 0.000e+000 0.00e+000 - 0 357 357 0 >> 448 1.804 1.804 1 U 0.000e+000 0.00e+000 - 0 359 359 0 >> 449 1.608 1.608 1 U 0.000e+000 0.00e+000 - 0 360 360 0 >> 450 0.909 0.927 1 U 0.000e+000 0.00e+000 - 0 374 374 0 >> 453 1.608 1.804 1 U 1.659e+004 0.00e+000 e 0 360 359 0 >> 459 1.797 1.804 1 U 0.000e+000 0.00e+000 - 0 363 363 0 >> 460 0.917 1.804 1 U 1.061e+004 0.00e+000 e 0 374 363 0 >> 463 7.784 7.784 1 U 0.000e+000 0.00e+000 - 0 61 61 0 >> 464 8.105 7.784 1 U 2.206e+003 0.00e+000 e 0 33 61 0 >> 465 7.784 8.105 1 U 2.604e+003 0.00e+000 e 0 61 33 0 >> 466 7.784 8.115 1 U 1.172e+003 0.00e+000 e 0 61 82 0 >> 467 8.115 7.784 1 U 9.530e+002 0.00e+000 e 0 82 61 0 >> 468 4.205 7.784 1 U 2.055e+003 0.00e+000 e 0 63 61 0 >> 469 1.898 7.784 1 U 4.067e+003 0.00e+000 e 0 65 61 0 >> 470 1.524 7.784 1 U 8.330e+002 0.00e+000 e 0 72 61 0 >> 471 1.206 7.784 1 U 1.462e+003 0.00e+000 e 0 73 61 0 >> 472 0.965 7.784 1 U 1.079e+003 0.00e+000 e 0 66 61 0 >> 473 4.205 4.205 1 U 0.000e+000 0.00e+000 - 0 63 63 0 >> 474 1.898 1.898 1 U 0.000e+000 0.00e+000 - 0 65 65 0 >> 475 1.524 1.524 1 U 0.000e+000 0.00e+000 - 0 72 72 0 >> 476 1.206 1.206 1 U 0.000e+000 0.00e+000 - 0 73 73 0 >> 477 0.965 0.965 1 U 0.000e+000 0.00e+000 - 0 66 66 0 >> 478 1.898 4.205 1 U 3.453e+003 0.00e+000 e 0 65 63 0 >> 479 1.524 4.205 1 U 7.820e+002 0.00e+000 e 0 72 63 0 >> 480 1.206 4.205 1 U 3.610e+002 0.00e+000 e 0 73 63 0 >> 481 0.965 4.205 1 U 9.590e+002 0.00e+000 e 0 66 63 0 >> 482 0.909 4.205 1 U 3.812e+003 0.00e+000 e 0 75 63 0 >> 485 0.965 1.898 1 U 3.192e+003 0.00e+000 e 0 66 65 0 >> 486 4.205 1.898 1 U 3.703e+003 0.00e+000 e 0 63 65 0 >> 487 1.206 1.524 1 U 2.370e+003 0.00e+000 e 0 73 72 0 >> 489 4.205 1.524 1 U 1.098e+003 0.00e+000 e 0 63 72 0 >> 491 1.524 1.206 1 U 8.322e+003 0.00e+000 e 0 72 73 0 >> 493 4.205 1.206 1 U 7.700e+002 0.00e+000 e 0 63 73 0 >> 494 1.206 0.965 1 U 1.073e+003 0.00e+000 e 0 73 66 0 >> 495 1.524 0.965 1 U 1.468e+003 0.00e+000 e 0 72 66 0 >> 496 1.898 0.965 1 U 3.886e+003 0.00e+000 e 0 65 66 0 >> 497 4.205 0.965 1 U 1.384e+003 0.00e+000 e 0 63 66 0 >> 498 0.909 0.909 1 U 0.000e+000 0.00e+000 - 0 75 75 0 >> 499 4.205 0.909 1 U 1.826e+003 0.00e+000 e 0 63 75 0 >> 505 4.394 7.784 1 U 5.409e+003 0.00e+000 e 0 35 61 0 >> 507 1.849 7.884 1 U 4.647e+003 0.00e+000 e 0 13 7 0 >> 510 4.272 4.272 1 U 0.000e+000 0.00e+000 - 0 9 9 0 >> 515 3.002 3.002 1 U 