data_30538 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of alpha-KTx-6.21 (UroTx) from Urodacus yaschenkoi ; _BMRB_accession_number 30538 _BMRB_flat_file_name bmr30538.str _Entry_type original _Submission_date 2018-11-05 _Accession_date 2018-11-05 _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 Chin Y. K.-Y. . 2 Luna-Ramirez K. . . 3 Anangi R. . . 4 King G. F. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 spectral_peak_list 3 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 199 "13C chemical shifts" 140 "15N chemical shifts" 40 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-03-05 original BMRB . stop_ _Original_release_date 2018-11-07 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Molecular determinants of the binding or urotoxin and its analogues in Kv1 channels ; _Citation_status 'in preparation' _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Luna-Ramirez K. . . 2 Finol-Urdaneta R. . . 3 McArthur J. . . 4 Anangi R. . . 5 Chin Y. K.-Y. . 6 Costi A. . . 7 Panyi G. . . 8 Najera R. . . 9 Gurrola G. . . 10 Possani L. D. . 11 Adams D. J. . 12 King G. F. . stop_ _Journal_abbreviation . _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 . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Potassium channel toxin alpha-KTx 6.21' _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 4028.794 _Mol_thiol_state 'all disulfide bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 37 _Mol_residue_sequence ; GDIKCSGTRQCWGPCKKQTT CTNSKCMNGKCKCYGCV ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 ASP 3 ILE 4 LYS 5 CYS 6 SER 7 GLY 8 THR 9 ARG 10 GLN 11 CYS 12 TRP 13 GLY 14 PRO 15 CYS 16 LYS 17 LYS 18 GLN 19 THR 20 THR 21 CYS 22 THR 23 ASN 24 SER 25 LYS 26 CYS 27 MET 28 ASN 29 GLY 30 LYS 31 CYS 32 LYS 33 CYS 34 TYR 35 GLY 36 CYS 37 VAL 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 $entity_1 'Inland robust scorpion' 1273102 Eukaryota Metazoa Urodacus yaschenkoi stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity_1 'recombinant technology' . Escherichia coli BL21 . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '200 uM [U-13C; U-15N] UroTx, 20 mM sodium acetate, 5 % D2O, 95% H2O/5% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 200 uM '[U-13C; U-15N]' 'sodium acetate' 20 mM 'natural abundance' D2O 5 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' refinement 'structure calculation' stop_ _Details . save_ save_software_2 _Saveframe_category software _Name Analysis _Version . loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ save_software_3 _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ save_software_4 _Saveframe_category software _Name TALOS-N _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'geometry optimization' stop_ _Details . save_ save_software_5 _Saveframe_category software _Name 'Rowland NMR Toolkit' _Version . loop_ _Vendor _Address _Electronic_address http://www.rowland.org/rnmrtk/toolkit.html . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AvanceIII _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aliphatic_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aromatic_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _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 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 water C 13 protons ppm 4.754664603 external indirect . . . 0.25144953 water H 1 protons ppm 4.754664603 external direct . . . 1 water N 15 protons ppm 4.754664603 external indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCO' '3D HNCACB' '3D HBHA(CO)NH' '3D 1H-15N NOESY' '3D 1H-13C NOESY aliphatic' '3D 1H-13C NOESY aromatic' 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 GLY HA2 H 3.800 0.040 2 2 1 1 GLY C C 169.683 0.500 1 3 1 1 GLY CA C 43.310 0.500 1 4 2 2 ASP H H 8.600 0.040 1 5 2 2 ASP HA H 4.651 0.040 1 6 2 2 ASP HB2 H 2.461 0.040 2 7 2 2 ASP HB3 H 2.461 0.040 2 8 2 2 ASP C C 175.631 0.500 1 9 2 2 ASP CA C 54.364 0.500 1 10 2 2 ASP CB C 42.242 0.500 1 11 2 2 ASP N N 120.424 0.500 1 12 3 3 ILE H H 8.909 0.040 1 13 3 3 ILE HA H 4.125 0.040 1 14 3 3 ILE HB H 1.535 0.040 1 15 3 3 ILE HG12 H 1.498 0.040 2 16 3 3 ILE HG13 H 1.099 0.040 2 17 3 3 ILE HG2 H 0.854 0.040 1 18 3 3 ILE HD1 H 0.769 0.040 1 19 3 3 ILE C C 175.309 0.500 1 20 3 3 ILE CA C 60.297 0.500 1 21 3 3 ILE CB C 39.468 0.500 1 22 3 3 ILE CG1 C 26.650 0.500 1 23 3 3 ILE CG2 C 18.184 0.500 1 24 3 3 ILE CD1 C 13.190 0.500 1 25 3 3 ILE N N 124.080 0.500 1 26 4 4 LYS H H 8.397 0.040 1 27 4 4 LYS HA H 4.649 0.040 1 28 4 4 LYS HB2 H 1.758 0.040 2 29 4 4 LYS HB3 H 1.696 0.040 2 30 4 4 LYS C C 175.465 0.500 1 31 4 4 LYS CA C 56.591 0.500 1 32 4 4 LYS CB C 33.289 0.500 1 33 4 4 LYS N N 127.179 0.500 1 34 5 5 CYS H H 8.013 0.040 1 35 5 5 CYS HA H 4.802 0.040 1 36 5 5 CYS HB2 H 3.124 0.040 2 37 5 5 CYS HB3 H 2.918 0.040 2 38 5 5 CYS C C 172.985 0.500 1 39 5 5 CYS CA C 53.869 0.500 1 40 5 5 CYS CB C 46.640 0.500 1 41 5 5 CYS N N 115.248 0.500 1 42 6 6 SER H H 9.041 0.040 1 43 6 6 SER HA H 4.552 0.040 1 44 6 6 SER HB2 H 3.901 0.040 2 45 6 6 SER HB3 H 3.758 0.040 2 46 6 6 SER C C 174.121 0.500 1 47 6 6 SER CA C 57.813 0.500 1 48 6 6 SER CB C 64.105 0.500 1 49 6 6 SER N N 113.812 0.500 1 50 7 7 GLY H H 7.534 0.040 1 51 7 7 GLY HA2 H 4.283 0.040 2 52 7 7 GLY HA3 H 3.926 0.040 2 53 7 7 GLY C C 173.673 0.500 1 54 7 7 GLY CA C 44.559 0.500 1 55 7 7 GLY N N 110.373 0.500 1 56 8 8 THR H H 8.843 0.040 1 57 8 8 THR HA H 3.549 0.040 1 58 8 8 THR HB H 4.087 0.040 1 59 8 8 THR HG2 H 1.300 0.040 1 60 8 8 THR C C 175.135 0.500 1 61 8 8 THR CA C 67.341 0.500 1 62 8 8 THR CB C 69.115 0.500 1 63 8 8 THR CG2 C 24.297 0.500 1 64 8 8 THR N N 120.646 0.500 1 65 9 9 ARG H H 8.461 0.040 1 66 9 9 ARG HA H 2.269 0.040 1 67 9 9 ARG HB2 H 1.233 0.040 2 68 9 9 ARG HB3 H 1.176 0.040 2 69 9 9 ARG HG2 H 0.959 0.040 2 70 9 9 ARG HG3 H 0.854 0.040 2 71 9 9 ARG HD2 H 2.611 0.040 2 72 9 9 ARG HD3 H 2.611 0.040 2 73 9 9 ARG C C 178.131 0.500 1 74 9 9 ARG CA C 57.885 0.500 1 75 9 9 ARG CB C 28.690 0.500 1 76 9 9 ARG CG C 26.868 0.500 1 77 9 9 ARG CD C 42.629 0.500 1 78 9 9 ARG N N 119.316 0.500 1 79 10 10 GLN H H 7.154 0.040 1 80 10 10 GLN HA H 4.027 0.040 1 81 10 10 GLN HB2 H 2.145 0.040 2 82 10 10 GLN HB3 H 2.145 0.040 2 83 10 10 GLN HG2 H 2.408 0.040 2 84 10 10 GLN HG3 H 2.279 0.040 2 85 10 10 GLN HE21 H 7.532 0.040 2 86 10 10 GLN HE22 H 6.869 0.040 2 87 10 10 GLN C C 176.738 0.500 1 88 10 10 GLN CA C 57.570 0.500 1 89 10 10 GLN CB C 28.996 0.500 1 90 10 10 GLN CG C 34.617 0.500 1 91 10 10 GLN N N 115.938 0.500 1 92 10 10 GLN NE2 N 112.277 0.500 1 93 11 11 CYS H H 8.144 0.040 1 94 11 11 CYS HA H 4.676 0.040 1 95 11 11 CYS HB2 H 3.249 0.040 2 96 11 11 CYS HB3 H 3.151 0.040 2 97 11 11 CYS C C 175.663 0.500 1 98 11 11 CYS CA C 54.413 0.500 1 99 11 11 CYS CB C 38.387 0.500 1 100 11 11 CYS N N 114.438 0.500 1 101 12 12 TRP H H 7.293 0.040 1 102 12 12 TRP HA H 4.536 0.040 1 103 12 12 TRP HB2 H 3.303 0.040 2 104 12 12 TRP HB3 H 3.139 0.040 2 105 12 12 TRP HD1 H 7.031 0.040 1 106 12 12 TRP HE1 H 9.856 0.040 1 107 12 12 TRP HE3 H 7.589 0.040 1 108 12 12 TRP HZ2 H 7.419 0.040 1 109 12 12 TRP HZ3 H 7.119 0.040 1 110 12 12 TRP HH2 H 7.191 0.040 1 111 12 12 TRP C C 177.583 0.500 1 112 12 12 TRP CA C 59.944 0.500 1 113 12 12 TRP CB C 29.057 0.500 1 114 12 12 TRP CD1 C 124.992 0.500 1 115 12 12 TRP CE3 C 120.812 0.500 1 116 12 12 TRP CZ2 C 114.272 0.500 1 117 12 12 TRP CZ3 C 122.085 0.500 1 118 12 12 TRP CH2 C 124.769 0.500 1 119 12 12 TRP N N 122.082 0.500 1 120 12 12 TRP NE1 N 127.645 0.500 1 121 13 13 GLY H H 9.080 0.040 1 122 13 13 GLY HA2 H 4.025 0.040 2 123 13 13 GLY HA3 H 3.907 0.040 2 124 13 13 GLY CA C 47.752 0.500 1 125 13 13 GLY N N 105.099 0.500 1 126 14 14 PRO HA H 4.256 0.040 1 127 14 14 PRO HB2 H 1.826 0.040 2 128 14 14 PRO HB3 H 2.436 0.040 2 129 14 14 PRO HG2 H 2.043 0.040 2 130 14 14 PRO HG3 H 2.248 0.040 2 131 14 14 PRO HD2 H 3.720 0.040 2 132 14 14 PRO HD3 H 3.613 0.040 2 133 14 14 PRO C C 180.237 0.500 1 134 14 14 PRO CA C 65.461 0.500 1 135 14 14 PRO CB C 32.685 0.500 1 136 14 14 PRO CG C 27.950 0.500 1 137 14 14 PRO CD C 51.257 0.500 1 138 15 15 CYS H H 8.478 0.040 1 139 15 15 CYS HA H 4.750 0.040 1 140 15 15 CYS HB2 H 3.433 0.040 2 141 15 15 CYS HB3 H 2.909 0.040 2 142 15 15 CYS C C 178.283 0.500 1 143 15 15 CYS CA C 56.068 0.500 1 144 15 15 CYS CB C 33.930 0.500 1 145 15 15 CYS N N 115.051 0.500 1 146 16 16 LYS H H 8.731 0.040 1 147 16 16 LYS HA H 3.715 0.040 1 148 16 16 LYS HB2 H 1.987 0.040 2 149 16 16 LYS HB3 H 1.592 0.040 2 150 16 16 LYS HG2 H 0.934 0.040 2 151 16 16 LYS HG3 H 1.202 0.040 2 152 16 16 LYS HD2 H 1.538 0.040 2 153 16 16 LYS HD3 H 1.438 0.040 2 154 16 16 LYS HE2 H 2.889 0.040 2 155 16 16 LYS HE3 H 2.889 0.040 2 156 16 16 LYS C C 179.846 0.500 1 157 16 16 LYS CA C 59.755 0.500 1 158 16 16 LYS CB C 31.886 0.500 1 159 16 16 LYS CG C 25.259 0.500 1 160 16 16 LYS CD C 29.595 0.500 1 161 16 16 LYS CE C 42.236 0.500 1 162 16 16 LYS N N 128.572 0.500 1 163 17 17 LYS H H 8.152 0.040 1 164 17 17 LYS HA H 3.974 0.040 1 165 17 17 LYS HB2 H 1.891 0.040 2 166 17 17 LYS HB3 H 1.986 0.040 2 167 17 17 LYS HG2 H 1.487 0.040 2 168 17 17 LYS HG3 H 1.405 0.040 2 169 17 17 LYS HD2 H 1.643 0.040 2 170 17 17 LYS HE2 H 2.936 0.040 2 171 17 17 LYS C C 178.093 0.500 1 172 17 17 LYS CA C 59.425 0.500 1 173 17 17 LYS CB C 31.915 0.500 1 174 17 17 LYS CG C 25.029 0.500 1 175 17 17 LYS CD C 29.110 0.500 1 176 17 17 LYS CE C 42.111 0.500 1 177 17 17 LYS N N 121.669 0.500 1 178 18 18 GLN H H 7.594 0.040 1 179 18 18 GLN HA H 4.230 0.040 1 180 18 18 GLN HB2 H 2.220 0.040 2 181 18 18 GLN HB3 H 2.220 0.040 2 182 18 18 GLN HG2 H 2.527 0.040 2 183 18 18 GLN HG3 H 2.323 0.040 2 184 18 18 GLN HE21 H 7.343 0.040 2 185 18 18 GLN HE22 H 6.693 0.040 2 186 18 18 GLN C C 177.890 0.500 1 187 18 18 GLN CA C 58.671 0.500 1 188 18 18 GLN CB C 30.760 0.500 1 189 18 18 GLN CG C 34.102 0.500 1 190 18 18 GLN N N 114.543 0.500 1 191 18 18 GLN NE2 N 110.565 0.500 1 192 19 19 THR H H 8.401 0.040 1 193 19 19 THR HA H 4.900 0.040 1 194 19 19 THR HB H 4.509 0.040 1 195 19 19 THR HG2 H 1.208 0.040 1 196 19 19 THR C C 176.286 0.500 1 197 19 19 THR CA C 62.531 0.500 1 198 19 19 THR CB C 73.411 0.500 1 199 19 19 THR CG2 C 20.633 0.500 1 200 19 19 THR N N 105.443 0.500 1 201 20 20 THR H H 8.535 0.040 1 202 20 20 THR HA H 4.299 0.040 1 203 20 20 THR HB H 4.543 0.040 1 204 20 20 THR HG2 H 1.224 0.040 1 205 20 20 THR C C 173.253 0.500 1 206 20 20 THR CA C 67.329 0.500 1 207 20 20 THR CB C 69.153 0.500 1 208 20 20 THR CG2 C 21.728 0.500 1 209 20 20 THR N N 116.430 0.500 1 210 21 21 CYS H H 8.500 0.040 1 211 21 21 CYS HA H 4.986 0.040 1 212 21 21 CYS HB2 H 3.788 0.040 2 213 21 21 CYS HB3 H 2.084 0.040 2 214 21 21 CYS C C 173.828 0.500 1 215 21 21 CYS CA C 56.809 0.500 1 216 21 21 CYS CB C 50.306 0.500 1 217 21 21 CYS N N 119.999 0.500 1 218 22 22 THR H H 8.396 0.040 1 219 22 22 THR HA H 3.960 0.040 1 220 22 22 THR HB H 3.745 0.040 1 221 22 22 THR HG2 H 1.043 0.040 1 222 22 22 THR C C 175.297 0.500 1 223 22 22 THR CA C 62.966 0.500 1 224 22 22 THR CB C 69.540 0.500 1 225 22 22 THR CG2 C 22.355 0.500 1 226 22 22 THR N N 111.211 0.500 1 227 23 23 ASN H H 7.443 0.040 1 228 23 23 ASN HA H 4.396 0.040 1 229 23 23 ASN HB2 H 3.033 0.040 2 230 23 23 ASN HB3 H 2.905 0.040 2 231 23 23 ASN HD21 H 6.977 0.040 2 232 23 23 ASN HD22 H 7.710 0.040 