data_16668 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; GTPase RhoA-GDP ; _BMRB_accession_number 16668 _BMRB_flat_file_name bmr16668.str _Entry_type original _Submission_date 2010-01-07 _Accession_date 2010-01-07 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'RhoA-GDP chemical shifts assignments' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Gasmi-Seabrook Genevieve . . 2 Ikura Mitsu . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 270 "13C chemical shifts" 479 "15N chemical shifts" 152 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-03-01 update BMRB 'completed entry citation' 2010-02-16 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 16669 RhoA-GTPgS stop_ save_ ############################# # Citation for this entry # ############################# save_RhoA-GDP _Saveframe_category entry_citation _Citation_full . _Citation_title 'Real-time NMR study of guanine nucleotide exchange and activation of RhoA by PDZ-RhoGEF.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 20018869 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Gasmi-Seabrook Genevieve M.C. . 2 Marshall Christopher B. . 3 Cheung Melissa . . 4 Kim Bryan . . 5 Wang Feng . . 6 Jang 'Ying Ju' . . 7 Mak Tak W. . 8 Stambolic Vuk . . 9 Ikura Mitsuhiko . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_name_full 'The Journal of biological chemistry' _Journal_volume 285 _Journal_issue 8 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 5137 _Page_last 5145 _Year 2010 _Details . loop_ _Keyword GTPases NMR RhoA stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'RhoA-GDP monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label protein $GTPase_RhoA nucleotide $GDP stop_ _System_molecular_weight 20.400 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function GTPase stop_ _Database_query_date . _Details 'RhoA GDP-bound form' save_ ######################## # Monomeric polymers # ######################## save_GTPase_RhoA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common GTPase_RhoA _Molecular_mass . _Mol_thiol_state 'all free' loop_ _Biological_function GTPase stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 181 _Mol_residue_sequence ; MAAIRKKLVIVGDGACGKTC LLIVFSKDQFPEVYVPTVFE NYVADIEVDGKQVELALWDT AGQEDYDRLRPLSYPDTDVI LMCFSIDSPDSLENIPEKWT PEVKHFCPNVPIILVGNKKD LRNDEHTRRELAKMKQEPVK PEEGRDMANRIGAFGYMECS AKTKDGVREVFEMATRAALQ A ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 ALA 4 ILE 5 ARG 6 LYS 7 LYS 8 LEU 9 VAL 10 ILE 11 VAL 12 GLY 13 ASP 14 GLY 15 ALA 16 CYS 17 GLY 18 LYS 19 THR 20 CYS 21 LEU 22 LEU 23 ILE 24 VAL 25 PHE 26 SER 27 LYS 28 ASP 29 GLN 30 PHE 31 PRO 32 GLU 33 VAL 34 TYR 35 VAL 36 PRO 37 THR 38 VAL 39 PHE 40 GLU 41 ASN 42 TYR 43 VAL 44 ALA 45 ASP 46 ILE 47 GLU 48 VAL 49 ASP 50 GLY 51 LYS 52 GLN 53 VAL 54 GLU 55 LEU 56 ALA 57 LEU 58 TRP 59 ASP 60 THR 61 ALA 62 GLY 63 GLN 64 GLU 65 ASP 66 TYR 67 ASP 68 ARG 69 LEU 70 ARG 71 PRO 72 LEU 73 SER 74 TYR 75 PRO 76 ASP 77 THR 78 ASP 79 VAL 80 ILE 81 LEU 82 MET 83 CYS 84 PHE 85 SER 86 ILE 87 ASP 88 SER 89 PRO 90 ASP 91 SER 92 LEU 93 GLU 94 ASN 95 ILE 96 PRO 97 GLU 98 LYS 99 TRP 100 THR 101 PRO 102 GLU 103 VAL 104 LYS 105 HIS 106 PHE 107 CYS 108 PRO 109 ASN 110 VAL 111 PRO 112 ILE 113 ILE 114 LEU 115 VAL 116 GLY 117 ASN 118 LYS 119 LYS 120 ASP 121 LEU 122 ARG 123 ASN 124 ASP 125 GLU 126 HIS 127 THR 128 ARG 129 ARG 130 GLU 131 LEU 132 ALA 133 LYS 134 MET 135 LYS 136 GLN 137 GLU 138 PRO 139 VAL 140 LYS 141 PRO 142 GLU 143 GLU 144 GLY 145 ARG 146 ASP 147 MET 148 ALA 149 ASN 150 ARG 151 ILE 152 GLY 153 ALA 154 PHE 155 GLY 156 TYR 157 MET 158 GLU 