0.000e+000 0.00e+000 - 0 25 25 0 >> 516 1.849 3.002 1 U 2.590e+002 0.00e+000 e 0 13 25 0 >> 517 1.517 3.002 1 U 3.580e+002 0.00e+000 e 0 15 25 0 >> 518 1.456 3.002 1 U 2.140e+002 0.00e+000 e 0 16 25 0 >> 520 1.849 1.849 1 U 0.000e+000 0.00e+000 - 0 13 13 0 >> 521 1.517 1.514 1 U 0.000e+000 0.00e+000 - 0 15 15 0 >> 522 1.456 1.456 1 U 0.000e+000 0.00e+000 - 0 16 16 0 >> 523 1.517 1.849 1 U 1.631e+003 0.00e+000 e 0 15 13 0 >> 525 1.849 1.517 1 U 3.167e+003 0.00e+000 e 0 13 15 0 >> 529 4.272 1.517 1 U 2.350e+002 0.00e+000 e 0 9 15 0 >> 531 4.272 1.456 1 U 3.220e+002 0.00e+000 e 0 9 16 0 >> 549 4.272 8.105 1 U 2.714e+003 0.00e+000 e 0 9 33 0 >> 550 7.859 7.859 1 U 0.000e+000 0.00e+000 - 0 269 269 0 >> 551 8.001 7.859 1 U 2.839e+003 0.00e+000 e 0 290 269 0 >> 553 3.918 7.859 1 U 4.727e+003 0.00e+000 e 0 271 269 0 >> 554 1.926 7.859 1 U 1.880e+003 0.00e+000 e 0 273 269 0 >> 555 1.609 7.859 1 U 7.630e+002 0.00e+000 e 0 280 269 0 >> 556 1.189 7.859 1 U 8.840e+002 0.00e+000 e 0 281 269 0 >> 557 0.923 7.859 1 U 1.099e+003 0.00e+000 e 0 274 269 0 >> 558 3.918 3.918 1 U 0.000e+000 0.00e+000 - 0 271 271 0 >> 559 1.926 1.926 1 U 0.000e+000 0.00e+000 - 0 273 273 0 >> 560 1.609 1.609 1 U 0.000e+000 0.00e+000 - 0 280 280 0 >> 561 1.189 1.189 1 U 0.000e+000 0.00e+000 - 0 281 281 0 >> 562 0.923 0.923 1 U 0.000e+000 0.00e+000 - 0 274 274 0 >> 563 1.926 3.918 1 U 0.000e+000 0.00e+000 - 0 273 271 0 >> 564 1.609 3.918 1 U 0.000e+000 0.00e+000 - 0 280 271 0 >> 565 1.189 3.918 1 U 0.000e+000 0.00e+000 - 0 281 271 0 >> 566 0.923 3.918 1 U 0.000e+000 0.00e+000 - 0 274 271 0 >> 567 0.889 3.918 1 U 0.000e+000 0.00e+000 - 0 283 271 0 >> 572 1.189 1.609 1 U 3.296e+003 0.00e+000 e 0 281 280 0 >> 574 1.926 1.609 1 U 3.730e+003 0.00e+000 e 0 273 280 0 >> 575 3.918 1.609 1 U 2.256e+003 0.00e+000 e 0 271 280 0 >> 576 0.861 1.190 1 U 5.990e+002 0.00e+000 e 0 283 281 0 >> 577 1.609 1.189 1 U 1.524e+003 0.00e+000 e 0 280 281 0 >> 579 3.918 1.189 1 U 2.286e+003 0.00e+000 e 0 271 281 0 >> 581 3.918 0.923 1 U 1.423e+003 0.00e+000 e 0 271 274 0 >> 582 0.889 0.889 1 U 0.000e+000 0.00e+000 - 0 283 283 0 >> 584 1.609 0.889 1 U 3.458e+003 0.00e+000 e 0 280 283 0 >> 585 1.926 0.889 1 U 3.520e+003 0.00e+000 e 0 273 283 0 >> 586 3.918 0.889 1 U 4.600e+002 0.00e+000 e 0 271 283 0 >> 587 1.189 0.923 1 U 4.168e+003 0.00e+000 e 0 281 274 0 >> 588 1.609 0.923 1 U 3.931e+003 