2 233 23 23 ASN C C 175.898 0.500 1 234 23 23 ASN CA C 55.374 0.500 1 235 23 23 ASN CB C 37.655 0.500 1 236 23 23 ASN N N 116.204 0.500 1 237 23 23 ASN ND2 N 113.718 0.500 1 238 24 24 SER H H 8.494 0.040 1 239 24 24 SER HA H 5.137 0.040 1 240 24 24 SER HB2 H 3.379 0.040 2 241 24 24 SER HB3 H 4.438 0.040 2 242 24 24 SER C C 173.373 0.500 1 243 24 24 SER CA C 58.593 0.500 1 244 24 24 SER CB C 67.783 0.500 1 245 24 24 SER N N 120.589 0.500 1 246 25 25 LYS H H 8.261 0.040 1 247 25 25 LYS HA H 4.612 0.040 1 248 25 25 LYS HB2 H 1.952 0.040 2 249 25 25 LYS HB3 H 1.712 0.040 2 250 25 25 LYS HG2 H 1.439 0.040 2 251 25 25 LYS HG3 H 1.296 0.040 2 252 25 25 LYS HD2 H 1.784 0.040 2 253 25 25 LYS HD3 H 1.784 0.040 2 254 25 25 LYS HE2 H 3.021 0.040 2 255 25 25 LYS HE3 H 3.021 0.040 2 256 25 25 LYS C C 174.395 0.500 1 257 25 25 LYS CA C 55.947 0.500 1 258 25 25 LYS CB C 38.111 0.500 1 259 25 25 LYS CG C 25.706 0.500 1 260 25 25 LYS CD C 29.466 0.500 1 261 25 25 LYS CE C 42.278 0.500 1 262 25 25 LYS N N 115.843 0.500 1 263 26 26 CYS H H 8.522 0.040 1 264 26 26 CYS HA H 4.775 0.040 1 265 26 26 CYS HB2 H 2.466 0.040 2 266 26 26 CYS HB3 H 2.794 0.040 2 267 26 26 CYS C C 173.283 0.500 1 268 26 26 CYS CA C 55.772 0.500 1 269 26 26 CYS CB C 40.126 0.500 1 270 26 26 CYS N N 125.679 0.500 1 271 27 27 MET H H 8.891 0.040 1 272 27 27 MET HA H 4.717 0.040 1 273 27 27 MET HB2 H 2.038 0.040 2 274 27 27 MET HB3 H 1.794 0.040 2 275 27 27 MET HG2 H 2.393 0.040 2 276 27 27 MET HG3 H 2.393 0.040 2 277 27 27 MET HE H 2.078 0.040 1 278 27 27 MET C C 174.783 0.500 1 279 27 27 MET CA C 54.359 0.500 1 280 27 27 MET CB C 34.480 0.500 1 281 27 27 MET CG C 31.540 0.500 1 282 27 27 MET CE C 16.940 0.500 1 283 27 27 MET N N 130.422 0.500 1 284 28 28 ASN H H 9.396 0.040 1 285 28 28 ASN HA H 4.302 0.040 1 286 28 28 ASN HB2 H 3.003 0.040 2 287 28 28 ASN HB3 H 2.716 0.040 2 288 28 28 ASN HD21 H 6.911 0.040 2 289 28 28 ASN HD22 H 7.618 0.040 2 290 28 28 ASN C C 175.483 0.500 1 291 28 28 ASN CA C 54.253 0.500 1 292 28 28 ASN CB C 37.454 0.500 1 293 28 28 ASN N N 124.735 0.500 1 294 28 28 ASN ND2 N 112.956 0.500 1 295 29 29 GLY H H 8.188 0.040 1 296 29 29 GLY HA2 H 4.065 0.040 2 297 29 29 GLY HA3 H 4.065 0.040 2 298 29 29 GLY C C 174.909 0.500 1 299 29 29 GLY CA C 45.821 0.500 1 300 29 29 GLY N N 102.702 0.500 1 301 30 30 LYS H H 7.646 0.040 1 302 30 30 LYS HA H 5.299 0.040 1 303 30 30 LYS HB2 H 1.647 0.040 2 304 30 30 LYS HB3 H 1.701 0.040 2 305 30 30 LYS HG2 H 1.350 0.040 2 306 30 30 LYS HG3 H 1.261 0.040 2 307 30 30 LYS C C 176.813 0.500 1 308 30 30 LYS CA C 54.432 0.500 1 309 30 30 LYS CB C 36.143 0.500 1 310 30 30 LYS CG C 24.783 0.500 1 311 30 30 LYS N N 119.989 0.500 1 312 31 31 CYS H H 8.897 0.040 1 313 31 31 CYS HA H 4.699 0.040 1 314 31 31 CYS HB2 H 2.538 0.040 2 315 31 31 CYS HB3 H 2.757 0.040 2 316 31 31 CYS C C 174.926 0.500 1 317 31 31 CYS CA C 56.077 0.500 1 318 31 31 CYS CB C 40.072 0.500 1 319 31 31 CYS N N 120.472 0.500 1 320 32 32 LYS H H 8.986 0.040 1 321 32 32 LYS HA H 4.460 0.040 1 322 32 32 LYS HB2 H 1.716 0.040 2 323 32 32 LYS HB3 H 1.614 0.040 2 324 32 32 LYS HG2 H 1.048 0.040 2 325 32 32 LYS HG3 H 0.865 0.040 2 326 32 32 LYS HD2 H 1.541 0.040 2 327 32 32 LYS HD3 H 1.541 0.040 2 328 32 32 LYS C C 174.266 0.500 1 329 32 32 LYS CA C 54.337 0.500 1 330 32 32 LYS CB C 33.120 0.500 1 331 32 32 LYS CG C 24.435 0.500 1 332 32 32 LYS CD C 28.615 0.500 1 333 32 32 LYS N N 125.666 0.500 1 334 33 33 CYS H H 8.837 0.040 1 335 33 33 CYS HA H 4.766 0.040 1 336 33 33 CYS HB2 H 2.583 0.040 2 337 33 33 CYS HB3 H 3.488 0.040 2 338 33 33 CYS C C 175.477 0.500 1 339 33 33 CYS CA C 51.704 0.500 1 340 33 33 CYS CB C 34.534 0.500 1 341 33 33 CYS N N 123.142 0.500 1 342 34 34 TYR H H 8.109 0.040 1 343 34 34 TYR HA H 4.486 0.040 1 344 34 34 TYR HB2 H 2.402 0.040 2 345 34 34 TYR HB3 H 3.159 0.040 2 346 34 34 TYR HD1 H 6.916 0.040 1 347 34 34 TYR HD2 H 6.916 0.040 1 348 34 34 TYR HE1 H 6.631 0.040 1 349 34 34 TYR HE2 H 6.631 0.040 1 350 34 34 TYR C C 176.743 0.500 1 351 34 34 TYR CA C 58.816 0.500 1 352 34 34 TYR CB C 39.250 0.500 1 353 34 34 TYR CD1 C 131.963 0.500 3 354 34 34 TYR CE1 C 118.090 0.500 3 355 34 34 TYR N N 123.452 0.500 1 356 35 35 GLY H H 9.161 0.040 1 357 35 35 GLY HA2 H 3.650 0.040 2 358 35 35 GLY HA3 H 4.244 0.040 2 359 35 35 GLY C C 172.830 0.500 1 360 35 35 GLY CA C 43.811 0.500 1 361 35 35 GLY N N 108.526 0.500 1 362 36 36 CYS H H 8.630 0.040 1 363 36 36 CYS HA H 4.556 0.040 1 364 36 36 CYS HB2 H 2.732 0.040 2 365 36 36 CYS HB3 H 3.142 0.040 2 366 36 36 CYS C C 174.852 0.500 1 367 36 36 CYS CA C 54.520 0.500 1 368 36 36 CYS CB C 41.603 0.500 1 369 36 36 CYS N N 117.411 0.500 1 370 37 37 VAL H H 7.607 0.040 1 371 37 37 VAL HA H 4.030 0.040 1 372 37 37 VAL HB H 2.050 0.040 1 373 37 37 VAL HG1 H 0.818 0.040 2 374 37 37 VAL HG2 H 0.763 0.040 2 375 37 37 VAL CA C 63.326 0.500 1 376 37 37 VAL CB C 33.308 0.500 1 377 37 37 VAL CG1 C 21.491 0.500 2 378 37 37 VAL CG2 C 19.762 0.500 2 379 37 37 VAL N N 124.326 0.500 1 stop_ save_ save_spectral_peak_list_1 _Saveframe_category spectral_peak_list _Details . _Experiment_label '3D 1H-15N NOESY' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H H 2 N N 3 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 30538 >> _Spectral_peak_list.ID 1 >> _Spectral_peak_list.Name . >> _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.Chem_shift_reference_ID . >> _Spectral_peak_list.Chem_shift_reference_label . >> _Spectral_peak_list.Experiment_ID 6 >> _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' >> _Spectral_peak_list.Experiment_class . >> _Spectral_peak_list.Experiment_type . >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _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 3 >>#FORMAT xeasy3D >>#INAME 1 HN >>#INAME 2 N >>#INAME 3 H >>#SPECTRUM N15NOESY HN N H >> 1 8.526 125.709 2.465 1 T 4.127e+06 0.00e+00 a 0 0 0 0 0 >> 2 7.444 116.195 4.394 1 T 7.017e+06 0.00e+00 a 0 0 0 0 0 >> 3 9.043 113.816 3.920 1 T 2.614e+06 0.00e+00 a 0 0 0 0 0 >> 4 8.148 114.422 3.263 1 T 1.044e+07 0.00e+00 a 0 0 0 0 0 >> 5 7.444 116.195 2.899 1 T 7.922e+06 0.00e+00 a 0 0 0 0 0 >> 6 8.017 115.193 2.900 1 T 2.490e+06 0.00e+00 a 0 0 0 0 0 >> 7 8.526 125.683 2.797 1 T 5.663e+06 0.00e+00 a 0 0 0 0 0 >> 8 7.154 115.928 4.026 1 T 5.226e+06 0.00e+00 a 0 0 0 0 0 >> 9 8.909 124.099 4.131 1 T 3.045e+06 0.00e+00 a 0 0 0 0 0 >> 10 8.896 130.416 2.055 1 T 1.579e+06 0.00e+00 a 0 0 0 0 0 >> 11 8.497 120.584 3.392 1 T 1.382e+06 0.00e+00 a 0 0 0 0 0 >> 13 8.497 120.584 4.452 1 T 1.983e+07 0.00e+00 a 0 0 0 0 0 >> 14 9.160 108.533 3.675 1 T 9.032e+06 0.00e+00 a 0 0 0 0 0 >> 15 9.043 113.816 3.777 1 T 2.573e+06 0.00e+00 a 0 0 0 0 0 >> 18 8.889 130.398 1.822 1 T 2.718e+06 0.00e+00 a 0 0 0 0 0 >> 19 8.497 120.622 5.142 1 T 3.724e+06 0.00e+00 a 0 0 0 0 0 >> 20 9.399 124.745 3.014 1 T 4.166e+05 0.00e+00 a 0 0 0 0 0 >> 21 8.265 115.858 1.957 1 T 2.610e+06 0.00e+00 a 0 0 0 0 0 >> 22 8.528 125.694 4.774 1 T 2.273e+06 0.00e+00 a 0 0 0 0 0 >> 25 8.113 123.423 4.482 1 T 6.896e+06 0.00e+00 a 0 0 0 0 0 >> 26 8.735 128.607 1.585 1 T 7.253e+06 0.00e+00 a 0 0 0 0 0 >> 27 8.466 119.291 1.234 1 T 7.347e+06 0.00e+00 a 0 0 0 0 0 >> 28 8.264 115.858 1.708 1 T 7.066e+06 0.00e+00 a 0 0 0 0 0 >> 29 7.535 110.380 4.293 1 T 3.887e+06 0.00e+00 a 0 0 0 0 0 >> 30 8.630 117.433 4.564 1 T 5.250e+06 0.00e+00 a 0 0 0 0 0 >> 31 8.156 121.682 1.993 1 T 2.078e+07 0.00e+00 a 0 0 0 0 0 >> 32 8.016 115.260 4.797 1 T 1.848e+06 0.00e+00 a 0 0 0 0 0 >> 33 8.156 121.645 3.979 1 T 8.174e+06 0.00e+00 a 0 0 0 0 0 >> 34 8.735 128.580 1.986 1 T 7.230e+06 0.00e+00 a 0 0 0 0 0 >> 35 8.149 114.422 3.175 1 T 9.158e+06 0.00e+00 a 0 0 0 0 0 >> 36 8.188 102.737 4.068 1 T 1.757e+07 0.00e+00 a 0 0 0 0 0 >> 37 7.597 114.548 4.220 1 T 8.426e+06 0.00e+00 a 0 0 0 0 0 >> 38 7.596 114.543 2.227 1 T 2.329e+07 0.00e+00 a 0 0 0 0 0 >> 39 8.836 123.120 2.596 1 T 6.195e+06 0.00e+00 a 0 0 0 0 0 >> 40 8.148 114.500 4.655 1 T 1.862e+06 0.00e+00 a 0 0 0 0 0 >> 41 7.535 110.380 3.928 1 T 5.718e+06 0.00e+00 a 0 0 0 0 0 >> 42 8.895 120.494 2.549 1 T 4.041e+06 0.00e+00 a 0 0 0 0 0 >> 43 8.539 116.415 4.302 1 T 2.112e+07 0.00e+00 a 0 0 0 0 0 >> 44 8.501 120.018 3.822 1 T 3.340e+06 0.00e+00 a 0 0 0 0 0 >> 45 8.479 115.004 2.909 1 T 1.002e+07 0.00e+00 a 0 0 0 0 0 >> 46 7.293 122.062 4.557 1 T 5.393e+06 0.00e+00 a 0 0 0 0 0 >> 47 8.630 117.396 2.738 1 T 1.026e+07 0.00e+00 a 0 0 0 0 0 >> 48 8.895 120.494 2.774 1 T 8.826e+06 0.00e+00 a 0 0 0 0 0 >> 49 8.016 115.237 3.162 1 T 1.459e+06 0.00e+00 a 0 0 0 0 0 >> 50 8.401 111.216 3.752 1 T 7.072e+06 0.00e+00 a 0 0 0 0 0 >> 51 8.504 119.988 2.084 1 T 5.308e+06 0.00e+00 a 0 0 0 0 0 >> 52 7.648 119.983 5.296 1 T 4.589e+06 0.00e+00 a 0 0 0 0 0 >> 53 8.265 115.858 4.628 1 T 3.101e+06 0.00e+00 a 0 0 0 0 0 >> 54 8.406 105.419 4.869 1 T 3.331e+06 0.00e+00 a 0 0 0 0 0 >> 55 8.113 123.429 3.152 1 T 4.910e+06 0.00e+00 a 0 0 0 0 0 >> 56 8.735 128.584 3.710 1 T 4.121e+06 0.00e+00 a 0 0 0 0 0 >> 57 8.837 123.140 3.491 1 T 2.868e+06 0.00e+00 a 0 0 0 0 0 >> 58 8.606 120.463 2.477 1 T 8.335e+05 0.00e+00 a 0 0 0 0 0 >> 59 8.896 120.464 4.727 1 T 2.212e+06 0.00e+00 a 0 0 0 0 0 >> 60 8.986 125.669 4.480 1 T 3.742e+06 0.00e+00 a 0 0 0 0 0 >> 61 8.466 119.255 2.263 1 T 2.699e+06 0.00e+00 a 0 0 0 0 0 >> 62 8.400 111.216 3.972 1 T 3.945e+06 0.00e+00 a 0 0 0 0 0 >> 63 9.043 113.810 4.562 1 T 3.270e+06 0.00e+00 a 0 0 0 0 0 >> 64 7.445 116.195 3.033 1 T 1.229e+07 0.00e+00 a 0 0 0 0 0 >> 65 7.154 115.935 2.188 1 T 1.663e+07 0.00e+00 a 0 0 0 0 0 >> 66 8.156 121.682 1.906 1 T 2.205e+07 0.00e+00 a 0 0 0 0 0 >> 67 8.835 123.089 4.798 1 T 1.209e+06 0.00e+00 a 0 0 0 0 0 >> 68 8.113 123.449 2.416 1 T 8.947e+06 0.00e+00 a 0 0 0 0 0 >> 70 8.396 127.077 1.765 1 T 1.248e+07 0.00e+00 a 0 0 0 0 0 >> 71 8.404 105.469 4.540 1 T 1.379e+06 0.00e+00 a 0 0 0 0 0 >> 72 8.396 127.217 4.654 1 T 2.153e+06 0.00e+00 a 0 0 0 0 0 >> 73 7.647 119.995 1.702 1 T 9.360e+06 0.00e+00 a 0 0 0 0 0 >> 74 8.908 124.079 1.524 1 T 1.118e+07 0.00e+00 a 0 0 0 0 0 >> 75 8.895 130.421 4.719 1 T 5.828e+06 0.00e+00 a 0 0 0 0 0 >> 76 8.478 114.999 3.440 1 T 4.823e+06 0.00e+00 a 0 0 0 0 0 >> 77 8.630 117.397 3.137 1 T 4.248e+06 0.00e+00 a 0 0 0 0 0 >> 78 9.162 108.509 4.245 1 T 4.948e+06 0.00e+00 a 0 0 0 0 0 >> 80 8.541 116.453 4.540 1 T 4.137e+06 0.00e+00 a 0 0 0 0 0 >> 81 8.480 115.084 4.752 1 T 2.203e+06 0.00e+00 a 0 0 0 0 0 >> 82 8.503 120.018 4.997 1 T 3.298e+06 0.00e+00 a 0 0 0 0 0 >> 83 9.399 124.730 4.309 1 T 4.827e+06 0.00e+00 a 0 0 0 0 0 >> 84 8.909 124.019 1.130 1 T 2.315e+06 0.00e+00 a 0 0 0 0 0 >> 85 8.909 124.096 0.803 1 T 2.694e+06 0.00e+00 a 0 0 0 0 0 >> 86 8.909 124.070 2.468 1 T 4.428e+06 0.00e+00 a 0 0 0 0 0 >> 87 8.909 124.061 4.651 1 T 7.990e+06 0.00e+00 a 0 0 0 0 0 >> 88 8.606 120.439 3.786 1 T 1.310e+06 0.00e+00 a 0 0 0 0 0 >> 89 8.908 124.128 2.759 1 T 5.999e+05 0.00e+00 a 0 0 0 0 0 >> 91 8.397 127.158 0.844 1 T 5.815e+06 0.00e+00 a 0 0 0 0 0 >> 92 8.396 127.077 1.549 1 T 5.386e+06 0.00e+00 a 0 0 0 0 0 >> 93 8.397 127.077 1.379 1 T 5.524e+06 0.00e+00 a 0 0 0 0 0 >> 94 8.397 127.179 4.130 1 T 2.207e+07 0.00e+00 a 0 0 0 0 0 >> 95 8.017 115.284 1.763 1 T 7.817e+06 0.00e+00 a 0 0 0 0 0 >> 96 8.018 115.175 1.371 1 T 2.048e+06 0.00e+00 a 0 0 0 0 0 >> 97 8.016 115.234 2.210 1 T 5.669e+05 0.00e+00 a 0 0 0 0 0 >> 98 9.044 113.774 2.907 1 T 2.112e+06 0.00e+00 a 0 