159 CYS 160 SER 161 ALA 162 LYS 163 THR 164 LYS 165 ASP 166 GLY 167 VAL 168 ARG 169 GLU 170 VAL 171 PHE 172 GLU 173 MET 174 ALA 175 THR 176 ARG 177 ALA 178 ALA 179 LEU 180 GLN 181 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-29 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 16669 GTPase_RhoA 100.00 181 100.00 100.00 2.02e-130 PDB 1A2B "Human Rhoa Complexed With Gtp Analogue" 100.00 182 99.45 99.45 2.76e-129 PDB 1CC0 "Crystal Structure Of The Rhoa.Gdp-Rhogdi Complex" 100.00 190 99.45 99.45 6.72e-129 PDB 1CXZ "Crystal Structure Of Human Rhoa Complexed With The Effector Domain Of The Protein Kinase PknPRK1" 100.00 182 99.45 99.45 2.76e-129 PDB 1DPF "Crystal Structure Of A Mg-Free Form Of Rhoa Complexed With Gdp" 99.45 180 97.22 97.22 3.88e-125 PDB 1FTN "Crystal Structure Of The Human RhoaGDP COMPLEX" 100.00 193 99.45 99.45 4.42e-129 PDB 1KMQ "Crystal Structure Of A Constitutively Activated Rhoa Mutant (Q63l)" 99.45 184 97.78 98.33 1.30e-125 PDB 1LB1 "Crystal Structure Of The Dbl And Pleckstrin Homology Domains Of Dbs In Complex With Rhoa" 100.00 192 100.00 100.00 1.42e-130 PDB 1OW3 "Crystal Structure Of Rhoa.gdp.mgf3-in Complex With Rhogap" 100.00 193 99.45 99.45 4.42e-129 PDB 1S1C "Crystal Structure Of The Complex Between The Human Rhoa And Rho-Binding Domain Of Human Rocki" 100.00 183 100.00 100.00 1.61e-130 PDB 1TX4 "RhoRHOGAPGDP(DOT)ALF4 COMPLEX" 97.79 177 99.44 99.44 5.88e-126 PDB 1X86 "Crystal Structure Of The DhPH DOMAINS OF LEUKEMIA-Associated Rhogef In Complex With Rhoa" 100.00 196 100.00 100.00 3.48e-130 PDB 1XCG "Crystal Structure Of Human Rhoa In Complex With DhPH Fragment Of Pdzrhogef" 98.34 178 99.44 99.44 7.63e-127 PDB 2RGN "Crystal Structure Of P63rhogef Complex With Galpha-Q And Rhoa" 100.00 196 100.00 100.00 3.48e-130 PDB 3KZ1 "Crystal Structure Of The Complex Of Pdz-Rhogef DhPH DOMAINS WITH GTP- Gamma-S Activated Rhoa" 100.00 182 100.00 100.00 2.60e-130 PDB 3LW8 "Shigella Ipgb2 In Complex With Human Rhoa, Gdp And Mg2+ (Complex A)" 99.45 185 100.00 100.00 2.21e-129 PDB 3LWN "Shigella Ipgb2 In Complex With Human Rhoa, Gdp And Mg2+ (Complex B)" 99.45 185 100.00 100.00 2.21e-129 PDB 3LXR "Shigella Ipgb2 In Complex With Human Rhoa And Gdp (Complex C)" 99.45 185 100.00 100.00 2.21e-129 PDB 3MSX "Crystal Structure Of Rhoa.Gdp.Mgf3 In Complex With Gap Domain Of Arhgap20" 99.45 180 99.44 99.44 2.53e-128 PDB 3T06 "Crystal Structure Of The DhPH FRAGMENT OF PDZRHOGEF WITH N-Terminal Regulatory Elements In Complex With Human Rhoa" 98.34 178 99.44 99.44 7.63e-127 PDB 3TVD "Crystal Structure Of Mouse Rhoa-gtp Complex" 100.00 193 100.00 100.00 2.52e-130 PDB 4D0N "Akap13 (akap-lbc) Rhogef Domain In Complex With Rhoa" 100.00 185 100.00 100.00 1.90e-130 PDB 4F38 "Crystal Structure Of Geranylgeranylated Rhoa In Complex With Rhogdi In Its Active Gppnhp-Bound Form" 100.00 195 100.00 100.00 2.67e-130 PDB 4XH9 "Crystal Structure Of Human Rhoa In Complex With Dh/ph Fragment Of The Guanine Nucleotide Exchange Factor Net1" 98.90 180 99.44 99.44 2.28e-127 PDB 4XOI "Structure Of Hsanillin Bound With Rhoa(q63l) At 2.1 Angstroms Resolution" 99.45 180 98.89 98.89 3.52e-127 PDB 4XSG "The Complex Structure Of C3cer Exoenzyme And Gtp Bound Rhoa (nadh-free State)" 98.90 179 99.44 99.44 2.04e-127 PDB 4XSH "The Complex Structure Of C3cer Exoenzyme And Gtp Bound Rhoa (nadh- Bound State)" 98.90 179 99.44 99.44 2.04e-127 PDB 5A0F "Crystal Structure Of Yersinia Afp18-modified Rhoa" 100.00 181 100.00 100.00 2.02e-130 PDB 5BWM "The Complex Structure Of C3cer Exoenzyme And Gdp Bound Rhoa (nadh- Bound State)" 98.90 179 99.44 99.44 2.04e-127 