0.00e+000 e 0 280 274 0 >> 589 1.926 0.923 1 U 4.655e+003 0.00e+000 e 0 273 274 0 >> 591 1.609 1.926 1 U 3.431e+003 0.00e+000 e 0 280 273 0 >> 592 1.189 1.926 1 U 1.498e+003 0.00e+000 e 0 281 273 0 >> 593 0.923 1.926 1 U 5.906e+003 0.00e+000 e 0 274 273 0 >> 594 3.918 1.926 1 U 2.649e+003 0.00e+000 e 0 271 273 0 >> 601 3.918 8.001 1 U 1.988e+003 0.00e+000 e 0 271 290 0 >> 602 7.741 7.989 1 U 4.156e+003 0.00e+000 e 0 384 406 0 >> 603 7.989 7.741 1 U 3.828e+003 0.00e+000 e 0 406 384 0 >> 604 4.446 7.895 1 U 3.975e+003 0.00e+000 e 0 109 135 0 >> 605 4.210 7.906 1 U 2.716e+003 0.00e+000 e 0 357 377 0 >> 606 8.120 8.120 1 U 0.000e+000 0.00e+000 - 0 333 333 0 >> 607 7.978 8.120 1 U 4.313e+003 0.00e+000 e 0 355 333 0 >> 609 4.278 8.120 1 U 2.080e+003 0.00e+000 e 0 335 333 0 >> 610 1.614 8.120 1 U 3.318e+003 0.00e+000 e 0 338 333 0 >> 611 0.928 8.120 1 U 2.265e+003 0.00e+000 e 0 342 333 0 >> 612 1.819 8.120 1 U 2.605e+003 0.00e+000 e 0 337 333 0 >> 613 4.278 4.278 1 U 0.000e+000 0.00e+000 - 0 335 335 0 >> 614 1.819 1.819 1 U 0.000e+000 0.00e+000 - 0 337 337 0 >> 615 1.614 1.614 1 U 0.000e+000 0.00e+000 - 0 338 338 0 >> 616 0.928 0.928 1 U 0.000e+000 0.00e+000 - 0 342 342 0 >> 618 1.819 4.278 1 U 5.730e+002 0.00e+000 e 0 337 335 0 >> 619 1.614 4.278 1 U 9.870e+002 0.00e+000 e 0 338 335 0 >> 621 4.278 1.819 1 U 3.373e+003 0.00e+000 e 0 335 337 0 >> 623 4.278 1.614 1 U 2.402e+003 0.00e+000 e 0 335 338 0 >> 625 4.278 0.928 1 U 9.740e+002 0.00e+000 e 0 335 342 0 >> 627 1.427 1.421 1 U 0.000e+000 0.00e+000 - 0 224 224 0 >> 628 1.847 1.421 1 U 3.150e+003 0.00e+000 e 0 221 224 0 >> 632 2.988 1.421 1 U 5.280e+002 0.00e+000 e 0 233 224 0 >> 634 1.416 2.988 1 U 1.395e+003 0.00e+000 e 0 224 233 0 >> 635 1.857 2.988 1 U 5.180e+002 0.00e+000 e 0 221 233 0 >> 637 1.421 1.864 1 U 4.231e+003 0.00e+000 e 0 224 221 0 >> 639 1.421 1.723 1 U 3.746e+003 0.00e+000 e 0 224 229 0 >> 640 1.428 4.132 1 U 2.344e+003 0.00e+000 e 0 224 217 0 >> 642 1.434 8.111 1 U 1.471e+003 0.00e+000 e 0 224 215 0 >> 643 1.749 7.989 1 U 1.442e+003 0.00e+000 e 0 420 406 0 >> 644 3.034 1.512 1 U 8.520e+002 0.00e+000 e 0 424 416 0 >> 647 4.224 8.096 1 U 2.759e+003 0.00e+000 e 0 408 432 0 >> 648 7.885 7.885 1 U 0.000e+000 0.00e+000 - 0 241 241 0 >> 649 8.111 7.885 1 U 1.065e+003 0.00e+000 e 0 215 241 0 >> 650 7.885 8.111 1 U 2.752e+003 0.00e+000 e 0 241 215 0 >> 651 4.208 7.885 1 U 