0 0 0 0 >> 99 9.043 113.819 3.135 1 T 3.542e+06 0.00e+00 a 0 0 0 0 0 >> 100 7.535 110.402 2.865 1 T 1.676e+06 0.00e+00 a 0 0 0 0 0 >> 101 7.536 110.357 3.140 1 T 4.941e+06 0.00e+00 a 0 0 0 0 0 >> 102 9.043 113.792 2.157 1 T 2.313e+06 0.00e+00 a 0 0 0 0 0 >> 103 7.536 110.406 2.164 1 T 2.239e+06 0.00e+00 a 0 0 0 0 0 >> 104 8.017 115.261 4.086 1 T 3.418e+06 0.00e+00 a 0 0 0 0 0 >> 105 8.016 115.237 5.293 1 T 4.447e+06 0.00e+00 a 0 0 0 0 0 >> 106 8.016 115.260 4.651 1 T 1.250e+07 0.00e+00 a 0 0 0 0 0 >> 107 8.016 115.260 4.564 1 T 3.907e+06 0.00e+00 a 0 0 0 0 0 >> 108 9.043 113.825 4.799 1 T 5.281e+06 0.00e+00 a 0 0 0 0 0 >> 109 7.536 110.440 4.809 1 T 1.400e+06 0.00e+00 a 0 0 0 0 0 >> 110 7.535 110.363 4.586 1 T 1.454e+06 0.00e+00 a 0 0 0 0 0 >> 111 9.043 113.829 7.533 1 T 9.720e+06 0.00e+00 a 0 0 0 0 0 >> 112 7.535 110.386 3.916 1 T 5.718e+06 0.00e+00 a 0 0 0 0 0 >> 113 7.535 110.386 3.779 1 T 1.202e+06 0.00e+00 a 0 0 0 0 0 >> 114 7.536 110.365 9.040 1 T 1.074e+07 0.00e+00 a 0 0 0 0 0 >> 115 8.852 120.614 4.238 1 T 1.347e+06 0.00e+00 a 0 0 0 0 0 >> 116 8.852 120.646 4.034 1 T 1.005e+06 0.00e+00 a 0 0 0 0 0 >> 117 8.466 119.291 7.138 1 T 2.141e+06 0.00e+00 a 0 0 0 0 0 >> 118 8.466 119.369 4.087 1 T 1.664e+06 0.00e+00 a 0 0 0 0 0 >> 119 8.469 119.319 2.594 1 T 7.291e+05 0.00e+00 a 0 0 0 0 0 >> 120 8.466 119.291 0.963 1 T 2.415e+06 0.00e+00 a 0 0 0 0 0 >> 121 7.153 116.066 0.917 1 T 1.110e+06 0.00e+00 a 0 0 0 0 0 >> 122 7.153 115.944 1.216 1 T 3.477e+06 0.00e+00 a 0 0 0 0 0 >> 123 7.154 115.953 2.403 1 T 3.653e+06 0.00e+00 a 0 0 0 0 0 >> 125 7.154 115.925 3.559 1 T 1.110e+06 0.00e+00 a 0 0 0 0 0 >> 126 7.154 115.884 8.457 1 T 3.329e+06 0.00e+00 a 0 0 0 0 0 >> 127 7.154 115.910 8.134 1 T 5.962e+06 0.00e+00 a 0 0 0 0 0 >> 128 8.148 114.461 7.225 1 T 1.125e+07 0.00e+00 a 0 0 0 0 0 >> 130 8.149 114.530 1.234 1 T 9.686e+05 0.00e+00 a 0 0 0 0 0 >> 131 8.148 114.459 2.203 1 T 4.168e+06 0.00e+00 a 0 0 0 0 0 >> 132 8.149 114.422 2.394 1 T 1.498e+06 0.00e+00 a 0 0 0 0 0 >> 133 8.149 114.463 3.573 1 T 1.621e+06 0.00e+00 a 0 0 0 0 0 >> 134 8.148 114.449 4.043 1 T 2.256e+06 0.00e+00 a 0 0 0 0 0 >> 135 7.293 122.064 8.144 1 T 9.792e+06 0.00e+00 a 0 0 0 0 0 >> 136 7.294 122.094 9.084 1 T 4.502e+06 0.00e+00 a 0 0 0 0 0 >> 137 7.294 122.037 3.685 1 T 2.259e+06 0.00e+00 a 0 0 0 0 0 >> 138 7.293 122.093 4.020 1 T 1.037e+06 0.00e+00 a 0 0 0 0 0 >> 139 7.293 121.951 2.245 1 T 2.562e+06 0.00e+00 a 0 0 0 0 0 >> 140 7.294 122.141 1.274 1 T 1.180e+06 0.00e+00 a 0 0 0 0 0 >> 141 7.292 122.179 1.048 1 T 7.306e+05 0.00e+00 a 0 0 0 0 0 >> 142 9.083 105.057 2.248 1 T 9.583e+05 0.00e+00 a 0 0 0 0 0 >> 143 9.084 105.111 3.146 1 T 3.556e+06 0.00e+00 a 0 0 0 0 0 >> 144 9.083 105.111 3.317 1 T 6.527e+06 0.00e+00 a 0 0 0 0 0 >> 145 9.082 105.083 3.678 1 T 8.429e+06 0.00e+00 a 0 0 0 0 0 >> 146 9.081 105.081 4.024 1 T 1.356e+07 0.00e+00 a 0 0 0 0 0 >> 147 9.082 105.057 4.552 1 T 1.303e+06 0.00e+00 a 0 0 0 0 0 >> 148 9.081 105.084 7.281 1 T 2.323e+06 0.00e+00 a 0 0 0 0 0 >> 149 8.479 115.004 1.837 1 T 6.118e+06 0.00e+00 a 0 0 0 0 0 >> 150 8.479 115.009 0.799 1 T 1.012e+06 0.00e+00 a 0 0 0 0 0 >> 151 8.479 114.903 1.511 1 T 7.751e+05 0.00e+00 a 0 0 0 0 0 >> 152 8.481 115.096 2.236 1 T 2.096e+06 0.00e+00 a 0 0 0 0 0 >> 153 8.479 115.084 2.441 1 T 1.789e+06 0.00e+00 a 0 0 0 0 0 >> 154 8.479 115.050 3.715 1 T 4.053e+06 0.00e+00 a 0 0 0 0 0 >> 155 8.479 115.074 3.975 1 T 1.030e+06 0.00e+00 a 0 0 0 0 0 >> 156 8.478 115.088 4.253 1 T 1.213e+06 0.00e+00 a 0 0 0 0 0 >> 157 8.479 115.084 4.570 1 T 2.049e+06 0.00e+00 a 0 0 0 0 0 >> 158 8.733 128.569 1.203 1 T 1.457e+06 0.00e+00 a 0 0 0 0 0 >> 159 8.735 128.569 0.956 1 T 1.567e+06 0.00e+00 a 0 0 0 0 0 >> 160 8.735 128.633 2.916 1 T 2.203e+06 0.00e+00 a 0 0 0 0 0 >> 161 8.736 128.505 3.423 1 T 1.279e+06 0.00e+00 a 0 0 0 0 0 >> 162 8.736 128.620 3.975 1 T 2.500e+06 0.00e+00 a 0 0 0 0 0 >> 163 8.735 128.569 4.673 1 T 7.260e+05 0.00e+00 a 0 0 0 0 0 >> 164 8.735 128.604 8.158 1 T 4.087e+06 0.00e+00 a 0 0 0 0 0 >> 165 8.156 121.662 7.600 1 T 7.927e+06 0.00e+00 a 0 0 0 0 0 >> 166 8.156 121.666 8.719 1 T 6.780e+06 0.00e+00 a 0 0 0 0 0 >> 167 7.596 114.544 8.135 1 T 8.818e+06 0.00e+00 a 0 0 0 0 0 >> 168 7.597 114.538 8.411 1 T 1.027e+07 0.00e+00 a 0 0 0 0 0 >> 169 8.156 121.680 3.690 1 T 2.177e+06 0.00e+00 a 0 0 0 0 0 >> 170 8.156 121.686 4.272 1 T 3.346e+06 0.00e+00 a 0 0 0 0 0 >> 171 8.158 121.567 2.927 1 T 7.828e+05 0.00e+00 a 0 0 0 0 0 >> 172 8.157 121.776 0.949 1 T 8.843e+05 0.00e+00 a 0 0 0 0 0 >> 173 8.156 121.653 1.536 1 T 5.439e+06 0.00e+00 a 0 0 0 0 0 >> 174 8.157 121.600 1.189 1 T 1.265e+06 0.00e+00 a 0 0 0 0 0 >> 175 8.158 121.591 2.273 1 T 1.291e+06 0.00e+00 a 0 0 0 0 0 >> 176 8.156 121.682 2.062 1 T 1.339e+07 0.00e+00 a 0 0 0 0 0 >> 177 7.598 114.553 1.466 1 T 1.292e+06 0.00e+00 a 0 0 0 0 0 >> 178 7.597 114.563 1.200 1 T 2.270e+06 0.00e+00 a 0 0 0 0 0 >> 179 7.597 114.542 1.939 1 T 9.936e+06 0.00e+00 a 0 0 0 0 0 >> 180 7.596 114.540 2.532 1 T 4.420e+06 0.00e+00 a 0 0 0 0 0 >> 181 7.596 114.554 3.955 1 T 2.586e+06 0.00e+00 a 0 0 0 0 0 >> 182 7.597 114.533 4.809 1 T 1.977e+06 0.00e+00 a 0 0 0 0 0 >> 183 8.404 105.443 2.222 1 T 6.523e+06 0.00e+00 a 0 0 0 0 0 >> 184 8.404 105.526 3.722 1 T 2.276e+06 0.00e+00 a 0 0 0 0 0 >> 185 8.404 105.465 4.275 1 T 3.501e+06 0.00e+00 a 0 0 0 0 0 >> 186 8.404 105.436 4.003 1 T 1.227e+06 0.00e+00 a 0 0 0 0 0 >> 187 8.404 105.459 1.214 1 T 7.913e+06 0.00e+00 a 0 0 0 0 0 >> 188 8.407 105.396 2.535 1 T 8.748e+05 0.00e+00 a 0 0 0 0 0 >> 189 8.540 116.439 2.198 1 T 1.429e+06 0.00e+00 a 0 0 0 0 0 >> 190 8.539 116.454 1.561 1 T 1.402e+06 0.00e+00 a 0 0 0 0 0 >> 191 8.539 116.410 1.223 1 T 8.623e+06 0.00e+00 a 0 0 0 0 0 >> 192 8.540 116.397 0.915 1 T 1.086e+06 0.00e+00 a 0 0 0 0 0 >> 193 8.539 116.417 3.727 1 T 4.927e+06 0.00e+00 a 0 0 0 0 0 >> 194 8.540 116.399 3.988 1 T 1.843e+06 0.00e+00 a 0 0 0 0 0 >> 195 8.540 116.420 4.867 1 T 2.353e+06 0.00e+00 a 0 0 0 0 0 >> 196 8.404 105.463 7.596 1 T 6.853e+06 0.00e+00 a 0 0 0 0 0 >> 197 8.539 116.414 7.579 1 T 1.571e+06 0.00e+00 a 0 0 0 0 0 >> 198 8.502 120.154 0.949 1 T 8.957e+05 0.00e+00 a 0 0 0 0 0 >> 199 8.503 120.025 1.577 1 T 8.005e+05 0.00e+00 a 0 0 0 0 0 >> 200 8.503 120.000 1.218 1 T 2.375e+06 0.00e+00 a 0 0 0 0 0 >> 201 8.399 111.204 1.568 1 T 1.030e+06 0.00e+00 a 0 0 0 0 0 >> 202 8.399 111.197 1.039 1 T 1.039e+07 0.00e+00 a 0 0 0 0 0 >> 203 8.399 111.156 2.084 1 T 2.626e+06 0.00e+00 a 0 0 0 0 0 >> 204 8.397 111.133 2.983 1 T 1.006e+06 0.00e+00 a 0 0 0 0 0 >> 205 8.399 111.190 4.970 1 T 1.782e+07 0.00e+00 a 0 0 0 0 0 >> 206 8.504 120.037 4.003 1 T 2.720e+06 0.00e+00 a 0 0 0 0 0 >> 207 8.502 120.029 4.584 1 T 3.302e+06 0.00e+00 a 0 0 0 0 0 >> 208 8.503 120.018 4.257 1 T 1.810e+06 0.00e+00 a 0 0 0 0 0 >> 209 8.503 120.018 4.880 1 T 2.333e+06 0.00e+00 a 0 0 0 0 0 >> 210 8.502 120.018 3.749 1 T 7.995e+06 0.00e+00 a 0 0 0 0 0 >> 211 8.502 120.018 3.678 1 T 5.683e+06 0.00e+00 a 0 0 0 0 0 >> 212 8.399 111.185 7.440 1 T 6.906e+06 0.00e+00 a 0 0 0 0 0 >> 213 7.444 116.194 8.408 1 T 9.195e+06 0.00e+00 a 0 0 0 0 0 >> 214 8.496 120.573 7.473 1 T 1.087e+06 0.00e+00 a 0 0 0 0 0 >> 215 8.497 120.565 6.959 1 T 2.160e+06 0.00e+00 a 0 0 0 0 0 >> 216 8.264 115.794 8.994 1 T 3.786e+06 0.00e+00 a 0 0 0 0 0 >> 217 7.444 116.154 4.975 1 T 1.622e+06 0.00e+00 a 0 0 0 0 0 >> 218 7.445 116.201 3.747 1 T 6.723e+06 0.00e+00 a 0 0 0 0 0 >> 219 7.445 116.201 3.961 1 T 2.347e+06 0.00e+00 a 0 0 0 0 0 >> 221 8.497 120.563 4.192 1 T 6.327e+06 0.00e+00 a 0 0 0 0 0 >> 222 8.498 120.563 3.033 1 T 1.667e+06 0.00e+00 a 0 0 0 0 0 >> 223 8.498 120.563 2.902 1 T 2.426e+06 0.00e+00 a 0 0 0 0 0 >> 224 7.445 116.134 1.034 1 T 1.110e+06 0.00e+00 a 0 0 0 0 0 >> 225 7.444 116.248 2.096 1 T 2.592e+06 0.00e+00 a 0 0 0 0 0 >> 226 8.497 120.584 1.306 1 T 9.535e+05 0.00e+00 a 0 0 0 0 0 >> 227 8.266 115.856 6.908 1 T 9.968e+05 0.00e+00 a 0 0 0 0 0 >> 228 8.264 115.809 6.628 1 T 1.203e+06 0.00e+00 a 0 0 0 0 0 >> 229 8.264 115.858 4.774 1 T 2.606e+06 0.00e+00 a 0 0 0 0 0 >> 230 8.264 115.825 5.128 1 T 1.283e+07 0.00e+00 a 0 0 0 0 0 >> 231 8.264 115.839 4.454 1 T 4.341e+06 0.00e+00 a 0 0 0 0 0 >> 232 8.265 115.858 4.353 1 T 3.658e+06 0.00e+00 a 0 0 0 0 0 >> 233 8.264 115.838 3.379 1 T 8.808e+06 0.00e+00 a 0 0 0 0 0 >> 234 8.266 115.922 2.500 1 T 7.436e+05 0.00e+00 a 0 0 0 0 0 >> 235 8.264 115.842 1.331 1 T 1.332e+06 0.00e+00 a 0 0 0 0 0 >> 236 8.526 125.687 3.554 1 T 3.557e+06 0.00e+00 a 0 0 0 0 0 >> 237 8.526 125.674 4.629 1 T 1.019e+07 0.00e+00 a 0 0 0 0 0 >> 238 8.526 125.673 1.309 1 T 4.299e+06 0.00e+00 a 0 0 0 0 0 >> 239 8.527 125.694 1.440 1 T 2.062e+06 0.00e+00 a 0 0 0 0 0 >> 240 8.526 125.708 1.738 1 T 1.612e+06 0.00e+00 a 0 0 0 0 0 >> 241 8.525 125.694 1.944 1 T 1.450e+06 0.00e+00 a 0 0 0 0 0 >> 242 8.895 130.434 7.663 1 T 2.095e+06 0.00e+00 a 0 0 0 0 0 >> 243 8.894 130.421 4.614 1 T 1.572e+06 0.00e+00 a 0 0 0 0 0 >> 244 8.895 130.429 2.792 1 T 8.052e+05 0.00e+00 a 0 0 0 0 0 >> 245 8.893 130.421 1.731 1 T 2.522e+06 0.00e+00 a 0 0 0 0 0 >> 246 8.894 130.446 2.461 1 T 1.816e+06 0.00e+00 a 0 0 0 0 0 >> 247 9.397 124.759 4.689 1 T 2.087e+06 0.00e+00 a 0 0 0 0 0 >> 248 8.895 130.421 4.809 1 T 5.642e+06 0.00e+00 a 0 0 0 0 0 >> 249 9.399 124.745 2.414 1 T 5.539e+05 0.00e+00 a 0 0 0 0 0 >> 250 9.398 124.683 8.188 1 T 7.396e+05 0.00e+00 a 0 0 0 0 0 >> 251 8.188 102.737 7.643 1 T 4.160e+06 0.00e+00 a 0 0 0 0 0 >> 252 8.188 102.792 9.373 1 T 2.305e+06 0.00e+00 a 0 0 0 0 0 >> 253 8.188 102.734 4.325 1 T 5.400e+06 0.00e+00 a 0 0 0 0 0 >> 254 8.191 102.722 3.049 1 T 8.169e+05 0.00e+00 a 0 0 0 0 0 >> 255 8.186 102.538 2.028 1 T 7.159e+05 0.00e+00 a 0 0 0 0 0 >> 256 7.648 119.995 1.345 1 T 3.314e+06 0.00e+00 a 0 0 0 0 0 >> 257 7.647 120.023 2.737 1 T 1.132e+06 0.00e+00 a 0 0 0 0 0 >> 258 7.650 119.966 3.002 1 T 8.186e+05 0.00e+00 a 0 0 0 0 0 >> 259 7.648 120.010 4.068 1 T 5.312e+06 0.00e+00 a 0 0 0 0 0 >> 260 7.648 119.988 4.735 1 T 8.906e+05 0.00e+00 a 0 0 0 0 0 >> 261 8.898 120.481 5.294 1 T 1.930e+07 0.00e+00 a 0 0 0 0 0 >> 262 7.648 119.995 8.888 1 T 5.216e+06 0.00e+00 a 0 0 0 0 0 >> 263 7.648 119.984 8.186 1 T 4.835e+06 0.00e+00 a 0 0 0 0 0 >> 264 8.898 120.394 7.953 1 T 8.105e+05 0.00e+00 a 0 0 0 0 0 >> 265 8.899 120.464 4.601 1 T 2.054e+06 0.00e+00 a 0 0 0 0 0 >> 266 8.902 120.464 1.639 1 T 8.041e+06 0.00e+00 a 0 0 0 0 0 >> 267 8.899 120.464 1.304 1 T 1.156e+06 0.00e+00 a 0 0 0 0 0 >> 268 8.898 120.404 0.830 1 T 1.792e+06 0.00e+00 a 0 0 0 0 0 >> 269 8.987 125.680 2.537 1 T 2.157e+06 0.00e+00 a 0 0 0 0 0 >> 270 8.986 125.666 2.783 1 T 1.057e+06 0.00e+00 a 0 0 0 0 0 >> 271 8.987 125.669 4.738 1 T 5.451e+06 0.00e+00 a 0 0 0 0 0 >> 272 8.987 125.669 4.606 1 T 4.289e+06 0.00e+00 a 0 0 0 0 0 >> 273 8.986 125.669 8.249 1 T 2.664e+06 0.00e+00 a 0 0 0 0 0 >> 274 8.838 123.138 4.471 1 T 1.772e+07 0.00e+00 a 0 0 0 0 0 >> 275 8.837 123.153 0.886 1 T 1.324e+06 0.00e+00 a 0 0 0 0 0 >> 276 8.837 123.124 1.570 1 T 3.204e+06 0.00e+00 a 0 0 0 0 0 >> 277 8.838 123.141 1.676 1 T 2.180e+06 0.00e+00 a 0 0 0 0 0 >> 278 8.112 123.432 3.472 1 T 3.501e+06 0.00e+00 a 0 0 0 0 0 >> 279 8.113 123.466 2.947 1 T 1.241e+06 0.00e+00 a 0 0 0 0 0 >> 280 8.113 123.444 4.793 1 T 8.034e+06 0.00e+00 a 0 0 0 0 0 >> 281 8.112 123.425 5.125 1 T 5.499e+06 0.00e+00 a 0 0 0 0 0 >> 282 8.112 123.374 6.929 1 T 3.102e+06 0.00e+00 a 0 0 0 0 0 >> 283 8.113 123.451 9.155 1 T 