DBJ BAA20863 "RhoA [Rattus norvegicus]" 94.48 174 100.00 100.00 4.04e-123 DBJ BAC36896 "unnamed protein product [Mus musculus]" 100.00 193 100.00 100.00 2.52e-130 DBJ BAC38971 "unnamed protein product [Mus musculus]" 100.00 193 100.00 100.00 2.52e-130 DBJ BAC99017 "Raichu-1237X [synthetic construct]" 100.00 777 100.00 100.00 1.49e-124 DBJ BAD96276 "ras homolog gene family, member A variant [Homo sapiens]" 100.00 193 99.45 99.45 9.77e-130 EMBL CAA28690 "unnamed protein product [Homo sapiens]" 100.00 193 100.00 100.00 2.26e-130 EMBL CAA39802 "rho1 [Canis lupus familiaris]" 100.00 193 99.45 99.45 1.53e-129 EMBL CAC08447 "RhoA GTPase [Gallus gallus]" 100.00 193 100.00 100.00 2.44e-130 EMBL CAC28868 "rho GTPase, partial [Platichthys flesus]" 70.17 127 98.43 100.00 8.52e-87 EMBL CAE46190 "hypothetical protein [Homo sapiens]" 100.00 193 100.00 100.00 2.26e-130 GB AAA30409 "rho (Gb) protein [Bos taurus]" 100.00 193 100.00 100.00 2.26e-130 GB AAA50612 "multidrug resistance protein, partial [Homo sapiens]" 97.79 189 100.00 100.00 3.08e-127 GB AAC18962 "GTPase cRhoA [Gallus gallus]" 100.00 193 100.00 100.00 2.44e-130 GB AAC23710 "Rho family GTPase [Mus musculus]" 100.00 193 99.45 99.45 9.50e-129 GB AAC33178 "GTP-binding protein [Homo sapiens]" 100.00 193 100.00 100.00 2.26e-130 REF NP_001003273 "transforming protein RhoA precursor [Canis lupus familiaris]" 100.00 193 100.00 100.00 2.26e-130 REF NP_001025020 "rho-related GTP-binding protein RhoC precursor [Gallus gallus]" 99.45 193 97.22 98.89 1.91e-126 REF NP_001038815 "transforming protein RhoA [Danio rerio]" 100.00 193 97.79 98.34 6.60e-127 REF NP_001079729 "ras homolog family member A [Xenopus laevis]" 100.00 193 97.79 98.90 4.79e-128 REF NP_001080441 "ras homolog family member A [Xenopus laevis]" 100.00 193 97.24 98.34 4.13e-127 SP P24406 "RecName: Full=Transforming protein RhoA; AltName: Full=Rho1; Flags: Precursor" 100.00 193 99.45 99.45 1.53e-129 SP P61585 "RecName: Full=Transforming protein RhoA; AltName: Full=Gb; AltName: Full=p21; Flags: Precursor" 100.00 193 100.00 100.00 2.26e-130 SP P61586 "RecName: Full=Transforming protein RhoA; AltName: Full=Rho cDNA clone 12; Short=h12; Flags: Precursor" 100.00 193 100.00 100.00 2.26e-130 SP P61589 "RecName: Full=Transforming protein RhoA; Flags: Precursor" 100.00 193 100.00 100.00 2.52e-130 SP Q5REY6 "RecName: Full=Transforming protein RhoA; Flags: Precursor" 100.00 193 100.00 100.00 2.26e-130 TPG DAA16889 "TPA: transforming protein RhoA precursor [Bos taurus]" 100.00 193 100.00 100.00 2.26e-130 stop_ save_ save_GDP _Saveframe_category monomeric_polymer _Mol_type polymer _Name_common GDP _Molecular_mass . _Mol_thiol_state . _Details . _Residue_count . _Mol_residue_sequence . loop_ _Residue_seq_code _Residue_label 1 GDP stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ###################### # Polymer residues # ###################### save_chem_comp_GDP _Saveframe_category polymer_residue _Mol_type 'RNA LINKING' _Name_common GUANOSINE-5'-DIPHOSPHATE _BMRB_code . _PDB_code GDP _Standard_residue_derivative . _Molecular_mass 443.201 _Mol_paramagnetic . _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Nov 18 15:00:07 2011 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons PB PB P . 0 . ? O1B O1B O . 0 . ? O2B O2B O . 0 . ? O3B O3B O . 0 . ? O3A O3A O . 0 . ? PA PA P . 0 . ? O1A O1A O . 0 . ? O2A O2A O . 0 . ? O5' O5' O . 0 . ? C5' C5' C . 0 . ? C4' C4' C . 0 . ? O4' O4' O . 0 . ? C3' C3' C . 0 . ? O3' O3' O . 0 . ? C2' C2' C . 0 . ? O2' O2' O . 0 . ? C1' C1' C . 0 . ? N9 N9 N . 0 . ? C8 C8 C . 0 . ? N7 N7 N . 0 . ? C5 C5 C . 