2.435e+003 0.00e+000 e 0 243 241 0 >> 652 3.216 7.885 1 U 3.750e+002 0.00e+000 e 0 255 241 0 >> 653 1.933 7.885 1 U 6.053e+003 0.00e+000 e 0 247 241 0 >> 656 3.216 3.216 1 U 0.000e+000 0.00e+000 - 0 255 255 0 >> 657 4.208 4.208 1 U 0.000e+000 0.00e+000 - 0 243 243 0 >> 658 1.933 1.933 1 U 0.000e+000 0.00e+000 - 0 247 247 0 >> 659 1.744 1.744 1 U 0.000e+000 0.00e+000 - 0 249 249 0 >> 660 1.706 1.706 1 U 0.000e+000 0.00e+000 - 0 250 250 0 >> 662 1.933 3.216 1 U 3.223e+003 0.00e+000 e 0 247 255 0 >> 663 1.744 3.216 1 U 4.750e+003 0.00e+000 e 0 249 255 0 >> 664 1.706 3.216 1 U 5.854e+003 0.00e+000 e 0 250 255 0 >> 665 3.216 4.208 1 U 1.800e+002 0.00e+000 e 0 255 243 0 >> 666 1.933 4.208 1 U 5.593e+003 0.00e+000 e 0 247 243 0 >> 669 3.216 1.933 1 U 2.888e+003 0.00e+000 e 0 255 247 0 >> 670 4.208 1.933 1 U 1.257e+004 0.00e+000 e 0 243 247 0 >> 678 7.218 7.218 1 U 0.000e+000 0.00e+000 - 0 257 257 0 >> 679 3.216 7.218 1 U 1.741e+003 0.00e+000 e 0 255 257 0 >> 680 1.933 7.218 1 U 9.820e+002 0.00e+000 e 0 247 257 0 >> 681 1.744 7.218 1 U 6.490e+002 0.00e+000 e 0 249 257 0 >> 682 1.706 7.218 1 U 6.730e+002 0.00e+000 e 0 250 257 0 >> 691 1.450 3.137 1 U 2.730e+002 0.00e+000 e 0 293 306 0 >> 695 3.137 4.208 1 U 1.133e+003 0.00e+000 e 0 306 243 0 >> 696 3.983 7.975 1 U 1.856e+003 0.00e+000 e 0 328 323 0 >> 697 3.983 3.983 1 U 0.000e+000 0.00e+000 - 0 328 328 0 >> 698 4.147 4.147 1 U 0.000e+000 0.00e+000 - 0 327 327 0 >> 700 4.354 4.354 1 U 0.000e+000 0.00e+000 - 0 325 325 0 >> 701 3.983 4.147 1 U 9.543e+003 0.00e+000 e 0 328 327 0 >> 702 4.354 4.147 1 U 1.011e+003 0.00e+000 e 0 325 327 0 >> 704 4.147 3.983 1 U 8.628e+003 0.00e+000 e 0 327 328 0 >> 705 4.354 3.983 1 U 1.474e+003 0.00e+000 e 0 325 328 0 >> 708 4.354 8.120 1 U 2.788e+003 0.00e+000 e 0 325 333 0 >> 709 4.295 7.989 1 U 2.865e+003 0.00e+000 e 0 386 406 0 >> 710 4.132 7.885 1 U 1.835e+003 0.00e+000 e 0 217 241 0 >> 711 1.892 8.105 1 U 1.976e+003 0.00e+000 e 0 37 33 0 >> 712 1.788 8.105 1 U 2.270e+003 0.00e+000 e 0 38 33 0 >> 713 1.700 8.105 1 U 1.335e+003 0.00e+000 e 0 41 33 0 >> 714 1.629 8.105 1 U 1.106e+003 0.00e+000 e 0 42 33 0 >> 715 4.394 4.394 1 U 0.000e+000 0.00e+000 - 0 35 35 0 >> 716 1.892 1.913 1 U 0.000e+000 0.00e+000 - 0 37 37 0 >> 717 1.788 1.792 1 U 0.000e+000 0.00e+000 - 0 38 38 0 >> 718 1.700 1.688 1 U 0.000e+000 0.00e+000 - 0 41 41 0 >> 719 1.629 1.619 1 U 