8.435e+06 0.00e+00 a 0 0 0 0 0 >> 284 9.162 108.512 8.119 1 T 4.884e+06 0.00e+00 a 0 0 0 0 0 >> 285 9.162 108.492 8.614 1 T 1.020e+06 0.00e+00 a 0 0 0 0 0 >> 286 8.631 117.346 7.621 1 T 2.014e+06 0.00e+00 a 0 0 0 0 0 >> 287 7.609 124.415 8.606 1 T 2.620e+06 0.00e+00 a 0 0 0 0 0 >> 288 8.629 117.421 9.169 1 T 1.417e+06 0.00e+00 a 0 0 0 0 0 >> 289 8.633 117.271 7.228 1 T 6.256e+05 0.00e+00 a 0 0 0 0 0 >> 290 9.161 108.475 3.137 1 T 1.017e+06 0.00e+00 a 0 0 0 0 0 >> 291 9.163 108.419 2.950 1 T 1.011e+06 0.00e+00 a 0 0 0 0 0 >> 292 9.162 108.420 2.456 1 T 1.462e+06 0.00e+00 a 0 0 0 0 0 >> 293 9.162 108.527 4.515 1 T 2.081e+06 0.00e+00 a 0 0 0 0 0 >> 294 9.162 108.458 1.197 1 T 2.389e+06 0.00e+00 a 0 0 0 0 0 >> 295 8.633 117.493 0.871 1 T 6.825e+05 0.00e+00 a 0 0 0 0 0 >> 296 8.629 117.424 1.187 1 T 9.653e+05 0.00e+00 a 0 0 0 0 0 >> 297 8.630 117.473 2.063 1 T 8.337e+05 0.00e+00 a 0 0 0 0 0 >> 298 7.609 124.336 0.776 1 T 4.328e+06 0.00e+00 a 0 0 0 0 0 >> 299 7.609 124.352 2.036 1 T 3.003e+06 0.00e+00 a 0 0 0 0 0 >> 300 7.609 124.248 2.746 1 T 1.139e+06 0.00e+00 a 0 0 0 0 0 >> 301 7.608 124.342 3.156 1 T 2.065e+06 0.00e+00 a 0 0 0 0 0 >> 302 8.630 117.398 3.668 1 T 9.439e+06 0.00e+00 a 0 0 0 0 0 >> 303 8.630 117.402 4.245 1 T 1.243e+07 0.00e+00 a 0 0 0 0 0 >> 304 7.609 124.332 4.037 1 T 4.549e+06 0.00e+00 a 0 0 0 0 0 >> 305 7.608 124.332 3.719 1 T 9.127e+05 0.00e+00 a 0 0 0 0 0 >> 306 7.609 124.337 4.567 1 T 7.568e+06 0.00e+00 a 0 0 0 0 0 >> 307 8.397 127.077 1.700 1 T 1.274e+07 0.00e+00 a 0 0 0 0 0 >> 308 8.017 115.284 1.701 1 T 7.817e+06 0.00e+00 a 0 0 0 0 0 >> 309 8.466 119.291 1.179 1 T 6.235e+06 0.00e+00 a 0 0 0 0 0 >> 310 8.466 119.291 0.854 1 T 1.983e+06 0.00e+00 a 0 0 0 0 0 >> 311 8.397 127.077 0.957 1 T 1.759e+06 0.00e+00 a 0 0 0 0 0 >> 312 7.532 112.244 6.868 1 T 5.198e+07 0.00e+00 a 0 0 0 0 0 >> 313 7.532 111.954 3.977 1 T 6.501e+05 0.00e+00 a 0 0 0 0 0 >> 314 7.532 112.238 2.420 1 T 3.592e+06 0.00e+00 a 0 0 0 0 0 >> 315 7.532 112.238 2.167 1 T 8.323e+05 0.00e+00 a 0 0 0 0 0 >> 316 7.532 112.238 2.277 1 T 1.023e+06 0.00e+00 a 0 0 0 0 0 >> 317 6.872 112.230 2.423 1 T 2.097e+06 0.00e+00 a 0 0 0 0 0 >> 318 6.873 112.302 2.163 1 T 5.164e+05 0.00e+00 a 0 0 0 0 0 >> 319 6.872 112.259 7.531 1 T 4.828e+07 0.00e+00 a 0 0 0 0 0 >> 320 6.873 112.193 9.045 1 T 8.015e+05 0.00e+00 a 0 0 0 0 0 >> 321 9.857 127.622 7.035 1 T 8.352e+06 0.00e+00 a 0 0 0 0 0 >> 322 9.856 127.641 7.408 1 T 4.387e+06 0.00e+00 a 0 0 0 0 0 >> 323 9.858 127.626 2.273 1 T 9.407e+05 0.00e+00 a 0 0 0 0 0 >> 324 9.857 127.649 4.501 1 T 6.447e+05 0.00e+00 a 0 0 0 0 0 >> 325 9.857 127.623 1.300 1 T 7.270e+06 0.00e+00 a 0 0 0 0 0 >> 326 9.858 127.580 4.142 1 T 9.086e+05 0.00e+00 a 0 0 0 0 0 >> 327 9.858 127.591 3.627 1 T 5.688e+05 0.00e+00 a 0 0 0 0 0 >> 328 9.081 105.081 3.911 1 T 7.308e+06 0.00e+00 a 0 0 0 0 0 >> 329 8.540 116.453 4.627 1 T 2.470e+06 0.00e+00 a 0 0 0 0 0 >> 330 7.713 113.701 6.976 1 T 4.762e+07 0.00e+00 a 0 0 0 0 0 >> 331 7.712 113.655 4.544 1 T 8.190e+05 0.00e+00 a 0 0 0 0 0 >> 332 6.977 113.744 4.564 1 T 4.484e+05 0.00e+00 a 0 0 0 0 0 >> 333 7.713 113.732 2.910 1 T 5.172e+06 0.00e+00 a 0 0 0 0 0 >> 334 7.714 113.665 2.416 1 T 9.097e+05 0.00e+00 a 0 0 0 0 0 >> 335 7.713 113.732 3.030 1 T 2.313e+06 0.00e+00 a 0 0 0 0 0 >> 336 6.980 113.704 7.715 1 T 3.787e+07 0.00e+00 a 0 0 0 0 0 >> 337 6.978 113.744 2.910 1 T 1.813e+06 0.00e+00 a 0 0 0 0 0 >> 338 6.977 113.744 3.030 1 T 1.209e+06 0.00e+00 a 0 0 0 0 0 >> 339 7.713 113.613 0.790 1 T 7.150e+05 0.00e+00 a 0 0 0 0 0 >> 340 6.977 113.744 2.424 1 T 5.520e+05 0.00e+00 a 0 0 0 0 0 >> 341 7.714 113.732 3.144 1 T 1.329e+06 0.00e+00 a 0 0 0 0 0 >> 342 6.978 113.744 3.137 1 T 6.083e+05 0.00e+00 a 0 0 0 0 0 >> 343 8.498 120.563 4.347 1 T 1.543e+07 0.00e+00 a 0 0 0 0 0 >> 344 7.618 112.936 2.701 1 T 1.860e+06 0.00e+00 a 0 0 0 0 0 >> 345 6.913 112.886 7.620 1 T 4.919e+07 0.00e+00 a 0 0 0 0 0 >> 346 7.618 112.874 6.911 1 T 5.734e+07 0.00e+00 a 0 0 0 0 0 >> 347 7.648 119.995 1.263 1 T 3.185e+06 0.00e+00 a 0 0 0 0 0 >> 348 7.648 119.995 1.644 1 T 9.344e+06 0.00e+00 a 0 0 0 0 0 >> 349 8.899 120.464 1.538 1 T 6.637e+06 0.00e+00 a 0 0 0 0 0 >> 350 8.902 120.464 1.695 1 T 4.940e+06 0.00e+00 a 0 0 0 0 0 >> 351 8.985 125.669 1.542 1 T 3.878e+06 0.00e+00 a 0 0 0 0 0 >> 352 8.986 125.669 1.619 1 T 6.364e+06 0.00e+00 a 0 0 0 0 0 >> 353 8.986 125.669 1.724 1 T 7.401e+06 0.00e+00 a 0 0 0 0 0 >> 354 8.986 125.669 0.865 1 T 5.901e+05 0.00e+00 a 0 0 0 0 0 >> 355 8.987 125.523 3.360 1 T 5.399e+05 0.00e+00 a 0 0 0 0 0 >> 356 7.342 110.600 1.225 1 T 5.707e+05 0.00e+00 a 0 0 0 0 0 >> 357 6.693 110.600 1.242 1 T 4.553e+05 0.00e+00 a 0 0 0 0 0 >> 358 6.693 110.600 2.536 1 T 5.932e+05 0.00e+00 a 0 0 0 0 0 >> 359 7.342 110.600 2.528 1 T 6.585e+05 0.00e+00 a 0 0 0 0 0 >> 360 7.342 110.600 6.699 1 T 5.491e+07 0.00e+00 a 0 0 0 0 0 >> 361 6.693 110.600 7.346 1 T 5.232e+07 0.00e+00 a 0 0 0 0 0 >> 362 7.598 114.548 4.761 1 T 1.772e+06 0.00e+00 a 0 0 0 0 0 >> 363 7.600 114.548 2.054 1 T 3.468e+06 0.00e+00 a 0 0 0 0 0 >> 364 7.597 114.548 1.892 1 T 6.972e+06 0.00e+00 a 0 0 0 0 0 >> 366 8.735 128.575 8.433 1 T 4.434e+06 0.00e+00 a 0 0 0 0 0 >> 367 8.155 121.682 1.650 1 T 2.192e+06 0.00e+00 a 0 0 0 0 0 >> 368 8.157 121.682 1.411 1 T 1.752e+06 0.00e+00 a 0 0 0 0 0 >> 369 6.870 112.280 4.022 1 T 4.770e+05 0.00e+00 a 0 0 0 0 0 >> 370 7.531 112.274 4.028 1 T 4.509e+05 0.00e+00 a 0 0 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 . . 13.886 ppm . . . 4.708 . . 30538 1 >> 2 . . N 15 N . . 32 ppm . . . 116 . . 30538 1 >> 3 . . H 1 H . . 13.886 ppm . . . 4.70 . . 30538 1 >> >> stop_ >> >>save_ >> ; save_ save_spectral_peak_list_2 _Saveframe_category spectral_peak_list _Details . _Experiment_label '3D 1H-13C NOESY aromatic' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H H-aromatic 2 C C-aromatic 3 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_2 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode spectral_peak_list_2 >> _Spectral_peak_list.Entry_ID 30538 >> _Spectral_peak_list.ID 2 >> _Spectral_peak_list.Name . >> _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.Chem_shift_reference_ID . >> _Spectral_peak_list.Chem_shift_reference_label . >> _Spectral_peak_list.Experiment_ID 8 >> _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aromatic' >> _Spectral_peak_list.Experiment_class . >> _Spectral_peak_list.Experiment_type . >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _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 3 >>#FORMAT xeasy3D >>#INAME 1 HC >>#INAME 2 C >>#INAME 3 H >>#SPECTRUM C13NOESY HC C H >> 1 7.590 120.827 3.139 1 T 3.051e+06 0.00e+00 a 0 0 0 0 0 >> 2 7.592 120.827 3.305 1 T 3.510e+06 0.00e+00 a 0 0 0 0 0 >> 3 7.590 120.827 1.061 1 T 1.352e+06 0.00e+00 a 0 0 0 0 0 >> 4 7.031 125.066 3.133 1 T 7.179e+06 0.00e+00 a 0 0 0 0 0 >> 5 7.032 125.066 3.300 1 T 5.292e+06 0.00e+00 a 0 0 0 0 0 >> 6 7.031 124.956 3.747 1 T 6.409e+06 0.00e+00 a 0 0 0 0 0 >> 7 7.031 124.975 4.221 1 T 9.819e+06 0.00e+00 a 0 0 0 0 0 >> 8 7.031 124.961 4.529 1 T 2.372e+07 0.00e+00 a 0 0 0 0 0 >> 9 7.031 124.910 1.308 1 T 6.662e+06 0.00e+00 a 0 0 0 0 0 >> 10 7.031 124.923 1.044 1 T 2.030e+06 0.00e+00 a 0 0 0 0 0 >> 11 7.031 125.025 9.859 1 T 2.514e+07 0.00e+00 a 0 0 0 0 0 >> 12 7.031 125.156 8.452 1 T 1.951e+06 0.00e+00 a 0 0 0 0 0 >> 13 7.031 124.986 8.192 1 T 2.719e+06 0.00e+00 a 0 0 0 0 0 >> 14 7.030 125.035 2.240 1 T 3.307e+06 0.00e+00 a 0 0 0 0 0 >> 15 7.420 114.259 9.855 1 T 4.902e+06 0.00e+00 a 0 0 0 0 0 >> 16 7.417 114.259 1.291 1 T 1.266e+06 0.00e+00 a 0 0 0 0 0 >> 17 7.191 124.775 7.418 1 T 1.402e+07 0.00e+00 a 0 0 0 0 0 >> 18 7.419 114.259 7.188 1 T 2.293e+07 0.00e+00 a 0 0 0 0 0 >> 19 7.191 124.775 1.185 1 T 8.540e+05 0.00e+00 a 0 0 0 0 0 >> 20 7.191 124.775 7.483 1 T 7.989e+06 0.00e+00 a 0 0 0 0 0 >> 21 7.119 122.155 7.591 1 T 3.733e+06 0.00e+00 a 0 0 0 0 0 >> 22 7.025 125.169 1.619 1 T 1.545e+06 0.00e+00 a 0 0 0 0 0 >> 23 7.028 125.073 1.938 1 T 1.206e+06 0.00e+00 a 0 0 0 0 0 >> 24 7.031 125.150 2.886 1 T 1.228e+06 0.00e+00 a 0 0 0 0 0 >> 25 6.917 131.975 4.478 1 T 8.947e+06 0.00e+00 a 0 0 0 0 0 >> 26 6.918 131.852 5.133 1 T 3.007e+06 0.00e+00 a 0 0 0 0 0 >> 27 6.919 131.895 1.666 1 T 1.213e+06 0.00e+00 a 0 0 0 0 0 >> 29 6.917 131.909 2.014 1 T 8.275e+05 0.00e+00 a 0 0 0 0 0 >> 30 6.916 132.054 2.389 1 T 5.832e+06 0.00e+00 a 0 0 0 0 0 >> 31 6.916 132.064 2.864 1 T 2.768e+06 0.00e+00 a 0 0 0 0 0 >> 32 6.918 131.928 3.146 1 T 4.784e+06 0.00e+00 a 0 0 0 0 0 >> 33 6.915 131.909 4.776 1 T 9.087e+05 0.00e+00 a 0 0 0 0 0 >> 34 6.918 131.898 6.639 1 T 3.718e+07 0.00e+00 a 0 0 0 0 0 >> 35 6.918 131.909 8.123 1 T 1.846e+06 0.00e+00 a 0 0 0 0 0 >> 36 6.916 131.909 8.526 1 T 9.996e+05 0.00e+00 a 0 0 0 0 0 >> 37 6.628 118.054 8.244 1 T 1.927e+06 0.00e+00 a 0 0 0 0 0 >> 38 6.631 118.115 6.907 1 T 5.259e+07 0.00e+00 a 0 0 0 0 0 >> 39 6.634 118.118 5.167 1 T 2.755e+06 0.00e+00 a 0 0 0 0 0 >> 40 6.627 118.092 4.484 1 T 1.951e+06 0.00e+00 a 0 0 0 0 0 >> 41 6.639 118.000 1.045 1 T 1.449e+06 0.00e+00 a 0 0 0 0 0 >> 42 6.627 118.176 1.423 1 T 2.342e+06 0.00e+00 a 0 0 0 0 0 >> 43 6.630 118.094 1.728 1 T 5.791e+06 0.00e+00 a 0 0 0 0 0 >> 44 6.631 118.092 1.977 1 T 7.359e+06 0.00e+00 a 0 0 0 0 0 >> 45 6.629 118.092 2.348 1 T 1.126e+06 0.00e+00 a 0 0 0 0 0 >> 46 6.630 118.092 2.843 1 T 1.897e+06 0.00e+00 a 0 0 0 0 0 >> 47 6.630 118.092 3.051 1 T 1.367e+06 0.00e+00 a 0 0 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-aromatic . . 13.89 ppm . . . 4.708 . . 30538 2 >> 2 . . C 13 C-aromatic . . 21 ppm . . . 123.5 . . 30538 2 >> 3 . . H 1 H . . 14 ppm . . . 4.708 . . 30538 2 >> >> stop_ >> >>save_ >> ; save_ save_spectral_peak_list_3 _Saveframe_category spectral_peak_list _Details . _Experiment_label '3D 1H-13C NOESY aliphatic' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H H-aliphatic 2 C C-aliphatic 3 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_3 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode spectral_peak_list_3 >> _Spectral_peak_list.Entry_ID 30538 >> _Spectral_peak_list.ID 3 >> _Spectral_peak_list.Name . >> _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.Chem_shift_reference_ID . >> _Spectral_peak_list.Chem_shift_reference_label . >> _Spectral_peak_list.Experiment_ID 7 >> _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aliphatic' >> _Spectral_peak_list.Experiment_class . >> _Spectral_peak_list.Experiment_type . >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _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 3 >>#FORMAT xeasy3D >>#INAME 1 HC >>#INAME 2 C >>#INAME 3 H >>#SPECTRUM C13NOESY HC C H >> 1 2.909 33.925 3.434 1 T 1.406e+07 0.00e+00 a 0 0 0 0 0 >> 2 4.511 73.390 3.665 1 T 4.995e+06 0.00e+00 a 0 0 0 0 0 >> 4 4.511 73.369 1.211 1 T 1.273e+07 0.00e+00 a 0 0 0 0 0 >> 6 4.904 62.574 1.215 1 T 4.499e+06 0.00e+00 a 0 0 0 0 0 >> 11 1.206 20.538 7.589 1 T 1.516e+06 0.00e+00 a 0 0 0 0 0 >> 12 1.208 20.628 8.568 1 T 9.348e+05 0.00e+00 a 0 0 0 0 0 >> 13 1.208 20.580 8.403 1 T 4.459e+06 0.00e+00 a 0 0 0 0 0 >> 14 1.209 20.652 9.162 1 T 1.444e+06 0.00e+00 a 0 0 0 0 0 >> 15 1.208 20.627 4.895 1 T 8.116e+06 0.00e+00 a 0 0 0 0 0 >> 16 1.207 20.690 4.502 1 T 1.459e+07 0.00e+00 a 0 0 0 0 0 >> 17 1.208 20.658 4.238 1 T 2.340e+06 0.00e+00 a 0 0 0 0 0 >> 18 1.207 20.627 3.671 1 T 3.325e+06 0.00e+00 a 0 0 0 0 0 >> 19 1.207 