0 . ? C6 C6 C . 0 . ? O6 O6 O . 0 . ? N1 N1 N . 0 . ? C2 C2 C . 0 . ? N2 N2 N . 0 . ? N3 N3 N . 0 . ? C4 C4 C . 0 . ? HOB2 HOB2 H . 0 . ? HOB3 HOB3 H . 0 . ? HOA2 HOA2 H . 0 . ? H5' H5' H . 0 . ? H5'' H5'' H . 0 . ? H4' H4' H . 0 . ? H3' H3' H . 0 . ? HO3' HO3' H . 0 . ? H2' H2' H . 0 . ? HO2' HO2' H . 0 . ? H1' H1' H . 0 . ? H8 H8 H . 0 . ? HN1 HN1 H . 0 . ? HN21 HN21 H . 0 . ? HN22 HN22 H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name DOUB PB O1B ? ? SING PB O2B ? ? SING PB O3B ? ? SING PB O3A ? ? SING O2B HOB2 ? ? SING O3B HOB3 ? ? SING O3A PA ? ? DOUB PA O1A ? ? SING PA O2A ? ? SING PA O5' ? ? SING O2A HOA2 ? ? SING O5' C5' ? ? SING C5' C4' ? ? SING C5' H5' ? ? SING C5' H5'' ? ? SING C4' O4' ? ? SING C4' C3' ? ? SING C4' H4' ? ? SING O4' C1' ? ? SING C3' O3' ? ? SING C3' C2' ? ? SING C3' H3' ? ? SING O3' HO3' ? ? SING C2' O2' ? ? SING C2' C1' ? ? SING C2' H2' ? ? SING O2' HO2' ? ? SING C1' N9 ? ? SING C1' H1' ? ? SING N9 C8 ? ? SING N9 C4 ? ? DOUB C8 N7 ? ? SING C8 H8 ? ? SING N7 C5 ? ? SING C5 C6 ? ? DOUB C5 C4 ? ? DOUB C6 O6 ? ? SING C6 N1 ? ? SING N1 C2 ? ? SING N1 HN1 ? ? SING C2 N2 ? ? DOUB C2 N3 ? ? SING N2 HN21 ? ? SING N2 HN22 ? ? SING N3 C4 ? ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $GTPase_RhoA Human 9606 Eukaryota Metazoa Homo sapiens 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 $GTPase_RhoA 'purified from the natural source' . Escherichia coli . pET28A stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $GTPase_RhoA 0.3 mM '[U-100% 13C; U-100% 15N]' D2O 10 % 'natural abundance' H2O 90 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_NMRDraw _Saveframe_category software _Name NMRDraw _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _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_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HN(CA)CO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $sample_1 save_ save_3D_HNHA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _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 'ionic strength' 100 . mM pH 7.0 . pH pressure 1 . atm temperature 293 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 $RhoA-GDP $RhoA-GDP DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 $RhoA-GDP $RhoA-GDP DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 $RhoA-GDP $RhoA-GDP stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $NMRView $NMRPipe $NMRDraw stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCACB' '3D HNCO' '3D HN(CA)CO' '3D HNHA' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name protein _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 MET H H 8.340 . 1 2 1 1 MET HA H 4.410 . 1 3 1 1 MET C C 175.360 . 1 4 1 1 MET CA C 55.700 . 1 5 1 1 MET CB C 33.170 . 1 6 1 1 MET N N 122.240 . 1 7 2 2 ALA H H 8.360 . 1 8 2 2 ALA C C 177.040 . 1 9 2 2 ALA CA C 52.130 . 1 10 2 2 ALA CB C 19.300 . 1 11 2 2 ALA N N 125.330 . 1 12 3 3 ALA H H 8.240 . 1 13 3 3 ALA HA H 4.330 . 1 14 3 3 ALA C C 177.450 . 1 15 3 3 ALA CA C 52.060 . 1 16 3 3 ALA CB C 19.700 . 1 17 3 3 ALA N N 123.510 . 1 18 4 4 ILE H H 8.230 . 1 19 4 4 ILE HA H 4.080 . 1 20 4 4 ILE C C 174.270 . 1 21 4 4 ILE CA C 60.850 . 1 22 4 4 ILE CB C 39.840 . 1 23 4 4 ILE N N 122.240 . 1 24 5 5 ARG H H 8.570 . 1 25 5 5 ARG HA H 5.410 . 1 26 5 5 ARG C C 176.200 . 1 27 5 5 ARG CA C 54.940 . 1 28 5 5 ARG CB C 31.440 . 1 29 5 5 ARG N N 128.250 . 1 30 6 6 LYS H H 8.800 . 1 31 6 6 LYS HA H 5.050 . 1 32 6 6 LYS C C 173.750 . 1 33 6 6 LYS CA C 52.150 . 1 34 6 6 LYS CB C 36.690 . 1 35 6 6 LYS N N 123.700 . 1 36 7 7 LYS H H 10.580 . 1 37 7 7 LYS HA H 4.990 . 