0.000e+000 0.00e+000 - 0 42 42 0 >> 720 3.202 3.202 1 U 0.000e+000 0.00e+000 - 0 47 47 0 >> 721 1.902 3.202 1 U 2.229e+003 0.00e+000 e 0 37 47 0 >> 722 1.784 3.202 1 U 1.629e+003 0.00e+000 e 0 38 47 0 >> 723 1.703 3.202 1 U 1.519e+003 0.00e+000 e 0 41 47 0 >> 724 1.628 3.202 1 U 1.649e+003 0.00e+000 e 0 42 47 0 >> 726 4.394 3.202 1 U 5.640e+002 0.00e+000 e 0 35 47 0 >> 727 3.202 1.913 1 U 2.050e+003 0.00e+000 e 0 47 37 0 >> 728 4.394 1.913 1 U 1.306e+003 0.00e+000 e 0 35 37 0 >> 729 3.202 1.792 1 U 1.788e+003 0.00e+000 e 0 47 38 0 >> 732 3.202 1.702 1 U 2.208e+003 0.00e+000 e 0 47 41 0 >> 733 3.202 1.636 1 U 5.460e+002 0.00e+000 e 0 47 42 0 >> 739 7.149 7.149 1 U 0.000e+000 0.00e+000 - 0 49 49 0 >> 741 3.202 7.149 1 U 1.409e+003 0.00e+000 e 0 47 49 0 >> 746 1.722 3.002 1 U 2.008e+003 0.00e+000 e 0 21 25 0 >> 747 1.722 1.722 1 U 0.000e+000 0.00e+000 - 0 21 21 0 >> 748 3.002 1.722 1 U 3.635e+003 0.00e+000 e 0 25 21 0 >> 749 4.208 7.126 1 U 5.490e+002 0.00e+000 e 0 243 307 0 >> 751 4.210 7.741 1 U 4.830e+002 0.00e+000 e 0 357 384 0 >> 752 4.208 7.859 1 U 2.794e+003 0.00e+000 e 0 243 269 0 >> 753 4.277 7.978 1 U 1.985e+003 0.00e+000 e 0 335 355 0 >> 755 3.983 8.120 1 U 1.727e+003 0.00e+000 e 0 328 333 0 >> 757 4.594 7.885 1 U 8.010e+002 0.00e+000 e 0 182 241 0 >> 763 4.205 8.115 1 U 2.566e+003 0.00e+000 e 0 63 82 0 >> 780 1.450 7.126 1 U 2.350e+002 0.00e+000 e 0 293 307 0 >> 799 1.609 7.218 1 U 3.320e+002 0.00e+000 e 0 280 257 0 >> 800 0.877 7.218 1 U 1.056e+003 0.00e+000 e 0 283 257 0 >> 801 0.923 7.218 1 U 3.460e+002 0.00e+000 e 0 274 257 0 >> 803 2.226 7.838 1 U 8.030e+002 0.00e+000 e 0 446 460 0 >> 805 1.778 7.784 1 U 9.770e+002 0.00e+000 e 0 38 61 0 >> 811 3.679 7.895 1 U 7.290e+002 0.00e+000 e 0 169 135 0 >> 817 1.189 8.001 1 U 4.480e+002 0.00e+000 e 0 281 290 0 >> 818 0.923 8.001 1 U 1.139e+003 0.00e+000 e 0 274 290 0 >> 819 1.926 8.001 1 U 3.412e+003 0.00e+000 e 0 273 290 0 >> 822 1.436 7.885 1 U 7.660e+002 0.00e+000 e 0 224 241 0 >> 824 0.877 7.859 1 U 1.415e+003 0.00e+000 e 0 283 269 0 >> 825 0.909 7.784 1 U 2.440e+002 0.00e+000 e 0 75 61 0 >> 829 1.701 4.132 1 U 4.770e+002 0.00e+000 e 0 229 217 0 >> 851 4.458 0.927 1 U 4.060e+002 0.00e+000 e 0 159 154 0 >> 853 4.446 0.957 1 U 4.070e+002 0.00e+000 e 0 109 104 0 >> 854 4.224 1.004 1 U 8.270e+002 0.00e+000 e 0 408 475 0 >> 856 3.966 0.957 1 U 4.360e+002 0.00e+000 e 0 84 104 