20.634 3.482 1 T 5.058e+06 0.00e+00 a 0 0 0 0 0 >> 20 1.208 20.639 2.574 1 T 3.888e+06 0.00e+00 a 0 0 0 0 0 >> 21 1.208 20.581 2.239 1 T 8.716e+06 0.00e+00 a 0 0 0 0 0 >> 25 4.299 67.325 4.925 1 T 9.812e+05 0.00e+00 a 0 0 0 0 0 >> 26 4.297 67.325 2.905 1 T 1.237e+06 0.00e+00 a 0 0 0 0 0 >> 27 4.298 67.325 8.374 1 T 1.691e+06 0.00e+00 a 0 0 0 0 0 >> 28 4.299 67.353 8.530 1 T 3.143e+07 0.00e+00 a 0 0 0 0 0 >> 29 4.538 69.098 8.542 1 T 1.442e+06 0.00e+00 a 0 0 0 0 0 >> 31 4.299 67.370 0.916 1 T 3.607e+06 0.00e+00 a 0 0 0 0 0 >> 32 4.299 67.372 1.224 1 T 3.392e+07 0.00e+00 a 0 0 0 0 0 >> 33 4.542 69.170 1.226 1 T 1.185e+07 0.00e+00 a 0 0 0 0 0 >> 36 1.223 21.736 4.301 1 T 1.054e+07 0.00e+00 a 0 0 0 0 0 >> 37 1.225 21.743 4.541 1 T 1.491e+07 0.00e+00 a 0 0 0 0 0 >> 38 1.223 21.702 8.533 1 T 4.171e+06 0.00e+00 a 0 0 0 0 0 >> 40 4.986 56.758 8.405 1 T 1.097e+07 0.00e+00 a 0 0 0 0 0 >> 41 4.985 56.760 7.446 1 T 1.284e+06 0.00e+00 a 0 0 0 0 0 >> 42 4.986 56.845 3.784 1 T 5.026e+06 0.00e+00 a 0 0 0 0 0 >> 43 4.986 56.760 2.086 1 T 2.693e+06 0.00e+00 a 0 0 0 0 0 >> 44 4.985 56.760 1.002 1 T 1.771e+06 0.00e+00 a 0 0 0 0 0 >> 45 2.087 50.333 4.558 1 T 1.494e+06 0.00e+00 a 0 0 0 0 0 >> 46 2.083 50.305 4.976 1 T 1.711e+06 0.00e+00 a 0 0 0 0 0 >> 47 2.083 50.310 3.795 1 T 1.183e+07 0.00e+00 a 0 0 0 0 0 >> 48 2.083 50.259 7.435 1 T 7.332e+05 0.00e+00 a 0 0 0 0 0 >> 49 2.082 50.259 8.403 1 T 1.100e+06 0.00e+00 a 0 0 0 0 0 >> 50 3.787 50.303 2.085 1 T 1.370e+07 0.00e+00 a 0 0 0 0 0 >> 51 3.793 50.392 4.977 1 T 2.966e+06 0.00e+00 a 0 0 0 0 0 >> 52 3.790 50.396 4.557 1 T 1.306e+06 0.00e+00 a 0 0 0 0 0 >> 53 3.790 50.259 7.446 1 T 2.101e+06 0.00e+00 a 0 0 0 0 0 >> 54 3.792 50.259 8.402 1 T 1.700e+06 0.00e+00 a 0 0 0 0 0 >> 55 4.985 56.760 8.502 1 T 1.332e+06 0.00e+00 a 0 0 0 0 0 >> 56 2.082 50.259 8.500 1 T 1.151e+06 0.00e+00 a 0 0 0 0 0 >> 57 3.792 50.259 8.494 1 T 5.535e+05 0.00e+00 a 0 0 0 0 0 >> 58 3.741 69.542 7.020 1 T 3.083e+06 0.00e+00 a 0 0 0 0 0 >> 60 3.958 63.001 1.042 1 T 2.613e+07 0.00e+00 a 0 0 0 0 0 >> 61 3.960 62.968 1.984 1 T 2.684e+06 0.00e+00 a 0 0 0 0 0 >> 62 3.958 63.005 1.582 1 T 6.961e+06 0.00e+00 a 0 0 0 0 0 >> 63 3.960 63.081 1.306 1 T 1.151e+06 0.00e+00 a 0 0 0 0 0 >> 64 3.958 63.043 3.461 1 T 4.194e+06 0.00e+00 a 0 0 0 0 0 >> 65 3.959 62.960 2.910 1 T 3.470e+06 0.00e+00 a 0 0 0 0 0 >> 66 3.958 62.939 3.147 1 T 1.537e+06 0.00e+00 a 0 0 0 0 0 >> 67 3.958 62.939 3.394 1 T 1.872e+06 0.00e+00 a 0 0 0 0 0 >> 68 3.743 69.575 4.544 1 T 8.629e+06 0.00e+00 a 0 0 0 0 0 >> 69 3.743 69.548 3.954 1 T 6.954e+06 0.00e+00 a 0 0 0 0 0 >> 70 3.959 63.018 4.552 1 T 5.887e+06 0.00e+00 a 0 0 0 0 0 >> 71 3.742 69.527 3.139 1 T 7.706e+06 0.00e+00 a 0 0 0 0 0 >> 72 3.742 69.403 3.275 1 T 2.015e+06 0.00e+00 a 0 0 0 0 0 >> 73 3.958 62.939 3.218 1 T 1.236e+06 0.00e+00 a 0 0 0 0 0 >> 74 3.741 69.523 1.044 1 T 2.178e+07 0.00e+00 a 0 0 0 0 0 >> 75 3.742 69.548 1.575 1 T 8.510e+05 0.00e+00 a 0 0 0 0 0 >> 76 3.744 69.548 7.568 1 T 5.700e+05 0.00e+00 a 0 0 0 0 0 >> 77 3.741 69.518 8.404 1 T 1.622e+06 0.00e+00 a 0 0 0 0 0 >> 78 3.741 69.531 7.348 1 T 7.838e+05 0.00e+00 a 0 0 0 0 0 >> 80 3.960 63.067 7.045 1 T 1.203e+06 0.00e+00 a 0 0 0 0 0 >> 81 3.958 62.987 7.444 1 T 3.066e+06 0.00e+00 a 0 0 0 0 0 >> 82 3.958 62.940 8.745 1 T 3.878e+06 0.00e+00 a 0 0 0 0 0 >> 83 3.959 62.983 8.406 1 T 8.872e+06 0.00e+00 a 0 0 0 0 0 >> 84 3.958 62.939 3.750 1 T 1.466e+07 0.00e+00 a 0 0 0 0 0 >> 86 1.044 22.412 4.983 1 T 7.350e+05 0.00e+00 a 0 0 0 0 0 >> 87 1.044 22.381 3.970 1 T 6.104e+06 0.00e+00 a 0 0 0 0 0 >> 88 1.044 22.354 3.747 1 T 9.112e+06 0.00e+00 a 0 0 0 0 0 >> 89 1.041 22.250 4.506 1 T 1.133e+06 0.00e+00 a 0 0 0 0 0 >> 90 1.041 22.316 4.235 1 T 1.105e+06 0.00e+00 a 0 0 0 0 0 >> 91 1.043 22.316 2.883 1 T 1.630e+06 0.00e+00 a 0 0 0 0 0 >> 92 1.044 22.385 3.355 1 T 1.371e+06 0.00e+00 a 0 0 0 0 0 >> 93 1.043 22.334 3.141 1 T 3.757e+06 0.00e+00 a 0 0 0 0 0 >> 94 1.042 22.316 1.982 1 T 1.917e+06 0.00e+00 a 0 0 0 0 0 >> 95 1.044 22.316 1.571 1 T 5.822e+06 0.00e+00 a 0 0 0 0 0 >> 96 1.042 22.316 7.017 1 T 5.675e+05 0.00e+00 a 0 0 0 0 0 >> 97 1.045 22.311 7.571 1 T 9.807e+05 0.00e+00 a 0 0 0 0 0 >> 98 1.043 22.358 8.403 1 T 5.473e+06 0.00e+00 a 0 0 0 0 0 >> 99 1.039 22.348 9.048 1 T 6.313e+05 0.00e+00 a 0 0 0 0 0 >> 100 1.041 22.296 8.754 1 T 7.162e+05 0.00e+00 a 0 0 0 0 0 >> 101 2.899 37.662 4.402 1 T 2.918e+06 0.00e+00 a 0 0 0 0 0 >> 102 3.031 37.673 4.398 1 T 3.628e+06 0.00e+00 a 0 0 0 0 0 >> 103 3.033 37.643 7.447 1 T 3.842e+06 0.00e+00 a 0 0 0 0 0 >> 104 2.904 37.643 7.443 1 T 3.942e+06 0.00e+00 a 0 0 0 0 0 >> 105 2.907 37.643 6.974 1 T 1.188e+06 0.00e+00 a 0 0 0 0 0 >> 106 3.031 37.643 6.977 1 T 1.320e+06 0.00e+00 a 0 0 0 0 0 >> 107 3.032 37.643 7.708 1 T 2.029e+06 0.00e+00 a 0 0 0 0 0 >> 108 2.905 37.643 7.711 1 T 2.376e+06 0.00e+00 a 0 0 0 0 0 >> 109 3.033 37.643 2.410 1 T 1.701e+06 0.00e+00 a 0 0 0 0 0 >> 110 2.908 37.642 2.421 1 T 2.644e+06 0.00e+00 a 0 0 0 0 0 >> 111 3.033 37.643 8.477 1 T 6.147e+05 0.00e+00 a 0 0 0 0 0 >> 112 2.906 37.643 8.477 1 T 5.515e+05 0.00e+00 a 0 0 0 0 0 >> 113 4.390 55.349 2.914 1 T 1.045e+07 0.00e+00 a 0 0 0 0 0 >> 114 4.390 55.349 3.037 1 T 6.973e+06 0.00e+00 a 0 0 0 0 0 >> 115 4.390 55.349 3.362 1 T 8.998e+05 0.00e+00 a 0 0 0 0 0 >> 116 4.390 55.349 3.692 1 T 5.797e+05 0.00e+00 a 0 0 0 0 0 >> 117 4.391 55.349 6.981 1 T 1.118e+06 0.00e+00 a 0 0 0 0 0 >> 118 4.391 55.349 7.449 1 T 1.039e+07 0.00e+00 a 0 0 0 0 0 >> 119 4.393 55.349 7.695 1 T 9.151e+05 0.00e+00 a 0 0 0 0 0 >> 120 4.392 55.376 8.495 1 T 3.557e+07 0.00e+00 a 0 0 0 0 0 >> 121 4.394 55.349 2.420 1 T 8.055e+05 0.00e+00 a 0 0 0 0 0 >> 122 5.138 58.521 6.913 1 T 6.191e+06 0.00e+00 a 0 0 0 0 0 >> 123 5.138 58.626 6.652 1 T 2.449e+06 0.00e+00 a 0 0 0 0 0 >> 124 3.380 67.742 5.122 1 T 3.694e+06 0.00e+00 a 0 0 0 0 0 >> 125 3.379 67.730 4.439 1 T 1.466e+07 0.00e+00 a 0 0 0 0 0 >> 126 5.139 58.591 3.381 1 T 1.523e+07 0.00e+00 a 0 0 0 0 0 >> 127 5.139 58.585 8.286 1 T 1.544e+07 0.00e+00 a 0 0 0 0 0 >> 128 5.138 58.591 8.139 1 T 5.301e+06 0.00e+00 a 0 0 0 0 0 >> 129 5.137 58.598 8.498 1 T 9.762e+06 0.00e+00 a 0 0 0 0 0 >> 130 5.140 58.591 8.953 1 T 9.056e+05 0.00e+00 a 0 0 0 0 0 >> 131 5.140 58.591 9.172 1 T 7.457e+05 0.00e+00 a 0 0 0 0 0 >> 132 3.380 67.824 8.264 1 T 3.523e+06 0.00e+00 a 0 0 0 0 0 >> 133 3.383 67.728 8.484 1 T 9.145e+05 0.00e+00 a 0 0 0 0 0 >> 134 5.137 58.636 4.202 1 T 2.332e+06 0.00e+00 a 0 0 0 0 0 >> 135 5.139 58.612 4.446 1 T 1.363e+07 0.00e+00 a 0 0 0 0 0 >> 136 3.380 67.702 4.191 1 T 1.698e+06 0.00e+00 a 0 0 0 0 0 >> 137 4.432 67.819 3.386 1 T 1.361e+07 0.00e+00 a 0 0 0 0 0 >> 138 4.433 67.821 4.198 1 T 1.729e+06 0.00e+00 a 0 0 0 0 0 >> 139 4.432 67.821 4.827 1 T 8.837e+05 0.00e+00 a 0 0 0 0 0 >> 140 3.381 67.821 4.816 1 T 7.018e+05 0.00e+00 a 0 0 0 0 0 >> 141 5.138 58.591 4.810 1 T 1.597e+06 0.00e+00 a 0 0 0 0 0 >> 142 3.382 67.821 3.176 1 T 1.739e+06 0.00e+00 a 0 0 0 0 0 >> 143 4.432 67.821 3.187 1 T 1.016e+06 0.00e+00 a 0 0 0 0 0 >> 144 4.433 67.821 2.897 1 T 3.792e+05 0.00e+00 a 0 0 0 0 0 >> 145 3.381 67.821 2.886 1 T 5.015e+05 0.00e+00 a 0 0 0 0 0 >> 146 5.141 58.591 3.171 1 T 1.220e+06 0.00e+00 a 0 0 0 0 0 >> 147 5.138 58.591 2.897 1 T 9.428e+05 0.00e+00 a 0 0 0 0 0 >> 148 5.135 58.632 2.402 1 T 1.427e+06 0.00e+00 a 0 0 0 0 0 >> 149 5.140 58.591 1.296 1 T 8.053e+05 0.00e+00 a 0 0 0 0 0 >> 150 5.138 58.591 1.974 1 T 8.354e+05 0.00e+00 a 0 0 0 0 0 >> 151 5.138 58.591 1.722 1 T 2.753e+06 0.00e+00 a 0 0 0 0 0 >> 152 5.140 58.675 1.552 1 T 1.139e+06 0.00e+00 a 0 0 0 0 0 >> 153 4.434 67.939 3.928 1 T 8.096e+05 0.00e+00 a 0 0 0 0 0 >> 155 4.432 67.821 7.046 1 T 8.745e+05 0.00e+00 a 0 0 0 0 0 >> 156 4.434 67.821 5.133 1 T 2.250e+06 0.00e+00 a 0 0 0 0 0 >> 157 4.432 67.821 8.234 1 T 1.618e+06 0.00e+00 a 0 0 0 0 0 >> 158 4.432 67.821 8.982 1 T 3.651e+05 0.00e+00 a 0 0 0 0 0 >> 159 1.953 38.132 4.621 1 T 2.971e+06 0.00e+00 a 0 0 0 0 0 >> 160 1.708 38.092 4.627 1 T 1.523e+06 0.00e+00 a 0 0 0 0 0 >> 161 1.958 38.020 6.635 1 T 2.179e+06 0.00e+00 a 0 0 0 0 0 >> 162 1.710 38.092 6.623 1 T 1.052e+06 0.00e+00 a 0 0 0 0 0 >> 163 1.709 38.168 1.950 1 T 1.596e+07 0.00e+00 a 0 0 0 0 0 >> 164 1.955 38.085 1.717 1 T 2.106e+07 0.00e+00 a 0 0 0 0 0 >> 165 1.955 38.145 8.284 1 T 1.403e+06 0.00e+00 a 0 0 0 0 0 >> 166 1.709 38.092 8.276 1 T 1.007e+06 0.00e+00 a 0 0 0 0 0 >> 167 1.709 38.092 2.415 1 T 6.127e+05 0.00e+00 a 0 0 0 0 0 >> 168 4.611 56.048 1.752 1 T 9.940e+05 0.00e+00 a 0 0 0 0 0 >> 169 4.612 55.948 1.946 1 T 2.822e+06 0.00e+00 a 0 0 0 0 0 >> 170 4.613 56.006 1.297 1 T 3.218e+06 0.00e+00 a 0 0 0 0 0 >> 171 4.613 56.058 1.427 1 T 7.635e+05 0.00e+00 a 0 0 0 0 0 >> 172 1.956 38.092 1.426 1 T 1.188e+06 0.00e+00 a 0 0 0 0 0 >> 173 1.957 38.092 1.297 1 T 1.105e+06 0.00e+00 a 0 0 0 0 0 >> 174 1.711 38.092 1.297 1 T 1.524e+06 0.00e+00 a 0 0 0 0 0 >> 175 1.709 38.092 1.423 1 T 7.376e+05 0.00e+00 a 0 0 0 0 0 >> 176 1.195 25.310 1.962 1 T 2.172e+06 0.00e+00 a 0 0 0 0 0 >> 177 1.352 25.245 4.622 1 T 1.114e+06 0.00e+00 a 0 0 0 0 0 >> 178 1.298 24.284 4.626 1 T 5.994e+06 0.00e+00 a 0 0 0 0 0 >> 179 1.438 25.681 4.644 1 T 7.940e+05 0.00e+00 a 0 0 0 0 0 >> 180 1.297 25.714 4.637 1 T 5.432e+05 0.00e+00 a 0 0 0 0 0 >> 181 1.439 25.714 1.708 1 T 2.191e+06 0.00e+00 a 0 0 0 0 0 >> 182 1.438 25.714 1.944 1 T 1.003e+06 0.00e+00 a 0 0 0 0 0 >> 183 1.438 25.714 1.297 1 T 1.198e+07 0.00e+00 a 0 0 0 0 0 >> 184 1.295 25.714 1.440 1 T 1.030e+07 0.00e+00 a 0 0 0 0 0 >> 185 1.296 25.714 1.708 1 T 1.271e+06 0.00e+00 a 0 0 0 0 0 >> 186 1.294 25.714 3.028 1 T 8.160e+05 0.00e+00 a 0 0 0 0 0 >> 187 1.441 25.714 3.028 1 T 5.984e+05 0.00e+00 a 0 0 0 0 0 >> 188 1.786 29.461 1.292 1 T 1.491e+06 0.00e+00 a 0 0 0 0 0 >> 189 1.785 29.435 3.030 1 T 3.290e+06 0.00e+00 a 0 0 0 0 0 >> 190 3.020 42.268 1.780 1 T 4.327e+06 0.00e+00 a 0 0 0 0 0 >> 191 3.020 42.249 1.302 1 T 1.468e+06 0.00e+00 a 0 0 0 0 0 >> 192 3.020 42.249 1.412 1 T 1.066e+06 0.00e+00 a 0 0 0 0 0 >> 193 2.793 40.189 3.558 1 T 2.910e+06 0.00e+00 a 0 0 0 0 0 >> 194 2.466 40.151 3.561 1 T 6.081e+06 0.00e+00 a 0 0 0 0 0 >> 195 2.465 40.066 2.795 1 T 2.113e+07 0.00e+00 a 0 0 0 0 0 >> 196 2.792 40.092 1.298 1 T 7.214e+05 0.00e+00 a 0 0 0 0 0 >> 197 2.466 40.092 1.293 1 T 9.690e+05 0.00e+00 a 0 0 0 0 0 >> 198 2.793 40.113 4.283 1 T 8.043e+05 0.00e+00 a 0 0 0 0 0 >> 199 2.792 40.092 4.588 1 T 8.023e+05 0.00e+00 a 0 0 0 0 0 >> 200 2.793 40.092 4.775 1 T 1.402e+06 0.00e+00 a 0 0 0 0 0 >> 201 2.465 40.073 4.775 1 T 2.985e+06 0.00e+00 a 0 0 0 0 0 >> 202 2.466 40.092 4.593 1 T 4.612e+05 0.00e+00 a 0 0 0 0 0 >> 203 2.463 40.110 8.514 1 T 3.413e+06 0.00e+00 a 0 0 0 0 0 >> 204 2.794 40.161 8.524 1 T 3.645e+06 0.00e+00 a 0 0 0 0 0 >> 205 2.794 40.128 2.467 1 T 1.849e+07 0.00e+00 a 0 0 0 0 0 >> 206 2.040 34.497 4.702 1 T 1.207e+06 0.00e+00 a 0 0 0 0 0 >> 207 1.804 34.475 4.690 1 T 9.692e+05 0.00e+00 a 0 0 0 0 0 >> 208 2.040 34.476 1.792 1 T 1.338e+07 0.00e+00 a 0 0 0 0 0 >> 209 1.796 34.476 2.035 1 T 1.354e+07 0.00e+00 a 0 0 0 0 0 >> 210 1.797 34.476 8.884 1 T 1.643e+06 0.00e+00 a 0 0 0 0 0 >> 211 2.040 34.497 8.879 1 T 6.186e+05 0.00e+00 a 0 0 0 0 0 >> 212 2.041 34.497 2.391 1 T 1.863e+06 0.00e+00 a 0 0 0 0 0 >> 213 1.796 34.476 2.379 1 T 2.470e+06 0.00e+00 a 0 0 0 0 0 >> 214 2.393 31.546 4.694 1 T 1.383e+06 0.00e+00 a 0 0 0 0 0 >> 215 2.392 31.560 1.789 1 T 7.034e+06 0.00e+00 a 0 0 0 0 0 >> 