1 38 7 7 LYS C C 173.800 . 1 39 7 7 LYS CA C 55.860 . 1 40 7 7 LYS CB C 34.410 . 1 41 7 7 LYS N N 125.120 . 1 42 8 8 LEU H H 9.450 . 1 43 8 8 LEU HA H 5.450 . 1 44 8 8 LEU C C 174.240 . 1 45 8 8 LEU CA C 53.730 . 1 46 8 8 LEU CB C 45.960 . 1 47 8 8 LEU N N 133.770 . 1 48 9 9 VAL H H 8.010 . 1 49 9 9 VAL HA H 5.200 . 1 50 9 9 VAL C C 173.600 . 1 51 9 9 VAL CA C 60.500 . 1 52 9 9 VAL CB C 35.310 . 1 53 9 9 VAL N N 125.880 . 1 54 10 10 ILE H H 8.150 . 1 55 10 10 ILE HA H 5.430 . 1 56 10 10 ILE C C 172.620 . 1 57 10 10 ILE CA C 57.350 . 1 58 10 10 ILE CB C 42.550 . 1 59 10 10 ILE N N 126.960 . 1 60 11 11 VAL H H 8.640 . 1 61 11 11 VAL C C 173.500 . 1 62 11 11 VAL CA C 58.220 . 1 63 11 11 VAL N N 116.920 . 1 64 12 12 GLY H H 6.380 . 1 65 12 12 GLY C C 173.010 . 1 66 12 12 GLY CA C 43.100 . 1 67 12 12 GLY N N 106.480 . 1 68 13 13 ASP H H 8.770 . 1 69 13 13 ASP C C 177.690 . 1 70 13 13 ASP CA C 56.410 . 1 71 13 13 ASP N N 121.500 . 1 72 14 14 GLY H H 8.860 . 1 73 14 14 GLY HA2 H 4.370 . 2 74 14 14 GLY HA3 H 4.370 . 2 75 14 14 GLY C C 173.980 . 1 76 14 14 GLY CA C 47.200 . 1 77 14 14 GLY N N 107.400 . 1 78 15 15 ALA H H 10.340 . 1 79 15 15 ALA C C 176.040 . 1 80 15 15 ALA N N 124.350 . 1 81 16 16 CYS H H 7.900 . 1 82 16 16 CYS HA H 4.830 . 1 83 16 16 CYS C C 175.150 . 1 84 16 16 CYS CA C 53.820 . 1 85 16 16 CYS CB C 28.330 . 1 86 16 16 CYS N N 115.590 . 1 87 17 17 GLY H H 8.310 . 1 88 17 17 GLY C C 176.860 . 1 89 17 17 GLY CA C 45.050 . 1 90 17 17 GLY N N 110.170 . 1 91 19 19 THR C C 177.550 . 1 92 20 20 CYS H H 8.740 . 1 93 20 20 CYS C C 179.260 . 1 94 20 20 CYS CA C 67.400 . 1 95 20 20 CYS CB C 31.160 . 1 96 20 20 CYS N N 121.160 . 1 97 21 21 LEU H H 8.090 . 1 98 21 21 LEU C C 176.250 . 1 99 21 21 LEU CA C 60.230 . 1 100 21 21 LEU CB C 39.800 . 1 101 21 21 LEU N N 120.540 . 1 102 22 22 LEU H H 7.780 . 1 103 22 22 LEU C C 174.380 . 1 104 22 22 LEU CA C 61.690 . 1 105 22 22 LEU CB C 38.790 . 1 106 22 22 LEU N N 112.440 . 1 107 24 24 VAL CA C 63.180 . 1 108 24 24 VAL CB C 32.630 . 1 109 25 25 PHE H H 8.310 . 1 110 25 25 PHE HA H 4.770 . 1 111 25 25 PHE CA C 55.050 . 1 112 25 25 PHE CB C 43.140 . 1 113 25 25 PHE N N 119.960 . 1 114 26 26 SER C C 175.460 . 1 115 26 26 SER CA C 62.140 . 1 116 26 26 SER CB C 63.640 . 1 117 27 27 LYS H H 8.750 . 1 118 27 27 LYS HA H 4.390 . 1 119 27 27 LYS C C 176.720 . 1 120 27 27 LYS CA C 55.270 . 1 121 27 27 LYS CB C 32.900 . 1 122 27 27 LYS N N 116.970 . 1 123 28 28 ASP H H 7.960 . 1 124 28 28 ASP HA H 4.620 . 1 125 28 28 ASP C C 174.630 . 1 126 28 28 ASP CA C 55.610 . 1 127 28 28 ASP CB C 40.670 . 1 128 28 28 ASP N N 118.110 . 1 129 29 29 GLN H H 6.540 . 1 130 29 29 GLN HA H 4.460 . 1 131 29 29 GLN C C 173.650 . 1 132 29 29 GLN CA C 54.620 . 1 133 29 29 GLN CB C 32.010 . 1 134 29 29 GLN N N 113.400 . 1 135 30 30 PHE H H 9.110 . 1 136 30 30 PHE HA H 4.370 . 1 137 30 30 PHE CA C 54.880 . 1 138 30 30 PHE CB C 39.330 . 1 139 30 30 PHE N N 129.030 . 1 140 32 32 GLU C C 176.980 . 1 141 32 32 GLU CA C 57.270 . 1 142 32 32 GLU CB C 31.650 . 1 143 33 33 VAL H H 7.970 . 1 144 33 33 VAL HA H 3.950 . 1 145 33 33 VAL C C 175.240 . 1 146 33 33 VAL CA C 63.720 . 1 147 33 33 VAL CB C 33.100 . 1 148 33 33 VAL N N 116.810 . 1 149 34 34 TYR H H 7.910 . 1 150 34 34 TYR HA H 4.470 . 1 151 34 34 TYR C C 173.340 . 1 152 34 34 TYR CA C 57.690 . 1 153 34 34 TYR CB C 39.470 . 1 154 34 34 TYR N N 120.400 . 1 155 35 35 VAL H H 7.880 . 1 156 35 35 VAL HA H 4.050 . 1 157 35 35 VAL C C 173.450 . 1 158 35 35 VAL CA C 58.220 . 1 159 35 35 VAL CB C 33.900 . 1 160 35 35 VAL N N 127.320 . 1 161 36 36 PRO C C 176.350 . 1 162 36 36 PRO CA C 61.890 . 