0 >> 857 3.937 0.957 1 U 3.680e+002 0.00e+000 e 0 85 104 0 >> 859 3.137 1.450 1 U 2.060e+002 0.00e+000 e 0 306 293 0 >> 862 3.202 0.965 1 U 3.150e+002 0.00e+000 e 0 47 66 0 >> 863 3.202 0.909 1 U 8.600e+001 0.00e+000 e 0 47 75 0 >> 864 1.446 1.849 1 U 9.850e+002 0.00e+000 e 0 16 13 0 >> 865 1.836 1.456 1 U 1.467e+003 0.00e+000 e 0 13 16 0 >> 866 1.519 1.898 1 U 2.321e+003 0.00e+000 e 0 72 65 0 >> 867 1.898 1.524 1 U 2.879e+003 0.00e+000 e 0 65 72 0 >> 868 4.458 3.860 1 U 2.279e+003 0.00e+000 e 0 159 168 0 >> 876 1.706 1.933 1 U 3.610e+003 0.00e+000 e 0 250 247 0 >> 877 1.744 1.933 1 U 4.583e+003 0.00e+000 e 0 249 247 0 >> 879 0.868 1.926 1 U 1.287e+003 0.00e+000 e 0 283 273 0 >> 883 1.607 1.819 1 U 1.335e+004 0.00e+000 e 0 338 337 0 >> 884 1.813 1.614 1 U 2.275e+004 0.00e+000 e 0 337 338 0 >> 885 0.923 1.819 1 U 3.916e+003 0.00e+000 e 0 342 337 0 >> 886 0.927 1.614 1 U 5.266e+003 0.00e+000 e 0 342 338 0 >> 889 0.905 0.905 1 U 0.000e+000 0.00e+000 - 0 343 343 0 >> 890 1.602 0.905 1 U 1.335e+004 0.00e+000 e 0 338 343 0 >> 893 0.905 1.614 1 U 6.219e+003 0.00e+000 e 0 343 338 0 >> 894 0.899 1.819 1 U 5.948e+003 0.00e+000 e 0 343 337 0 >> 897 0.908 8.120 1 U 2.722e+003 0.00e+000 e 0 343 333 0 >> 898 7.741 7.906 1 U 4.576e+003 0.00e+000 e 0 384 377 0 >> 900 8.096 7.741 1 U 2.560e+002 0.00e+000 e 0 432 384 0 >> 901 1.914 1.512 1 U 7.356e+003 0.00e+000 e 0 411 416 0 >> 903 2.424 2.230 1 U 7.750e+003 0.00e+000 e 0 452 446 0 >> 913 4.147 7.975 1 U 1.251e+003 0.00e+000 e 0 327 323 0 >> 914 1.816 4.272 1 U 2.540e+002 0.00e+000 e 0 13 9 0 >> 915 1.804 4.210 1 U 3.467e+003 0.00e+000 e 0 359 357 0 >> 916 1.605 4.210 1 U 2.655e+003 0.00e+000 e 0 360 357 0 >> 917 1.922 4.224 1 U 3.073e+003 0.00e+000 e 0 411 408 0 >> 918 1.512 4.224 1 U 9.720e+002 0.00e+000 e 0 416 408 0 >> 922 2.127 2.325 1 U 5.840e+003 0.00e+000 e 0 165 161 0 >> 923 2.071 2.325 1 U 3.075e+003 0.00e+000 e 0 166 161 0 >> 924 2.127 1.995 1 U 7.670e+003 0.00e+000 e 0 165 162 0 >> 925 4.354 1.450 1 U 4.440e+002 0.00e+000 e 0 302 293 0 >> 926 4.288 2.424 1 U 5.000e+002 0.00e+000 e 0 386 452 0 >> 927 4.594 1.933 1 U 1.873e+003 0.00e+000 e 0 182 247 0 >> 928 1.604 4.136 1 U 5.310e+002 0.00e+000 e 0 338 292 0 >> 929 1.817 4.136 1 U 6.640e+002 0.00e+000 e 0 337 292 0 >> 932 4.354 1.608 1 U 8.820e+002 0.00e+000 e 0 302 360 0 >> 933 4.354 1.804 1 U 1.340e+003 0.00e+000 e 0 302 359 0 >> 936 4.277 1.753 1 U 9.990e+002 0.00e+000 e 0 335 388 0 >> 937 4.277 1.646 1 U 9.350e+002 0.00e+000 e 0 335 389 0 >> 938 4.208 1.918 1 U 5.505e+003 0.00e+000 e 0 357 411 0 >> 947 4.131 8.001 1 U 1.866e+003 0.00e+000 e 0 217 290 0 >> 949 4.203 8.147 1 U 1.669e+003 0.00e+000 e 0 243 300 0 >> 950 4.132 8.147 1 U 8.210e+002 0.00e+000 e 0 217 300 0 >> 951 3.915 7.975 1 U 1.359e+003 0.00e+000 e 0 271 323 0 >> 953 4.138 8.120 1 U 1.208e+003 0.00e+000 e 0 292 333 0 >> 954 3.926 8.120 1 U 9.500e+002 0.00e+000 e 0 271 333 0 >> 955 4.131 7.978 1 U 4.170e+002 0.00e+000 e 0 292 355 0 >> 956 4.354 7.978 1 U 1.557e+003 0.00e+000 e 0 302 355 0 >> 957 4.274 7.906 1 U 2.220e+002 0.00e+000 e 0 335 377 0 >> 958 4.354 7.906 1 U 1.028e+003 0.00e+000 e 0 325 377 0 >> 960 4.354 7.741 1 U 4.990e+002 0.00e+000 e 0 325 384 0 >> 961 4.271 7.741 1 U 1.730e+003 0.00e+000 e 0 335 384 0 >> 962 4.212 7.989 1 U 1.755e+003 0.00e+000 e 0 357 406 0 >> 964 4.290 8.019 1 U 1.394e+003 0.00e+000 e 0 386 442 0 >> 966 0.906 7.126 1 U 3.960e+002 0.00e+000 e 0 374 307 0 >> 967 0.906 6.815 1 U 2.090e+002 0.00e+000 e 0 374 308 0 >> 985 8.275 8.226 1 U 1.682e+003 0.00e+000 e 0 173 180 0 >> 986 8.120 7.975 1 U 5.746e+003 0.00e+000 e 0 333 323 0 >> 990 0.917 8.147 1 U 1.508e+003 0.00e+000 e 0 274 300 0 >> 993 0.901 3.034 1 U 3.280e+002 0.00e+000 e 0 394 424 0 >> 996 0.921 4.136 1 U 1.502e+003 0.00e+000 e 0 274 292 0 >> 998 3.856 1.622 1 U 1.722e+003 0.00e+000 e 0 168 139 0 >> 999 3.676 1.622 1 U 1.642e+003 0.00e+000 e 0 169 139 0 >>1000 1.517 1.722 1 U 2.674e+004 0.00e+000 e 0 15 21 0 >>1002 7.906 7.978 1 U 3.141e+003 0.00e+000 e 0 377 355 0 >>1003 4.186 7.859 1 U 1.585e+003 0.00e+000 e 0 199 269 0 >>1005 1.923 4.183 1 U 8.650e+002 0.00e+000 e 0 273 199 0 >>1006 1.449 4.132 1 U 1.860e+003 0.00e+000 e 0 293 217 0 >>1007 4.207 8.096 1 U 1.480e+003 0.00e+000 e 0 357 432 0 >>1008 4.289 8.096 1 U 1.427e+003 0.00e+000 e 0 386 432 0 >>1009 4.277 7.989 1 U 1.171e+003 0.00e+000 e 0 335 406 0 >>1010 4.361 7.906 1 U 4.950e+002 0.00e+000 e 0 302 377 0 >>1011 4.208 7.973 1 U 5.970e+002 0.00e+000 e 0 243 323 0 >>1013 4.137 3.137 1 U 4.680e+002 0.00e+000 e 0 217 306 0 >>1014 0.912 3.137 1 U 5.670e+002 0.00e+000 e 0 374 306 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 . . 6500 . . . . . . . 34138 1 >> 2 . . H 1 H . . 6500 . . . . . . . 34138 1 >> >> stop_ >> >>save_ >> ; save_