216 2.391 31.445 2.037 1 T 3.197e+06 0.00e+00 a 0 0 0 0 0 >> 217 2.390 31.445 1.346 1 T 1.000e+06 0.00e+00 a 0 0 0 0 0 >> 218 2.392 31.468 8.914 1 T 1.196e+06 0.00e+00 a 0 0 0 0 0 >> 219 2.395 31.593 7.628 1 T 1.131e+06 0.00e+00 a 0 0 0 0 0 >> 220 2.076 16.923 6.675 1 T 1.229e+06 0.00e+00 a 0 0 0 0 0 >> 221 2.077 16.935 6.869 1 T 9.291e+05 0.00e+00 a 0 0 0 0 0 >> 222 2.074 16.935 4.640 1 T 5.916e+05 0.00e+00 a 0 0 0 0 0 >> 223 2.076 16.935 2.084 1 T 8.715e+08 0.00e+00 a 0 0 0 0 0 >> 224 2.040 34.497 2.077 1 T 2.644e+07 0.00e+00 a 0 0 0 0 0 >> 225 1.796 34.476 2.075 1 T 1.003e+07 0.00e+00 a 0 0 0 0 0 >> 226 2.392 31.445 2.073 1 T 2.283e+06 0.00e+00 a 0 0 0 0 0 >> 227 4.301 54.253 3.003 1 T 1.935e+07 0.00e+00 a 0 0 0 0 0 >> 229 4.301 54.267 2.701 1 T 8.554e+06 0.00e+00 a 0 0 0 0 0 >> 230 2.714 37.487 4.307 1 T 2.370e+06 0.00e+00 a 0 0 0 0 0 >> 231 3.004 37.467 2.716 1 T 3.020e+07 0.00e+00 a 0 0 0 0 0 >> 232 2.719 37.393 7.621 1 T 1.718e+06 0.00e+00 a 0 0 0 0 0 >> 233 4.300 54.161 8.180 1 T 8.003e+06 0.00e+00 a 0 0 0 0 0 >> 234 4.299 54.228 9.401 1 T 6.967e+06 0.00e+00 a 0 0 0 0 0 >> 235 4.306 54.253 6.926 1 T 7.934e+05 0.00e+00 a 0 0 0 0 0 >> 236 3.003 37.474 4.307 1 T 4.443e+06 0.00e+00 a 0 0 0 0 0 >> 237 2.714 37.424 3.004 1 T 2.981e+07 0.00e+00 a 0 0 0 0 0 >> 238 4.068 45.848 7.655 1 T 2.679e+06 0.00e+00 a 0 0 0 0 0 >> 239 4.065 45.837 8.193 1 T 1.355e+07 0.00e+00 a 0 0 0 0 0 >> 240 4.063 45.832 8.023 1 T 1.488e+06 0.00e+00 a 0 0 0 0 0 >> 241 4.063 45.878 5.268 1 T 1.094e+06 0.00e+00 a 0 0 0 0 0 >> 242 4.069 45.816 2.960 1 T 1.654e+06 0.00e+00 a 0 0 0 0 0 >> 243 4.063 45.780 1.311 1 T 9.493e+05 0.00e+00 a 0 0 0 0 0 >> 244 4.067 45.806 1.651 1 T 6.412e+05 0.00e+00 a 0 0 0 0 0 >> 245 4.067 45.806 1.740 1 T 5.229e+05 0.00e+00 a 0 0 0 0 0 >> 246 5.298 54.398 1.697 1 T 1.615e+07 0.00e+00 a 0 0 0 0 0 >> 247 5.297 54.398 1.349 1 T 6.271e+06 0.00e+00 a 0 0 0 0 0 >> 248 5.298 54.442 8.898 1 T 2.666e+07 0.00e+00 a 0 0 0 0 0 >> 249 5.296 54.328 8.018 1 T 4.195e+06 0.00e+00 a 0 0 0 0 0 >> 250 5.298 54.420 7.644 1 T 5.041e+06 0.00e+00 a 0 0 0 0 0 >> 251 5.294 54.398 8.309 1 T 4.928e+05 0.00e+00 a 0 0 0 0 0 >> 252 1.702 36.157 7.643 1 T 1.467e+06 0.00e+00 a 0 0 0 0 0 >> 253 1.647 36.220 7.637 1 T 1.277e+06 0.00e+00 a 0 0 0 0 0 >> 254 1.702 36.190 8.895 1 T 1.800e+06 0.00e+00 a 0 0 0 0 0 >> 255 1.646 36.205 8.892 1 T 1.706e+06 0.00e+00 a 0 0 0 0 0 >> 256 1.646 36.157 5.299 1 T 2.730e+06 0.00e+00 a 0 0 0 0 0 >> 257 1.702 36.085 5.300 1 T 2.888e+06 0.00e+00 a 0 0 0 0 0 >> 258 5.297 54.398 2.477 1 T 7.791e+05 0.00e+00 a 0 0 0 0 0 >> 259 5.294 54.398 2.746 1 T 1.261e+06 0.00e+00 a 0 0 0 0 0 >> 260 1.700 36.124 2.465 1 T 6.245e+05 0.00e+00 a 0 0 0 0 0 >> 261 1.647 36.124 2.457 1 T 7.693e+05 0.00e+00 a 0 0 0 0 0 >> 262 5.295 54.398 0.841 1 T 8.904e+05 0.00e+00 a 0 0 0 0 0 >> 263 1.702 36.124 1.349 1 T 2.177e+06 0.00e+00 a 0 0 0 0 0 >> 264 1.648 36.124 1.349 1 T 2.738e+06 0.00e+00 a 0 0 0 0 0 >> 265 5.297 54.398 4.113 1 T 1.132e+06 0.00e+00 a 0 0 0 0 0 >> 266 1.266 24.773 5.300 1 T 8.544e+05 0.00e+00 a 0 0 0 0 0 >> 267 1.349 24.788 5.310 1 T 8.548e+05 0.00e+00 a 0 0 0 0 0 >> 268 1.266 24.788 2.929 1 T 5.869e+05 0.00e+00 a 0 0 0 0 0 >> 269 1.349 24.788 2.918 1 T 1.122e+06 0.00e+00 a 0 0 0 0 0 >> 270 5.298 54.398 1.259 1 T 3.814e+06 0.00e+00 a 0 0 0 0 0 >> 271 1.701 36.124 1.265 1 T 2.035e+06 0.00e+00 a 0 0 0 0 0 >> 272 1.646 36.124 1.262 1 T 1.333e+06 0.00e+00 a 0 0 0 0 0 >> 273 5.298 54.398 1.645 1 T 1.097e+07 0.00e+00 a 0 0 0 0 0 >> 274 1.260 24.788 1.645 1 T 3.733e+06 0.00e+00 a 0 0 0 0 0 >> 275 1.261 24.788 1.699 1 T 2.645e+06 0.00e+00 a 0 0 0 0 0 >> 276 1.350 24.788 1.642 1 T 8.279e+06 0.00e+00 a 0 0 0 0 0 >> 277 1.350 24.788 1.702 1 T 6.140e+06 0.00e+00 a 0 0 0 0 0 >> 278 2.755 40.092 0.818 1 T 2.064e+06 0.00e+00 a 0 0 0 0 0 >> 279 2.540 40.026 0.815 1 T 1.781e+06 0.00e+00 a 0 0 0 0 0 >> 280 2.755 40.106 1.537 1 T 6.419e+06 0.00e+00 a 0 0 0 0 0 >> 281 2.540 40.064 1.533 1 T 3.817e+06 0.00e+00 a 0 0 0 0 0 >> 282 2.755 40.047 2.532 1 T 1.864e+07 0.00e+00 a 0 0 0 0 0 >> 283 2.540 40.112 2.761 1 T 2.263e+07 0.00e+00 a 0 0 0 0 0 >> 285 2.543 40.097 3.215 1 T 2.065e+06 0.00e+00 a 0 0 0 0 0 >> 286 2.543 40.070 4.704 1 T 2.630e+06 0.00e+00 a 0 0 0 0 0 >> 287 2.757 40.069 4.698 1 T 1.344e+06 0.00e+00 a 0 0 0 0 0 >> 288 2.757 40.240 5.321 1 T 5.825e+05 0.00e+00 a 0 0 0 0 0 >> 289 2.541 40.025 8.917 1 T 3.683e+06 0.00e+00 a 0 0 0 0 0 >> 290 2.755 40.065 8.905 1 T 5.170e+06 0.00e+00 a 0 0 0 0 0 >> 294 1.614 33.103 4.460 1 T 2.724e+06 0.00e+00 a 0 0 0 0 0 >> 295 1.716 33.130 4.458 1 T 2.655e+06 0.00e+00 a 0 0 0 0 0 >> 299 1.613 33.035 0.857 1 T 1.292e+06 0.00e+00 a 0 0 0 0 0 >> 300 1.614 33.035 1.076 1 T 1.531e+06 0.00e+00 a 0 0 0 0 0 >> 301 1.716 33.035 1.069 1 T 2.247e+06 0.00e+00 a 0 0 0 0 0 >> 302 1.716 33.035 0.854 1 T 1.776e+06 0.00e+00 a 0 0 0 0 0 >> 303 1.613 33.035 1.349 1 T 1.400e+06 0.00e+00 a 0 0 0 0 0 >> 304 1.716 33.035 1.345 1 T 1.454e+06 0.00e+00 a 0 0 0 0 0 >> 305 1.717 33.035 8.972 1 T 1.838e+06 0.00e+00 a 0 0 0 0 0 >> 306 1.613 33.035 8.972 1 T 1.549e+06 0.00e+00 a 0 0 0 0 0 >> 307 1.613 33.145 8.274 1 T 6.144e+05 0.00e+00 a 0 0 0 0 0 >> 308 4.461 54.222 1.038 1 T 1.448e+06 0.00e+00 a 0 0 0 0 0 >> 309 4.462 54.332 0.868 1 T 2.051e+06 0.00e+00 a 0 0 0 0 0 >> 310 4.461 54.506 8.830 1 T 2.353e+07 0.00e+00 a 0 0 0 0 0 >> 311 4.461 54.337 8.976 1 T 1.361e+06 0.00e+00 a 0 0 0 0 0 >> 312 4.461 54.337 5.904 1 T 1.388e+06 0.00e+00 a 0 0 0 0 0 >> 313 4.461 54.337 2.559 1 T 8.279e+05 0.00e+00 a 0 0 0 0 0 >> 314 1.051 24.451 4.458 1 T 7.325e+05 0.00e+00 a 0 0 0 0 0 >> 315 0.864 24.401 4.466 1 T 7.948e+05 0.00e+00 a 0 0 0 0 0 >> 316 1.541 28.623 4.470 1 T 2.527e+06 0.00e+00 a 0 0 0 0 0 >> 317 1.538 28.579 8.845 1 T 1.073e+06 0.00e+00 a 0 0 0 0 0 >> 318 1.540 28.624 6.605 1 T 6.295e+05 0.00e+00 a 0 0 0 0 0 >> 319 1.540 28.666 0.856 1 T 1.439e+06 0.00e+00 a 0 0 0 0 0 >> 320 1.540 28.666 1.069 1 T 1.797e+06 0.00e+00 a 0 0 0 0 0 >> 324 2.735 41.633 4.548 1 T 3.268e+06 0.00e+00 a 0 0 0 0 0 >> 325 3.488 34.490 1.213 1 T 4.564e+06 0.00e+00 a 0 0 0 0 0 >> 326 2.582 34.580 1.212 1 T 3.049e+06 0.00e+00 a 0 0 0 0 0 >> 327 3.488 34.541 2.584 1 T 2.351e+07 0.00e+00 a 0 0 0 0 0 >> 328 2.583 34.535 3.486 1 T 1.936e+07 0.00e+00 a 0 0 0 0 0 >> 329 2.582 34.512 4.766 1 T 1.178e+06 0.00e+00 a 0 0 0 0 0 >> 330 2.584 34.614 4.489 1 T 1.059e+06 0.00e+00 a 0 0 0 0 0 >> 332 3.489 34.506 4.484 1 T 8.396e+05 0.00e+00 a 0 0 0 0 0 >> 333 3.487 34.445 4.772 1 T 2.870e+06 0.00e+00 a 0 0 0 0 0 >> 334 2.584 34.533 8.841 1 T 3.417e+06 0.00e+00 a 0 0 0 0 0 >> 335 3.493 34.533 9.166 1 T 7.340e+05 0.00e+00 a 0 0 0 0 0 >> 336 3.487 34.523 8.851 1 T 2.200e+06 0.00e+00 a 0 0 0 0 0 >> 337 3.486 34.506 8.110 1 T 1.059e+06 0.00e+00 a 0 0 0 0 0 >> 338 3.155 39.171 4.492 1 T 6.965e+06 0.00e+00 a 0 0 0 0 0 >> 339 2.403 39.275 4.485 1 T 3.723e+06 0.00e+00 a 0 0 0 0 0 >> 340 4.482 58.812 3.161 1 T 1.036e+07 0.00e+00 a 0 0 0 0 0 >> 342 3.153 39.152 0.788 1 T 1.291e+06 0.00e+00 a 0 0 0 0 0 >> 343 4.483 58.860 2.397 1 T 5.694e+06 0.00e+00 a 0 0 0 0 0 >> 344 4.485 58.829 0.778 1 T 4.250e+05 0.00e+00 a 0 0 0 0 0 >> 345 3.155 39.250 2.407 1 T 3.235e+07 0.00e+00 a 0 0 0 0 0 >> 346 2.404 39.260 0.778 1 T 7.816e+05 0.00e+00 a 0 0 0 0 0 >> 347 2.406 39.239 3.159 1 T 2.482e+07 0.00e+00 a 0 0 0 0 0 >> 348 4.484 58.942 6.921 1 T 6.443e+06 0.00e+00 a 0 0 0 0 0 >> 349 4.478 58.836 8.126 1 T 2.913e+06 0.00e+00 a 0 0 0 0 0 >> 350 4.483 58.829 9.162 1 T 1.691e+06 0.00e+00 a 0 0 0 0 0 >> 351 3.156 39.422 9.169 1 T 6.821e+05 0.00e+00 a 0 0 0 0 0 >> 352 3.154 39.187 7.680 1 T 6.841e+05 0.00e+00 a 0 0 0 0 0 >> 353 3.156 39.228 6.924 1 T 4.450e+06 0.00e+00 a 0 0 0 0 0 >> 354 3.160 39.260 8.125 1 T 3.008e+06 0.00e+00 a 0 0 0 0 0 >> 355 2.406 39.307 6.920 1 T 3.996e+06 0.00e+00 a 0 0 0 0 0 >> 356 2.404 39.252 8.116 1 T 2.890e+06 0.00e+00 a 0 0 0 0 0 >> 357 2.404 39.471 9.155 1 T 9.541e+05 0.00e+00 a 0 0 0 0 0 >> 358 4.244 43.820 4.517 1 T 2.584e+06 0.00e+00 a 0 0 0 0 0 >> 359 3.650 43.815 4.512 1 T 4.805e+06 0.00e+00 a 0 0 0 0 0 >> 360 4.245 43.821 3.655 1 T 2.340e+07 0.00e+00 a 0 0 0 0 0 >> 361 3.651 43.821 4.242 1 T 2.501e+07 0.00e+00 a 0 0 0 0 0 >> 362 3.650 43.828 1.207 1 T 4.164e+06 0.00e+00 a 0 0 0 0 0 >> 363 4.244 43.821 1.221 1 T 2.257e+06 0.00e+00 a 0 0 0 0 0 >> 365 3.649 43.841 2.085 1 T 8.927e+05 0.00e+00 a 0 0 0 0 0 >> 366 3.651 43.821 2.749 1 T 5.146e+05 0.00e+00 a 0 0 0 0 0 >> 367 3.648 43.836 8.632 1 T 5.705e+06 0.00e+00 a 0 0 0 0 0 >> 368 3.650 43.783 9.157 1 T 5.762e+06 0.00e+00 a 0 0 0 0 0 >> 369 4.245 43.821 8.637 1 T 7.904e+06 0.00e+00 a 0 0 0 0 0 >> 371 4.244 43.821 9.157 1 T 2.286e+06 0.00e+00 a 0 0 0 0 0 >> 372 4.245 43.821 7.668 1 T 4.904e+05 0.00e+00 a 0 0 0 0 0 >> 373 2.735 41.654 8.627 1 T 4.583e+06 0.00e+00 a 0 0 0 0 0 >> 374 3.142 41.595 8.630 1 T 2.835e+06 0.00e+00 a 0 0 0 0 0 >> 375 3.141 41.589 4.562 1 T 6.635e+06 0.00e+00 a 0 0 0 0 0 >> 376 4.557 54.441 3.143 1 T 4.937e+06 0.00e+00 a 0 0 0 0 0 >> 377 4.558 54.562 2.727 1 T 2.306e+06 0.00e+00 a 0 0 0 0 0 >> 378 3.139 41.470 7.611 1 T 1.146e+06 0.00e+00 a 0 0 0 0 0 >> 379 4.559 54.583 2.073 1 T 1.170e+06 0.00e+00 a 0 0 0 0 0 >> 380 3.144 41.595 2.725 1 T 2.613e+07 0.00e+00 a 0 0 0 0 0 >> 381 2.729 41.595 3.134 1 T 1.763e+07 0.00e+00 a 0 0 0 0 0 >> 382 4.557 54.463 7.617 1 T 2.880e+06 0.00e+00 a 0 0 0 0 0 >> 383 4.557 54.598 8.614 1 T 1.430e+06 0.00e+00 a 0 0 0 0 0 >> 384 2.737 41.595 7.602 1 T 4.933e+05 0.00e+00 a 0 0 0 0 0 >> 385 4.032 63.281 7.616 1 T 6.250e+06 0.00e+00 a 0 0 0 0 0 >> 386 4.032 63.251 8.527 1 T 7.430e+05 0.00e+00 a 0 0 0 0 0 >> 387 4.030 63.330 2.046 1 T 7.038e+06 0.00e+00 a 0 0 0 0 0 >> 388 4.031 63.355 0.816 1 T 4.147e+06 0.00e+00 a 0 0 0 0 0 >> 389 2.049 33.397 4.031 1 T 3.482e+06 0.00e+00 a 0 0 0 0 0 >> 390 2.050 33.322 0.819 1 T 4.722e+06 0.00e+00 a 0 0 0 0 0 >> 391 2.045 33.381 7.610 1 T 1.751e+06 0.00e+00 a 0 0 0 0 0 >> 392 0.763 19.819 2.044 1 T 1.062e+06 0.00e+00 a 0 0 0 0 0 >> 393 0.763 19.819 3.157 1 T 9.009e+05 0.00e+00 a 0 0 0 0 0 >> 394 0.816 21.521 3.149 1 T 7.946e+05 0.00e+00 a 0 0 0 0 0 >> 395 0.819 21.465 2.058 1 T 2.820e+06 0.00e+00 a 0 0 0 0 0 >> 396 0.817 21.493 4.027 1 T 4.722e+05 0.00e+00 a 0 0 0 0 0 >> 397 0.761 19.819 4.030 1 T 5.431e+05 0.00e+00 a 0 0 0 0 0 >> 398 0.762 19.651 7.607 1 T 1.722e+06 0.00e+00 a 0 0 0 0 0 >> 399 4.029 63.355 0.763 1 T 3.763e+06 0.00e+00 a 0 0 0 0 0 >> 400 2.050 33.322 0.763 1 T 3.324e+06 0.00e+00 a 0 0 0 0 0 >> 401 2.217 30.755 4.231 1 T 8.804e+06 0.00e+00 a 0 0 0 0 0 >> 402 4.228 58.668 2.226 1 T 3.188e+07 0.00e+00 a 0 0 0 0 0 >> 403 4.228 58.828 1.199 1 T 2.880e+06 0.00e+00 a 0 0 0 0 0 >> 404 4.231 58.702 1.439 1 T 1.162e+06 0.00e+00 a 0 0 0 0 0 >> 405 4.228 58.550 1.949 1 T 1.454e+06 0.00e+00 a 0 0 0 0 0 >> 406 4.228 58.636 2.539 1 T 6.271e+06 0.00e+00 a 0 0 0 0 0 >> 407 2.217 30.681 1.212 1 T 6.180e+06 0.00e+00 a 0 0 0 0 0 >> 408 2.217 30.740 4.754 1 T 2.141e+06 0.00e+00 a 0 0 0 0 0 >> 409 2.216 30.759 8.401 1 T 2.661e+06 0.00e+00 a 0 0 0 0 0 >> 410 2.217 30.769 7.598 1 T 8.458e+06 0.00e+00 a 0 0 0 0 0 >> 411 4.227 58.654 7.595 1 T 1.290e+07 0.00e+00 a 0 0 0 0 0 >> 412 4.227 58.813 8.389 1 T 3.049e+06 0.00e+00 a 0 0 0 0 0 >> 414 2.527 34.002 4.232 1 T 1.675e+06 0.00e+00 a 0 0 0 0 0 >> 415 2.321 34.118 4.231 1 T 1.728e+06 0.00e+00 a 0 0 0 0 0 >> 417 2.326 34.090 1.217 1 T 2.050e+06 