1 163 36 36 PRO CB C 31.980 . 1 164 37 37 THR H H 8.520 . 1 165 37 37 THR C C 176.950 . 1 166 37 37 THR CA C 60.780 . 1 167 37 37 THR CB C 69.230 . 1 168 37 37 THR N N 118.510 . 1 169 38 38 VAL H H 9.120 . 1 170 38 38 VAL HA H 4.020 . 1 171 38 38 VAL N N 119.290 . 1 172 39 39 PHE C C 174.940 . 1 173 39 39 PHE CA C 55.390 . 1 174 39 39 PHE CB C 40.300 . 1 175 40 40 GLU H H 7.700 . 1 176 40 40 GLU C C 174.410 . 1 177 40 40 GLU CA C 55.810 . 1 178 40 40 GLU CB C 30.560 . 1 179 40 40 GLU N N 125.910 . 1 180 41 41 ASN C C 174.220 . 1 181 41 41 ASN CA C 54.800 . 1 182 41 41 ASN CB C 37.550 . 1 183 42 42 TYR H H 7.770 . 1 184 42 42 TYR HA H 4.390 . 1 185 42 42 TYR C C 173.500 . 1 186 42 42 TYR CA C 57.890 . 1 187 42 42 TYR CB C 43.220 . 1 188 42 42 TYR N N 125.290 . 1 189 43 43 VAL H H 7.520 . 1 190 43 43 VAL HA H 4.630 . 1 191 43 43 VAL C C 173.800 . 1 192 43 43 VAL CA C 61.170 . 1 193 43 43 VAL CB C 32.700 . 1 194 43 43 VAL N N 126.680 . 1 195 44 44 ALA H H 8.990 . 1 196 44 44 ALA HA H 4.680 . 1 197 44 44 ALA C C 175.370 . 1 198 44 44 ALA CA C 50.180 . 1 199 44 44 ALA CB C 22.520 . 1 200 44 44 ALA N N 130.910 . 1 201 45 45 ASP H H 8.310 . 1 202 45 45 ASP HA H 5.320 . 1 203 45 45 ASP C C 175.290 . 1 204 45 45 ASP CA C 53.800 . 1 205 45 45 ASP CB C 42.210 . 1 206 45 45 ASP N N 121.210 . 1 207 46 46 ILE H H 9.080 . 1 208 46 46 ILE HA H 4.530 . 1 209 46 46 ILE C C 171.200 . 1 210 46 46 ILE CA C 60.650 . 1 211 46 46 ILE CB C 42.350 . 1 212 46 46 ILE N N 122.770 . 1 213 47 47 GLU H H 8.170 . 1 214 47 47 GLU HA H 5.640 . 1 215 47 47 GLU C C 176.010 . 1 216 47 47 GLU CA C 54.470 . 1 217 47 47 GLU CB C 31.830 . 1 218 47 47 GLU N N 127.110 . 1 219 48 48 VAL H H 8.520 . 1 220 48 48 VAL HA H 4.370 . 1 221 48 48 VAL C C 174.460 . 1 222 48 48 VAL CA C 60.500 . 1 223 48 48 VAL CB C 35.580 . 1 224 48 48 VAL N N 123.590 . 1 225 49 49 ASP H H 9.280 . 1 226 49 49 ASP HA H 4.290 . 1 227 49 49 ASP C C 175.930 . 1 228 49 49 ASP CA C 55.480 . 1 229 49 49 ASP CB C 39.170 . 1 230 49 49 ASP N N 125.300 . 1 231 50 50 GLY H H 8.800 . 1 232 50 50 GLY HA2 H 4.110 . 2 233 50 50 GLY HA3 H 3.590 . 2 234 50 50 GLY C C 174.060 . 1 235 50 50 GLY CA C 45.450 . 1 236 50 50 GLY N N 103.760 . 1 237 51 51 LYS H H 8.170 . 1 238 51 51 LYS C C 174.500 . 1 239 51 51 LYS CA C 54.780 . 1 240 51 51 LYS CB C 33.680 . 1 241 51 51 LYS N N 121.770 . 1 242 52 52 GLN H H 8.280 . 1 243 52 52 GLN HA H 4.560 . 1 244 52 52 GLN C C 174.990 . 1 245 52 52 GLN CA C 55.630 . 1 246 52 52 GLN CB C 28.730 . 1 247 52 52 GLN N N 122.270 . 1 248 53 53 VAL H H 9.140 . 1 249 53 53 VAL HA H 4.830 . 1 250 53 53 VAL C C 175.070 . 1 251 53 53 VAL CA C 60.620 . 1 252 53 53 VAL CB C 35.320 . 1 253 53 53 VAL N N 126.780 . 1 254 54 54 GLU H H 8.930 . 1 255 54 54 GLU HA H 4.810 . 1 256 54 54 GLU C C 174.340 . 1 257 54 54 GLU CA C 54.470 . 1 258 54 54 GLU CB C 31.160 . 1 259 54 54 GLU N N 127.360 . 1 260 55 55 LEU H H 9.350 . 1 261 55 55 LEU HA H 5.040 . 1 262 55 55 LEU C C 174.450 . 1 263 55 55 LEU CA C 52.640 . 1 264 55 55 LEU CB C 44.910 . 1 265 55 55 LEU N N 128.240 . 1 266 56 56 ALA H H 9.400 . 1 267 56 56 ALA HA H 4.840 . 1 268 56 56 ALA C C 176.150 . 1 269 56 56 ALA CA C 51.730 . 1 270 56 56 ALA CB C 20.320 . 1 271 56 56 ALA N N 130.040 . 1 272 57 57 LEU H H 8.960 . 1 273 57 57 LEU C C 176.530 . 1 274 57 57 LEU CA C 54.940 . 1 275 57 57 LEU CB C 42.680 . 1 276 57 57 LEU N N 123.630 . 1 277 58 58 TRP H H 9.180 . 1 278 58 58 TRP C C 173.480 . 1 279 58 58 TRP CA C 56.940 . 1 280 58 58 TRP CB C 28.730 . 1 281 58 58 TRP N N 127.250 . 1 282 59 59 ASP H H 8.830 . 1 283 59 59 ASP C C 177.010 . 1 284 59 59 ASP CA C 52.150 . 