0.00e+00 a 0 0 0 0 0 >> 418 2.529 34.118 1.218 1 T 9.271e+05 0.00e+00 a 0 0 0 0 0 >> 421 2.324 34.118 7.605 1 T 8.848e+05 0.00e+00 a 0 0 0 0 0 >> 422 2.529 34.118 7.605 1 T 1.344e+06 0.00e+00 a 0 0 0 0 0 >> 424 2.531 33.962 6.690 1 T 6.577e+05 0.00e+00 a 0 0 0 0 0 >> 425 2.908 33.906 3.967 1 T 6.200e+05 0.00e+00 a 0 0 0 0 0 >> 426 2.910 34.007 4.735 1 T 1.718e+06 0.00e+00 a 0 0 0 0 0 >> 427 2.910 34.017 4.490 1 T 7.499e+05 0.00e+00 a 0 0 0 0 0 >> 428 2.908 33.938 8.479 1 T 3.030e+06 0.00e+00 a 0 0 0 0 0 >> 429 2.910 33.811 8.727 1 T 7.819e+05 0.00e+00 a 0 0 0 0 0 >> 430 3.436 33.930 2.908 1 T 1.476e+07 0.00e+00 a 0 0 0 0 0 >> 432 3.434 33.919 3.938 1 T 6.349e+05 0.00e+00 a 0 0 0 0 0 >> 433 3.434 33.919 4.484 1 T 7.639e+05 0.00e+00 a 0 0 0 0 0 >> 434 3.433 33.973 4.737 1 T 3.041e+06 0.00e+00 a 0 0 0 0 0 >> 435 3.436 34.007 8.477 1 T 2.075e+06 0.00e+00 a 0 0 0 0 0 >> 436 3.713 59.755 0.951 1 T 1.341e+07 0.00e+00 a 0 0 0 0 0 >> 437 3.713 59.755 1.592 1 T 1.147e+07 0.00e+00 a 0 0 0 0 0 >> 438 3.714 59.744 1.990 1 T 6.594e+06 0.00e+00 a 0 0 0 0 0 >> 439 3.713 59.774 2.896 1 T 9.480e+05 0.00e+00 a 0 0 0 0 0 >> 440 3.713 59.740 4.288 1 T 3.899e+06 0.00e+00 a 0 0 0 0 0 >> 441 3.716 59.867 4.963 1 T 1.511e+06 0.00e+00 a 0 0 0 0 0 >> 443 3.715 59.789 8.726 1 T 6.077e+06 0.00e+00 a 0 0 0 0 0 >> 444 3.717 59.792 8.143 1 T 1.674e+06 0.00e+00 a 0 0 0 0 0 >> 445 3.717 59.657 7.642 1 T 1.088e+06 0.00e+00 a 0 0 0 0 0 >> 446 3.713 59.755 8.504 1 T 9.695e+06 0.00e+00 a 0 0 0 0 0 >> 447 3.717 59.564 7.846 1 T 8.475e+05 0.00e+00 a 0 0 0 0 0 >> 448 1.593 31.856 8.738 1 T 3.880e+06 0.00e+00 a 0 0 0 0 0 >> 449 1.592 31.774 8.465 1 T 4.973e+05 0.00e+00 a 0 0 0 0 0 >> 450 1.592 31.932 8.166 1 T 8.408e+05 0.00e+00 a 0 0 0 0 0 >> 452 1.987 32.062 7.592 1 T 1.849e+06 0.00e+00 a 0 0 0 0 0 >> 453 1.991 31.858 8.736 1 T 3.251e+06 0.00e+00 a 0 0 0 0 0 >> 454 1.987 31.903 8.151 1 T 6.059e+06 0.00e+00 a 0 0 0 0 0 >> 455 1.985 31.853 4.230 1 T 2.662e+06 0.00e+00 a 0 0 0 0 0 >> 456 1.987 31.992 3.981 1 T 4.414e+06 0.00e+00 a 0 0 0 0 0 >> 457 1.994 31.880 3.712 1 T 1.562e+06 0.00e+00 a 0 0 0 0 0 >> 458 3.714 59.745 1.196 1 T 5.485e+06 0.00e+00 a 0 0 0 0 0 >> 459 1.593 31.873 3.712 1 T 3.307e+06 0.00e+00 a 0 0 0 0 0 >> 460 1.592 31.891 1.994 1 T 1.496e+07 0.00e+00 a 0 0 0 0 0 >> 462 1.589 31.878 3.970 1 T 1.894e+06 0.00e+00 a 0 0 0 0 0 >> 463 1.593 31.891 0.947 1 T 3.562e+06 0.00e+00 a 0 0 0 0 0 >> 464 1.592 31.891 1.181 1 T 1.368e+06 0.00e+00 a 0 0 0 0 0 >> 466 1.993 31.886 1.204 1 T 2.331e+06 0.00e+00 a 0 0 0 0 0 >> 467 1.995 31.880 0.951 1 T 2.468e+06 0.00e+00 a 0 0 0 0 0 >> 468 1.201 25.215 0.936 1 T 1.733e+07 0.00e+00 a 0 0 0 0 0 >> 469 0.931 25.337 1.205 1 T 1.392e+07 0.00e+00 a 0 0 0 0 0 >> 470 0.938 25.157 1.994 1 T 1.575e+06 0.00e+00 a 0 0 0 0 0 >> 471 0.937 25.157 2.897 1 T 1.565e+06 0.00e+00 a 0 0 0 0 0 >> 472 0.937 25.157 3.715 1 T 2.118e+06 0.00e+00 a 0 0 0 0 0 >> 473 0.938 25.350 4.289 1 T 1.055e+06 0.00e+00 a 0 0 0 0 0 >> 474 1.196 25.283 2.886 1 T 1.517e+06 0.00e+00 a 0 0 0 0 0 >> 475 1.202 25.312 3.700 1 T 1.018e+06 0.00e+00 a 0 0 0 0 0 >> 477 1.201 25.157 4.286 1 T 8.516e+05 0.00e+00 a 0 0 0 0 0 >> 478 1.439 29.648 2.890 1 T 3.197e+06 0.00e+00 a 0 0 0 0 0 >> 479 1.539 29.522 2.895 1 T 4.018e+06 0.00e+00 a 0 0 0 0 0 >> 480 1.539 29.522 0.952 1 T 2.553e+06 0.00e+00 a 0 0 0 0 0 >> 481 1.439 29.522 0.952 1 T 2.947e+06 0.00e+00 a 0 0 0 0 0 >> 482 1.436 29.522 1.193 1 T 1.445e+06 0.00e+00 a 0 0 0 0 0 >> 483 1.539 29.522 1.201 1 T 1.958e+06 0.00e+00 a 0 0 0 0 0 >> 484 1.538 29.522 1.995 1 T 1.471e+06 0.00e+00 a 0 0 0 0 0 >> 485 1.437 29.522 1.988 1 T 1.172e+06 0.00e+00 a 0 0 0 0 0 >> 486 2.888 42.236 0.950 1 T 6.157e+06 0.00e+00 a 0 0 0 0 0 >> 487 2.889 42.226 1.201 1 T 4.167e+06 0.00e+00 a 0 0 0 0 0 >> 488 2.888 42.226 1.434 1 T 3.018e+06 0.00e+00 a 0 0 0 0 0 >> 489 2.890 42.226 1.543 1 T 9.897e+06 0.00e+00 a 0 0 0 0 0 >> 490 2.888 42.226 1.598 1 T 5.361e+06 0.00e+00 a 0 0 0 0 0 >> 492 1.889 31.911 4.242 1 T 1.960e+06 0.00e+00 a 0 0 0 0 0 >> 493 1.890 31.884 3.991 1 T 4.442e+06 0.00e+00 a 0 0 0 0 0 >> 494 1.892 31.949 7.606 1 T 2.014e+06 0.00e+00 a 0 0 0 0 0 >> 495 1.890 31.946 8.154 1 T 4.127e+06 0.00e+00 a 0 0 0 0 0 >> 496 3.974 59.535 7.609 1 T 3.402e+06 0.00e+00 a 0 0 0 0 0 >> 497 3.974 59.437 8.149 1 T 1.060e+07 0.00e+00 a 0 0 0 0 0 >> 498 3.973 59.457 8.508 1 T 8.989e+05 0.00e+00 a 0 0 0 0 0 >> 499 3.973 59.478 1.592 1 T 4.171e+06 0.00e+00 a 0 0 0 0 0 >> 500 3.974 59.473 1.409 1 T 1.059e+07 0.00e+00 a 0 0 0 0 0 >> 501 3.972 59.459 1.225 1 T 2.745e+06 0.00e+00 a 0 0 0 0 0 >> 502 3.972 59.473 1.892 1 T 1.460e+07 0.00e+00 a 0 0 0 0 0 >> 503 3.973 59.473 1.991 1 T 1.280e+07 0.00e+00 a 0 0 0 0 0 >> 506 1.486 25.033 3.969 1 T 8.746e+05 0.00e+00 a 0 0 0 0 0 >> 507 1.403 25.033 3.969 1 T 1.014e+06 0.00e+00 a 0 0 0 0 0 >> 508 3.973 59.473 1.490 1 T 1.888e+06 0.00e+00 a 0 0 0 0 0 >> 509 1.489 25.095 8.393 1 T 9.625e+05 0.00e+00 a 0 0 0 0 0 >> 510 1.407 25.033 8.168 1 T 5.390e+05 0.00e+00 a 0 0 0 0 0 >> 511 1.644 29.077 3.973 1 T 1.414e+06 0.00e+00 a 0 0 0 0 0 >> 512 1.643 29.136 8.418 1 T 7.927e+05 0.00e+00 a 0 0 0 0 0 >> 513 1.648 29.100 2.935 1 T 4.071e+06 0.00e+00 a 0 0 0 0 0 >> 514 2.934 42.104 2.937 1 T 8.804e+08 0.00e+00 a 0 0 0 0 0 >> 515 4.255 65.492 0.830 1 T 1.666e+06 0.00e+00 a 0 0 0 0 0 >> 516 1.826 32.697 0.819 1 T 2.983e+06 0.00e+00 a 0 0 0 0 0 >> 517 2.436 32.708 0.817 1 T 3.745e+06 0.00e+00 a 0 0 0 0 0 >> 518 2.434 32.682 1.140 1 T 6.176e+05 0.00e+00 a 0 0 0 0 0 >> 519 3.610 51.287 0.843 1 T 9.194e+05 0.00e+00 a 0 0 0 0 0 >> 521 3.719 51.255 0.844 1 T 7.252e+05 0.00e+00 a 0 0 0 0 0 >> 522 2.042 27.968 0.844 1 T 1.899e+06 0.00e+00 a 0 0 0 0 0 >> 523 2.251 27.971 0.844 1 T 3.429e+06 0.00e+00 a 0 0 0 0 0 >> 524 4.257 65.461 1.824 1 T 1.085e+07 0.00e+00 a 0 0 0 0 0 >> 525 4.257 65.461 2.048 1 T 1.055e+07 0.00e+00 a 0 0 0 0 0 >> 526 4.256 65.461 2.242 1 T 1.643e+06 0.00e+00 a 0 0 0 0 0 >> 527 4.256 65.461 2.431 1 T 2.675e+07 0.00e+00 a 0 0 0 0 0 >> 528 2.435 32.682 1.819 1 T 2.649e+07 0.00e+00 a 0 0 0 0 0 >> 529 3.721 51.255 1.824 1 T 1.902e+06 0.00e+00 a 0 0 0 0 0 >> 530 3.720 51.255 2.043 1 T 8.120e+06 0.00e+00 a 0 0 0 0 0 >> 531 3.718 51.255 2.258 1 T 3.458e+06 0.00e+00 a 0 0 0 0 0 >> 532 3.721 51.255 2.436 1 T 9.297e+05 0.00e+00 a 0 0 0 0 0 >> 533 3.610 51.260 2.431 1 T 1.484e+06 0.00e+00 a 0 0 0 0 0 >> 534 3.614 51.260 2.242 1 T 3.995e+06 0.00e+00 a 0 0 0 0 0 >> 535 3.612 51.260 2.048 1 T 1.030e+07 0.00e+00 a 0 0 0 0 0 >> 536 3.612 51.260 1.819 1 T 1.175e+06 0.00e+00 a 0 0 0 0 0 >> 537 2.042 27.968 1.824 1 T 2.612e+06 0.00e+00 a 0 0 0 0 0 >> 538 2.249 27.933 1.819 1 T 3.791e+06 0.00e+00 a 0 0 0 0 0 >> 539 2.248 27.933 2.048 1 T 2.588e+07 0.00e+00 a 0 0 0 0 0 >> 540 2.251 27.933 2.436 1 T 3.012e+06 0.00e+00 a 0 0 0 0 0 >> 541 2.041 27.968 2.431 1 T 2.707e+06 0.00e+00 a 0 0 0 0 0 >> 542 2.041 27.968 2.247 1 T 2.142e+07 0.00e+00 a 0 0 0 0 0 >> 543 2.251 28.247 4.263 1 T 1.168e+06 0.00e+00 a 0 0 0 0 0 >> 544 2.250 27.845 4.008 1 T 6.638e+05 0.00e+00 a 0 0 0 0 0 >> 545 2.248 27.721 4.659 1 T 8.331e+05 0.00e+00 a 0 0 0 0 0 >> 546 2.249 27.933 3.615 1 T 2.351e+06 0.00e+00 a 0 0 0 0 0 >> 547 2.247 27.933 3.722 1 T 3.783e+06 0.00e+00 a 0 0 0 0 0 >> 548 2.042 27.968 3.609 1 T 3.600e+06 0.00e+00 a 0 0 0 0 0 >> 549 2.041 27.968 3.727 1 T 2.086e+06 0.00e+00 a 0 0 0 0 0 >> 550 2.436 32.682 3.604 1 T 1.023e+06 0.00e+00 a 0 0 0 0 0 >> 551 2.436 32.682 3.722 1 T 8.141e+05 0.00e+00 a 0 0 0 0 0 >> 552 2.434 32.682 4.258 1 T 9.655e+06 0.00e+00 a 0 0 0 0 0 >> 553 1.827 32.688 4.253 1 T 3.546e+06 0.00e+00 a 0 0 0 0 0 >> 554 1.827 32.688 3.620 1 T 8.509e+05 0.00e+00 a 0 0 0 0 0 >> 555 1.826 32.688 3.712 1 T 1.395e+06 0.00e+00 a 0 0 0 0 0 >> 556 4.255 65.461 3.608 1 T 2.428e+06 0.00e+00 a 0 0 0 0 0 >> 557 4.257 65.461 3.718 1 T 1.362e+06 0.00e+00 a 0 0 0 0 0 >> 558 3.613 51.295 9.079 1 T 6.089e+06 0.00e+00 a 0 0 0 0 0 >> 559 3.614 51.224 8.440 1 T 1.231e+06 0.00e+00 a 0 0 0 0 0 >> 560 3.614 51.237 7.321 1 T 8.578e+05 0.00e+00 a 0 0 0 0 0 >> 561 3.721 51.463 8.466 1 T 9.941e+05 0.00e+00 a 0 0 0 0 0 >> 562 3.720 51.270 9.081 1 T 5.694e+06 0.00e+00 a 0 0 0 0 0 >> 563 3.723 51.275 7.312 1 T 5.837e+05 0.00e+00 a 0 0 0 0 0 >> 565 2.434 32.682 8.467 1 T 8.195e+05 0.00e+00 a 0 0 0 0 0 >> 566 1.825 32.672 8.471 1 T 2.235e+06 0.00e+00 a 0 0 0 0 0 >> 567 4.257 65.461 7.609 1 T 1.187e+06 0.00e+00 a 0 0 0 0 0 >> 568 4.258 65.426 8.185 1 T 4.489e+06 0.00e+00 a 0 0 0 0 0 >> 569 4.254 65.376 8.436 1 T 1.946e+06 0.00e+00 a 0 0 0 0 0 >> 570 2.249 27.968 8.470 1 T 7.210e+05 0.00e+00 a 0 0 0 0 0 >> 571 3.615 51.056 4.660 1 T 1.082e+06 0.00e+00 a 0 0 0 0 0 >> 572 3.719 51.177 4.657 1 T 1.279e+06 0.00e+00 a 0 0 0 0 0 >> 573 4.258 65.461 1.446 1 T 1.514e+06 0.00e+00 a 0 0 0 0 0 >> 574 4.255 65.461 1.563 1 T 1.667e+06 0.00e+00 a 0 0 0 0 0 >> 575 1.826 32.688 2.433 1 T 1.673e+07 0.00e+00 a 0 0 0 0 0 >> 576 4.028 47.855 2.009 1 T 1.523e+06 0.00e+00 a 0 0 0 0 0 >> 577 4.024 47.853 1.014 1 T 6.610e+05 0.00e+00 a 0 0 0 0 0 >> 578 4.028 47.708 1.599 1 T 9.220e+05 0.00e+00 a 0 0 0 0 0 >> 580 3.910 47.733 1.593 1 T 6.529e+05 0.00e+00 a 0 0 0 0 0 >> 581 3.908 47.733 1.998 1 T 1.651e+06 0.00e+00 a 0 0 0 0 0 >> 582 4.024 47.733 3.657 1 T 6.299e+06 0.00e+00 a 0 0 0 0 0 >> 583 3.910 47.733 3.651 1 T 9.374e+06 0.00e+00 a 0 0 0 0 0 >> 584 4.025 47.778 9.080 1 T 7.747e+06 0.00e+00 a 0 0 0 0 0 >> 585 3.904 47.779 9.077 1 T 9.817e+06 0.00e+00 a 0 0 0 0 0 >> 586 3.911 47.733 8.794 1 T 7.171e+05 0.00e+00 a 0 0 0 0 0 >> 587 4.537 60.010 1.039 1 T 2.361e+06 0.00e+00 a 0 0 0 0 0 >> 588 3.305 28.956 1.049 1 T 2.559e+06 0.00e+00 a 0 0 0 0 0 >> 589 3.129 28.981 1.048 1 T 3.991e+06 0.00e+00 a 0 0 0 0 0 >> 591 4.535 59.944 2.905 1 T 1.469e+06 0.00e+00 a 0 0 0 0 0 >> 592 4.536 59.944 3.145 1 T 5.627e+06 0.00e+00 a 0 0 0 0 0 >> 593 4.537 59.944 3.299 1 T 3.293e+06 0.00e+00 a 0 0 0 0 0 >> 594 4.536 59.951 3.749 1 T 5.708e+06 0.00e+00 a 0 0 0 0 0 >> 595 4.542 59.977 3.963 1 T 3.050e+06 0.00e+00 a 0 0 0 0 0 >> 596 3.138 29.094 4.535 1 T 2.593e+06 0.00e+00 a 0 0 0 0 0 >> 597 3.302 29.051 4.533 1 T 2.113e+06 0.00e+00 a 0 0 0 0 0 >> 598 3.303 29.047 3.141 1 T 2.104e+07 0.00e+00 a 0 0 0 0 0 >> 599 3.138 29.023 3.299 1 T 2.630e+07 0.00e+00 a 0 0 0 0 0 >> 600 3.303 29.053 3.744 1 T 1.073e+06 0.00e+00 a 0 0 0 0 0 >> 601 3.140 29.053 3.739 1 T 1.676e+06 0.00e+00 a 0 0 0 0 0 >> 602 3.138 29.053 4.003 1 T 7.273e+05 0.00e+00 a 0 0 0 0 0 >> 603 3.303 29.053 4.018 1 T 5.443e+05 0.00e+00 a 0 0 0 0 0 >> 604 4.537 60.016 7.034 1 T 4.747e+06 0.00e+00 a 0 0 0 0 0 >> 605 4.538 60.060 7.295 1 T 3.159e+06 0.00e+00 a 0 0 0 0 0 >> 606 4.534 59.932 9.115 1 T 8.413e+05 0.00e+00 a 0 0 0 0 0 >> 607 4.535 59.961 11.400 1 T 6.237e+05 0.00e+00 a 0 0 0 0 0 >> 608 3.304 28.981 9.079 1 T 3.050e+06 0.00e+00 a 0 0 0 0 0 >> 609 3.137 29.053 9.077 1 T 2.779e+06 0.00e+00 a 0 0 0 0 0 >> 610 3.134 29.068 7.601 1 T 1.801e+06 0.00e+00 a 0 0 0 0 0 >> 611 3.133 29.083 7.284 1 T 2.328e+06 0.00e+00 a 0 0 0 0 0 >> 612 3.302 28.962 7.609 1 T 1.662e+06 0.00e+00 a 0 0 0 0 0 >> 613 3.303 28.942 7.291 1 T 2.830e+06 0.00e+00 a 0 0 0 0 0 >> 614 3.304 29.016 7.075 1 T 4.753e+05 0.00e+00 a 0 0 0 0 0 >> 615 3.136 29.065 7.086 1 T 7.393e+05 0.00e+00 a 0 0 0 0 0 >> 618 3.245 38.366 1.294 1 T 8.882e+05 0.00e+00 a 0 0 0 0 0 >> 619 3.151 38.441 1.299 1 T 1.045e+06 0.00e+00 a 0 0 0 0 0 >> 620 3.244 38.386 2.527 1 T 1.700e+06 0.00e+00 a 0 0 0 0 0 >> 621 3.149 38.386 2.538 1 T 1.996e+06 0.00e+00 a 0 0 0 0 0 >> 622 3.249 38.413 4.679 1 T 1.829e+06 0.00e+00 a 0 0 0 0 0 >> 623 3.250 38.364 4.471 1 T 7.329e+05 0.00e+00 a 0 0 0 0 0 >> 624 3.153 38.375 4.672 1 T 2.978e+06 0.00e+00 a 0 0 0 0 0 >> 625 3.150 38.386 4.468 1 T 1.398e+06 0.00e+00 a 0 0 0 0 0 >> 626 3.248 38.467 7.278 1 T 6.945e+05 0.00e+00 a 0 0 0 0 0 >> 627 3.152 38.340 7.287 1 T 7.351e+05 0.00e+00 a 0 0 0 0 0 >> 629 3.248 38.424 8.152 1 T 2.021e+06 0.00e+00 a 0 0 0 0 0 >> 630 3.149 38.681 8.144 1 T 3.366e+06 0.00e+00 a 0 0 0 0 0 >> 631 4.024 57.776 0.890 1 T 9.344e+05 0.00e+00 a 0 0 0 0 0 >> 632 4.023 57.489 1.217 1 T 1.257e+06 0.00e+00 a 0 0 0 0 0 >> 635 4.023 57.651 2.137 1 T 2.117e+07 0.00e+00 a 0 0 0 0 0 >> 636 4.025 57.651 2.281 1 T 4.555e+06 0.00e+00 a 0 0 0 0 0 >> 637 4.024 57.651 2.418 1 T 1.401e+07 0.00e+00 a 0 0 0 0 0 >> 638 4.025 57.613 7.152 1 T 7.196e+06 0.00e+00 a 0 0 0 0 0 >> 639 4.023 57.726 7.558 1 T 8.610e+05 0.00e+00 a 0 0 0 0 0 >> 640 4.022 57.795 8.141 1 T 2.492e+06 0.00e+00 a 0 0 0 0 0 >> 641 4.027 57.456 9.072 1 T 9.461e+05 0.00e+00 a 0 0 0 0 0 >> 642 2.150 29.086 8.131 1 T 9.584e+05 0.00e+00 a 0 0 0 0 0 >> 643 2.144 29.042 7.144 1 T 4.720e+06 0.00e+00 a 0 0 0 0 0 >> 644 2.140 29.078 7.537 1 T 9.978e+05 0.00e+00 a 0 0 0 0 0 >> 645 2.149 28.943 9.022 1 T 7.678e+05 0.00e+00 a 0 0 0 0 0 >> 646 2.145 29.014 4.033 1 T 5.790e+06 0.00e+00 a 0 0 0 0 0 >> 647 2.140 29.021 4.794 1 T 9.419e+05 0.00e+00 a 0 0 0 0 0 >> 648 2.145 29.057 3.140 1 T 2.295e+06 0.00e+00 a 0 0 0 0 0 >> 649 2.144 29.113 2.918 1 T 1.199e+06 0.00e+00 a 0 0 0 0 0 >> 651 2.408 34.621 4.032 1 T 4.493e+06 0.00e+00 a 0 0 0 0 0 >> 652 2.279 34.650 4.025 1 T 4.680e+06 0.00e+00 a 0 0 0 0 0 >> 655 2.409 34.665 7.532 1 T 1.984e+06 0.00e+00 a 0 0 0 0 0 >> 656 2.411 34.608 7.136 1 T 2.532e+06 0.00e+00 a 0 0 0 0 0 >> 657 2.409 34.576 6.882 1 T 1.008e+06 0.00e+00 a 0 0 0 0 0 >> 658 2.280 34.576 6.875 1 T 8.097e+05 0.00e+00 a 0 0 0 0 0 >> 659 2.281 34.746 7.522 1 T 1.735e+06 0.00e+00 a 0 0 0 0 0 >> 660 2.280 34.766 7.128 1 T 1.941e+06 0.00e+00 a 0 0 0 0 0 >> 661 2.268 57.871 8.454 1 T 2.436e+06 0.00e+00 a 0 0 0 0 0 >> 662 1.230 28.837 8.464 1 T 1.294e+06 0.00e+00 a 0 0 0 0 0 >> 663 1.173 28.753 8.462 1 T 1.205e+06 0.00e+00 a 0 0 0 0 0 >> 664 1.176 28.797 7.163 1 T 8.868e+05 0.00e+00 a 0 0 0 0 0 >> 665 1.227 28.677 7.137 1 T 5.016e+05 0.00e+00 a 0 0 0 0 0 >> 666 2.609 42.629 7.169 1 T 9.312e+05 0.00e+00 a 0 0 0 0 0 >> 667 1.233 28.741 2.267 1 T 2.124e+06 0.00e+00 a 0 0 0 0 0 >> 669 1.234 28.625 2.613 1 T 1.218e+06 0.00e+00 a 0 0 0 0 0 >> 670 1.176 28.650 2.274 1 T 2.724e+06 0.00e+00 a 0 0 0 0 0 >> 671 1.178 28.658 2.628 1 T 1.163e+06 0.00e+00 a 0 0 0 0 0 >> 672 2.270 57.885 2.609 1 T 1.613e+06 0.00e+00 a 0 0 0 0 0 >> 673 2.267 57.885 0.947 1 T 2.251e+06 0.00e+00 a 0 0 0 0 0 >> 674 2.269 57.885 1.234 1 T 1.159e+07 0.00e+00 a 0 0 0 0 0 >> 675 2.269 57.885 1.183 1 T 7.998e+06 0.00e+00 a 0 0 0 0 0 >> 676 2.267 57.885 0.858 1 T 1.537e+06 0.00e+00 a 0 0 0 0 0 >> 677 1.235 28.692 0.853 1 T 8.293e+05 0.00e+00 a 0 0 0 0 0 >> 678 1.233 28.692 0.951 1 T 1.112e+06 0.00e+00 a 0 0 0 0 0 >> 679 1.180 28.692 0.853 1 T 1.181e+06 0.00e+00 a 0 0 0 0 0 >> 680 1.179 28.692 0.951 1 T 8.562e+05 0.00e+00 a 0 0 0 0 0 >> 681 0.962 26.788 7.175 1 T 5.490e+05 0.00e+00 a 0 0 0 0 0 >> 682 0.958 26.832 2.615 1 T 2.972e+06 0.00e+00 a 0 0 0 0 0 >> 683 0.854 26.813 2.610 1 T 2.125e+06 0.00e+00 a 0 0 0 0 0 >> 684 0.854 26.913 2.263 1 T 4.071e+05 0.00e+00 a 0 0 0 0 0 >> 685 0.958 26.913 2.257 1 T 5.309e+05 0.00e+00 a 0 0 0 0 0 >> 686 2.613 42.629 0.953 1 T 3.241e+06 0.00e+00 a 0 0 0 0 0 >> 687 2.611 42.629 0.850 1 T 3.752e+06 0.00e+00 a 0 0 0 0 0 >> 688 2.611 42.629 1.179 1 T 2.212e+06 0.00e+00 a 0 0 0 0 0 >> 689 2.611 42.629 1.233 1 T 3.749e+06 0.00e+00 a 0 0 0 0 0 >> 690 2.273 57.869 9.859 1 T 1.302e+06 0.00e+00 a 0 0 0 0 0 >> 691 2.270 57.885 7.116 1 T 9.991e+05 0.00e+00 a 0 0 0 0 0 >> 692 2.268 57.885 7.281 1 T 8.071e+05 0.00e+00 a 0 0 0 0 0 >> 693 2.271 57.885 7.585 1 T 5.321e+05 0.00e+00 a 0 0 0 0 0 >> 694 2.270 57.885 8.170 1 T 4.471e+05 0.00e+00 a 0 0 0 0 0 >> 695 3.549 67.334 1.300 1 T 1.231e+07 0.00e+00 a 0 0 0 0 0 >> 696 4.087 69.126 1.303 1 T 1.606e+07 0.00e+00 a 0 0 0 0 0 >> 697 4.087 69.104 3.546 1 T 1.790e+06 0.00e+00 a 0 0 0 0 0 >> 699 1.298 24.289 3.549 1 T 3.868e+06 0.00e+00 a 0 0 0 0 0 >> 700 1.297 24.282 3.232 1 T 1.094e+06 0.00e+00 a 0 0 0 0 0 >> 701 1.298 24.305 3.847 1 T 6.029e+05 0.00e+00 a 0 0 0 0 0 >> 702 1.298 24.334 4.084 1 T 8.721e+06 0.00e+00 a 0 0 0 0 0 >> 703 1.298 24.206 7.034 1 T 1.038e+06 0.00e+00 a 0 0 0 0 0 >> 704 1.298 24.291 9.860 1 T 5.062e+06 0.00e+00 a 0 0 0 0 0 >> 705 1.298 24.229 8.520 1 T 2.197e+06 0.00e+00 a 0 0 0 0 0 >> 706 1.298 24.228 8.182 1 T 6.096e+05 0.00e+00 a 0 0 0 0 0 >> 707 4.086 69.073 8.856 1 T 1.115e+06 0.00e+00 a 0 0 0 0 0 >> 708 4.086 69.045 8.485 1 T 1.766e+06 0.00e+00 a 0 0 0 0 0 >> 709 3.549 67.390 8.876 1 T 7.060e+05 0.00e+00 a 0 0 0 0 0 >> 710 3.548 67.378 8.522 1 T 6.524e+06 0.00e+00 a 0 0 0 0 0 >> 711 3.549 67.363 8.144 1 T 1.520e+06 0.00e+00 a 0 0 0 0 0 >> 712 3.549 67.424 7.171 1 T 8.378e+05 0.00e+00 a 0 0 0 0 0 >> 713 3.548 67.340 2.802 1 T 6.517e+06 0.00e+00 a 0 0 0 0 0 >> 714 3.549 67.325 2.471 1 T 1.504e+07 0.00e+00 a 0 0 0 0 0 >> 716 3.550 67.344 4.082 1 T 2.520e+06 0.00e+00 a 0 0 0 0 0 >> 717 3.548 67.348 4.333 1 T 7.079e+05 0.00e+00 a 0 0 0 0 0 >> 718 3.551 67.348 4.633 1 T 1.645e+06 0.00e+00 a 0 0 0 0 0 >> 719 3.551 67.348 4.760 1 T 1.191e+06 0.00e+00 a 0 0 0 0 0 >> 720 3.929 44.601 4.279 1 T 2.310e+07 0.00e+00 a 0 0 0 0 0 >> 721 4.286 44.589 3.920 1 T 2.561e+07 0.00e+00 a 0 0 0 0 0 >> 722 3.930 44.691 7.549 1 T 2.853e+06 0.00e+00 a 0 0 0 0 0 >> 723 4.285 44.680 7.545 1 T 2.701e+06 0.00e+00 a 0 0 0 0 0 >> 724 3.760 64.113 4.555 1 T 7.876e+06 0.00e+00 a 0 0 0 0 0 >> 725 3.900 64.089 4.551 1 T 6.204e+06 0.00e+00 a 0 0 0 0 0 >> 726 3.760 64.119 3.904 1 T 5.274e+07 0.00e+00 a 0 0 0 0 0 >> 727 3.900 64.098 3.751 1 T 4.465e+07 0.00e+00 a 0 0 0 0 0 >> 728 3.759 64.129 7.536 1 T 1.010e+06 0.00e+00 a 0 0 0 0 0 >> 729 3.900 64.111 7.542 1 T 8.141e+05 0.00e+00 a 0 0 0 0 0 >> 730 3.757 64.151 9.057 1 T 1.498e+06 0.00e+00 a 0 0 0 0 0 >> 731 3.899 64.118 9.047 1 T 1.234e+06 0.00e+00 a 0 0 0 0 0 >> 735 4.552 57.813 9.044 1 T 1.648e+06 0.00e+00 a 0 0 0 0 0 >> 736 4.552 57.813 7.542 1 T 8.504e+05 0.00e+00 a 0 0 0 0 0 >> 737 4.553 57.813 3.896 1 T 5.322e+06 0.00e+00 a 0 0 0 0 0 >> 738 4.552 57.813 3.754 1 T 5.480e+06 0.00e+00 a 0 0 0 0 0 >> 741 3.127 46.677 8.009 1 T 7.900e+05 0.00e+00 a 0 0 0 0 0 >> 742 3.123 46.652 9.044 1 T 1.637e+06 0.00e+00 a 0 0 0 0 0 >> 743 3.123 46.634 7.540 1 T 3.048e+06 0.00e+00 a 0 0 0 0 0 >> 744 2.921 46.717 7.529 1 T 1.701e+06 0.00e+00 a 0 0 0 0 0 >> 745 2.917 46.642 9.059 1 T 1.387e+06 0.00e+00 a 0 0 0 0 0 >> 746 2.913 46.619 8.025 1 T 7.896e+05 0.00e+00 a 0 0 0 0 0 >> 747 3.124 46.640 4.638 1 T 6.936e+05 0.00e+00 a 0 0 0 0 0 >> 748 3.124 46.614 4.807 1 T 5.254e+06 0.00e+00 a 0 0 0 0 0 >> 749 2.917 46.676 4.803 1 T 5.726e+06 0.00e+00 a 0 0 0 0 0 >> 750 2.914 46.582 4.636 1 T 7.728e+05 0.00e+00 a 0 0 0 0 0 >> 751 3.128 46.657 2.164 1 T 4.040e+06 0.00e+00 a 0 0 0 0 0 >> 752 2.920 46.603 2.162 1 T 3.297e+06 0.00e+00 a 0 0 0 0 0 >> 753 2.919 46.650 3.133 1 T 2.551e+07 0.00e+00 a 0 0 0 0 0 >> 754 3.124 46.536 2.924 1 T 2.557e+07 0.00e+00 a 0 0 0 0 0 >> 755 4.124 60.267 0.848 1 T 1.315e+07 0.00e+00 a 0 0 0 0 0 >> 756 4.126 60.241 1.088 1 T 6.350e+06 0.00e+00 a 0 0 0 0 0 >> 757 4.125 60.469 1.717 1 T 2.161e+06 0.00e+00 a 0 0 0 0 0 >> 758 4.125 60.228 1.508 1 T 8.967e+06 0.00e+00 a 0 0 0 0 0 >> 759 4.126 60.387 2.465 1 T 8.321e+05 0.00e+00 a 0 0 0 0 0 >> 760 1.535 39.464 0.827 1 T 1.031e+07 0.00e+00 a 0 0 0 0 0 >> 761 1.534 39.480 1.121 1 T 3.287e+06 0.00e+00 a 0 0 0 0 0 >> 762 1.535 39.519 2.766 1 T 7.408e+06 0.00e+00 a 0 0 0 0 0 >> 763 1.535 39.464 2.536 1 T 2.225e+06 0.00e+00 a 0 0 0 0 0 >> 764 1.535 39.468 4.129 1 T 2.809e+06 0.00e+00 a 0 0 0 0 0 >> 765 1.533 39.473 4.651 1 T 6.048e+05 0.00e+00 a 0 0 0 0 0 >> 766 4.125 60.215 8.910 1 T 6.391e+06 0.00e+00 a 0 0 0 0 0 >> 767 4.125 60.265 8.392 1 T 3.012e+07 0.00e+00 a 0 0 0 0 0 >> 768 1.534 39.466 8.904 1 T 8.658e+06 0.00e+00 a 0 0 0 0 0 >> 769 1.531 39.494 8.401 1 T 8.290e+05 0.00e+00 a 0 0 0 0 0 >> 770 0.768 13.315 8.406 1 T 7.311e+05 0.00e+00 a 0 0 0 0 0 >> 771 0.770 13.029 8.901 1 T 1.278e+06 0.00e+00 a 0 0 0 0 0 >> 772 1.099 26.723 8.897 1 T 1.686e+06 0.00e+00 a 0 0 0 0 0 >> 773 1.493 26.709 8.906 1 T 2.318e+06 0.00e+00 a 0 0 0 0 0 >> 774 0.855 18.177 8.901 1 T 1.743e+06 0.00e+00 a 0 0 0 0 0 >> 775 0.851 18.183 8.412 1 T 3.068e+06 0.00e+00 a 0 0 0 0 0 >> 776 0.772 13.029 4.134 1 T 1.623e+06 0.00e+00 a 0 0 0 0 0 >> 777 1.100 26.724 4.127 1 T 2.398e+06 0.00e+00 a 0 0 0 0 0 >> 778 1.497 26.736 4.135 1 T 1.332e+06 0.00e+00 a 0 0 0 0 0 >> 780 0.853 18.202 4.131 1 T 6.521e+06 0.00e+00 a 0 0 0 0 0 >> 782 1.497 26.744 1.111 1 T 1.310e+07 0.00e+00 a 0 0 0 0 0 >> 783 1.495 26.781 0.781 1 T 4.407e+06 0.00e+00 a 0 0 0 0 0 >> 784 1.096 26.687 0.809 1 T 5.035e+06 0.00e+00 a 0 0 0 0 0 >> 785 1.099 26.637 1.501 1 T 1.924e+07 0.00e+00 a 0 0 0 0 0 >> 786 1.093 26.683 2.465 1 T 6.399e+05 0.00e+00 a 0 0 0 0 0 >> 787 1.494 26.731 2.441 1 T 9.788e+05 0.00e+00 a 0 0 0 0 0 >> 788 0.854 18.189 2.739 1 T 1.151e+06 0.00e+00 a 0 0 0 0 0 >> 789 0.853 18.261 2.469 1 T 1.740e+06 0.00e+00 a 0 0 0 0 0 >> 790 0.852 18.274 2.233 1 T 1.563e+06 0.00e+00 a 0 0 0 0 0 >> 796 0.853 18.166 1.783 1 T 2.260e+06 0.00e+00 a 0 0 0 0 0 >> 797 0.854 18.166 1.992 1 T 9.091e+05 0.00e+00 a 0 0 0 0 0 >> 798 0.855 18.314 1.552 1 T 1.433e+07 0.00e+00 a 0 0 0 0 0 >> 799 0.768 13.198 1.522 1 T 1.231e+07 0.00e+00 a 0 0 0 0 0 >> 800 0.770 13.178 2.481 1 T 1.920e+06 0.00e+00 a 0 0 0 0 0 >> 801 0.770 13.029 2.719 1 T 1.160e+06 0.00e+00 a 0 0 0 0 0 >> 802 4.650 54.460 2.466 1 T 1.589e+06 0.00e+00 a 0 0 0 0 0 >> 803 2.461 42.250 4.652 1 T 5.507e+06 0.00e+00 a 0 0 0 0 0 >> 804 2.461 42.229 1.633 1 T 3.415e+06 0.00e+00 a 0 0 0 0 0 >> 805 2.462 42.209 1.313 1 T 1.546e+06 0.00e+00 a 0 0 0 0 0 >> 806 2.459 42.148 1.418 1 T 9.488e+05 0.00e+00 a 0 0 0 0 0 >> 807 3.800 43.310 8.594 1 T 1.060e+06 0.00e+00 a 0 0 0 0 0 >> 809 4.649 56.591 8.033 1 T 1.652e+06 0.00e+00 a 0 0 0 0 0 >> 810 1.758 33.332 8.013 1 T 1.315e+06 0.00e+00 a 0 0 0 0 0 >> 811 1.696 33.217 8.022 1 T 1.088e+06 0.00e+00 a 0 0 0 0 0 >> 812 1.760 33.157 4.648 1 T 1.441e+06 0.00e+00 a 0 0 0 0 0 >> 813 1.696 33.157 4.655 1 T 1.772e+06 0.00e+00 a 0 0 0 0 0 >> 814 4.650 56.476 1.702 1 T 7.865e+05 0.00e+00 a 0 0 0 0 0 >> 815 4.650 56.476 1.760 1 T 1.206e+06 0.00e+00 a 0 0 0 0 0 >> 816 1.758 33.157 8.390 1 T 4.414e+06 0.00e+00 a 0 0 0 0 0 >> 817 1.698 33.157 8.383 1 T 2.966e+06 0.00e+00 a 0 0 0 0 0 >> 818 1.759 33.157 4.132 1 T 5.886e+05 0.00e+00 a 0 0 0 0 0 >> 819 1.761 33.157 4.312 1 T 6.074e+05 0.00e+00 a 0 0 0 0 0 >> 820 1.694 33.157 4.137 1 T 5.270e+05 0.00e+00 a 0 0 0 0 0 >> 821 1.539 29.581 5.307 1 T 5.287e+05 0.00e+00 a 0 0 0 0 0 >> 822 2.321 34.053 7.352 1 T 6.059e+05 0.00e+00 a 0 0 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-aliphatic . . 13.89 ppm . . . 4.708 . . 30538 3 >> 2 . . C 13 C-aliphatic . . 32 ppm . . . 116 . . 30538 3 >> 3 . . H 1 H . . 13.89 ppm . . . 4.708 . . 30538 3 >> >> stop_ >> >>save_ >> ; save_