1 285 59 59 ASP CB C 42.650 . 1 286 59 59 ASP N N 124.110 . 1 287 60 60 THR H H 8.550 . 1 288 60 60 THR HA H 4.600 . 1 289 60 60 THR C C 171.500 . 1 290 60 60 THR CA C 60.390 . 1 291 60 60 THR CB C 73.800 . 1 292 60 60 THR N N 112.340 . 1 293 61 61 ALA H H 8.950 . 1 294 61 61 ALA C C 176.510 . 1 295 61 61 ALA CA C 50.990 . 1 296 61 61 ALA N N 120.360 . 1 297 63 63 GLN CA C 56.130 . 1 298 63 63 GLN CB C 30.510 . 1 299 64 64 GLU H H 9.100 . 1 300 64 64 GLU C C 177.500 . 1 301 64 64 GLU CA C 58.360 . 1 302 64 64 GLU CB C 28.680 . 1 303 64 64 GLU N N 119.380 . 1 304 65 65 ASP H H 8.570 . 1 305 65 65 ASP HA H 4.620 . 1 306 65 65 ASP C C 177.080 . 1 307 65 65 ASP CA C 56.010 . 1 308 65 65 ASP CB C 40.540 . 1 309 65 65 ASP N N 120.410 . 1 310 66 66 TYR H H 8.070 . 1 311 66 66 TYR HA H 4.210 . 1 312 66 66 TYR C C 178.080 . 1 313 66 66 TYR CA C 61.100 . 1 314 66 66 TYR CB C 32.770 . 1 315 66 66 TYR N N 116.590 . 1 316 67 67 ASP H H 7.670 . 1 317 67 67 ASP HA H 4.070 . 1 318 67 67 ASP N N 119.810 . 1 319 71 71 PRO C C 178.410 . 1 320 71 71 PRO CA C 64.790 . 1 321 71 71 PRO CB C 30.980 . 1 322 72 72 LEU H H 7.280 . 1 323 72 72 LEU C C 178.670 . 1 324 72 72 LEU CA C 56.190 . 1 325 72 72 LEU CB C 40.680 . 1 326 72 72 LEU N N 115.390 . 1 327 73 73 SER H H 8.140 . 1 328 73 73 SER HA H 4.200 . 1 329 73 73 SER C C 174.190 . 1 330 73 73 SER CA C 60.540 . 1 331 73 73 SER CB C 63.120 . 1 332 73 73 SER N N 113.870 . 1 333 74 74 TYR H H 6.650 . 1 334 74 74 TYR C C 174.710 . 1 335 74 74 TYR CA C 59.780 . 1 336 74 74 TYR CB C 37.920 . 1 337 74 74 TYR N N 118.650 . 1 338 75 75 PRO C C 175.500 . 1 339 75 75 PRO CA C 65.990 . 1 340 75 75 PRO CB C 30.980 . 1 341 76 76 ASP H H 8.880 . 1 342 76 76 ASP HA H 4.160 . 1 343 76 76 ASP C C 174.610 . 1 344 76 76 ASP CA C 55.740 . 1 345 76 76 ASP CB C 39.530 . 1 346 76 76 ASP N N 117.060 . 1 347 77 77 THR H H 7.400 . 1 348 77 77 THR CA C 66.540 . 1 349 77 77 THR CB C 68.390 . 1 350 77 77 THR N N 116.630 . 1 351 78 78 ASP H H 8.990 . 1 352 78 78 ASP HA H 5.050 . 1 353 78 78 ASP C C 175.060 . 1 354 78 78 ASP CA C 55.880 . 1 355 78 78 ASP CB C 45.090 . 1 356 78 78 ASP N N 122.600 . 1 357 79 79 VAL H H 7.860 . 1 358 79 79 VAL C C 170.300 . 1 359 79 79 VAL CA C 61.190 . 1 360 79 79 VAL CB C 32.680 . 1 361 79 79 VAL N N 116.690 . 1 362 80 80 ILE H H 8.150 . 1 363 80 80 ILE HA H 5.430 . 1 364 80 80 ILE C C 175.660 . 1 365 80 80 ILE CA C 57.540 . 1 366 80 80 ILE CB C 40.970 . 1 367 80 80 ILE N N 126.960 . 1 368 81 81 LEU H H 8.860 . 1 369 81 81 LEU HA H 4.850 . 1 370 81 81 LEU C C 173.240 . 1 371 81 81 LEU CA C 53.190 . 1 372 81 81 LEU CB C 42.240 . 1 373 81 81 LEU N N 126.010 . 1 374 82 82 MET H H 9.130 . 1 375 82 82 MET HA H 4.710 . 1 376 82 82 MET C C 174.070 . 1 377 82 82 MET CA C 56.720 . 1 378 82 82 MET CB C 28.740 . 1 379 82 82 MET N N 127.360 . 1 380 84 84 PHE C C 172.170 . 1 381 84 84 PHE CA C 56.070 . 1 382 84 84 PHE CB C 39.780 . 1 383 85 85 SER H H 9.310 . 1 384 85 85 SER C C 176.310 . 1 385 85 85 SER N N 113.730 . 1 386 86 86 ILE C C 174.970 . 1 387 86 86 ILE CA C 64.310 . 1 388 87 87 ASP H H 8.300 . 1 389 87 87 ASP HA H 4.310 . 1 390 87 87 ASP C C 174.000 . 1 391 87 87 ASP CA C 53.120 . 1 392 87 87 ASP CB C 41.700 . 1 393 87 87 ASP N N 115.090 . 1 394 88 88 SER H H 7.910 . 1 395 88 88 SER HA H 5.180 . 1 396 88 88 SER C C 172.790 . 1 397 88 88 SER CB C 62.870 . 1 398 88 88 SER N N 110.190 . 1 399 89 89 PRO C C 178.820 . 1 400 89 89 PRO CA C 65.750 . 1 401 89 89 PRO CB C 31.830 . 1 402 90 90 ASP H H 9.060 . 1 403 90 90 ASP HA H 4.340 . 1 404 90 90 ASP C C 178.040 . 1 405 90 90 ASP CA C 57.660 . 1 406 90 90 ASP CB C 40.090 . 1 407 90 90 ASP N N 118.700 . 1 408 91 91 SER H H 8.360 . 1 409 91 91 SER HA H 4.970 . 1 410 91 91 SER C C 177.160 . 1 411 91 91 SER CA C 61.130 . 1 412 91 91 SER CB C 63.370 . 1 413 91 91 SER N N 117.730 . 1 414 92 92 LEU H H 7.140 . 1 415 92 92 LEU HA H 4.080 . 1 416 92 92 LEU C C 179.030 . 1 417 92 92 LEU CA C 56.950 . 1 418 92 92 LEU CB C 40.870 . 1 419 92 92 LEU N N 124.510 . 1 420 93 93 GLU H H 7.860 . 1 421 93 93 GLU HA H 3.940 . 1 422 93 93 GLU C C 178.400 . 1 423 93 93 GLU CA C 59.060 . 1 424 93 93 GLU CB C 28.800 . 1 425 93 93 GLU N N 119.920 . 1 426 94 94 ASN H H 7.520 . 1 427 94 94 ASN HA H 5.000 . 1 428 94 94 ASN C C 178.150 . 1 429 94 94 ASN CA C 53.920 . 1 430 94 94 ASN CB C 38.850 . 1 431 94 94 ASN N N 112.980 . 1 432 95 95 ILE H H 8.420 . 1 433 95 95 ILE C C 176.420 . 1 434 95 95 ILE CA C 64.170 . 1 435 95 95 ILE CB C 39.200 . 1 436 95 95 ILE N N 123.700 . 1 437 96 96 PRO C C 176.910 . 1 438 96 96 PRO CA C 65.070 . 1 439 96 96 PRO CB C 30.910 . 1 440 97 97 GLU H H 6.540 . 1 441 97 97 GLU HA H 4.260 . 1 442 97 97 GLU C C 175.670 . 1 443 97 97 GLU CA C 57.710 . 1 444 97 97 GLU CB C 31.250 . 1 445 97 97 GLU N N 115.540 . 1 446 98 98 LYS H H 7.820 . 1 447 98 98 LYS C C 177.730 . 1 448 98 98 LYS CA C 57.440 . 1 449 98 98 LYS CB C 35.150 . 1 450 98 98 LYS N N 116.090 . 1 451 99 99 TRP H H 7.600 . 1 452 99 99 TRP HA H 4.540 . 1 453 99 99 TRP C C 177.750 . 1 454 99 99 TRP CA C 60.230 . 1 455 99 99 TRP CB C 29.640 . 1 456 99 99 TRP N N 120.450 . 1 457 100 100 THR H H 8.960 . 1 458 100 100 THR HA H 4.100 . 1 459 100 100 THR C C 177.460 . 1 460 100 100 THR CA C 66.100 . 1 461 100 100 THR CB C 69.880 . 1 462 100 100 THR N N 115.170 . 1 463 101 101 PRO C C 179.270 . 1 464 101 101 PRO CA C 65.890 . 1 465 101 101 PRO CB C 30.660 . 1 466 102 102 GLU H H 6.930 . 1 467 102 102 GLU HA H 4.300 . 1 468 102 102 GLU C C 178.040 . 1 469 102 102 GLU CA C 60.450 . 1 470 102 102 GLU CB C 30.430 . 1 471 102 102 GLU N N 116.560 . 1 472 103 103 VAL H H 8.590 . 1 473 103 103 VAL HA H 3.460 . 1 474 103 103 VAL C C 177.970 . 1 475 103 103 VAL CA C 66.730 . 1 476 103 103 VAL CB C 31.560 . 1 477 103 103 VAL N N 117.130 . 1 478 104 104 LYS H H 8.690 . 1 479 104 104 LYS HA H 3.780 . 1 480 104 104 LYS C C 177.820 . 1 481 104 104 LYS CA C 58.160 . 1 482 104 104 LYS CB C 31.420 . 1 483 104 104 LYS N N 116.940 . 1 484 105 105 HIS H H 7.400 . 1 485 105 105 HIS HA H 4.200 . 1 486 105 105 HIS C C 176.440 . 1 487 105 105 HIS CA C 58.660 . 1 488 105 105 HIS CB C 29.280 . 1 489 105 105 HIS N N 116.080 . 1 490 106 106 PHE H H 7.470 . 1 491 106 106 PHE HA H 4.190 . 1 492 106 106 PHE C C 176.690 . 1 493 106 106 PHE CA C 61.170 . 1 494 106 106 PHE CB C 42.190 . 1 495 106 106 PHE N N 113.450 . 1 496 107 107 CYS H H 8.750 . 1 497 107 107 CYS C C 171.850 . 1 498 107 107 CYS CA C 55.410 . 1 499 107 107 CYS CB C 28.340 . 1 500 107 107 CYS N N 117.530 . 1 501 108 108 PRO C C 177.460 . 1 502 108 108 PRO CA C 64.950 . 1 503 108 108 PRO CB C 31.660 . 1 504 109 109 ASN H H 8.790 . 1 505 109 109 ASN HA H 4.710 . 1 506 109 109 ASN C C 174.470 . 1 507 109 109 ASN CA C 53.670 . 1 508 109 109 ASN CB C 38.650 . 1 509 109 109 ASN N N 113.740 . 1 510 110 110 VAL H H 7.070 . 1 511 110 110 VAL HA H 4.330 . 1 512 110 110 VAL C C 174.050 . 1 513 110 110 VAL CA C 60.160 . 1 514 110 110 VAL CB C 33.500 . 1 515 110 110 VAL N N 122.180 . 1 516 111 111 PRO CA C 63.190 . 1 517 111 111 PRO CB C 32.740 . 1 518 112 112 ILE H H 8.270 . 1 519 112 112 ILE HA H 4.800 . 1 520 112 112 ILE C C 175.840 . 1 521 112 112 ILE CA C 55.580 . 1 522 112 112 ILE CB C 43.140 . 1 523 112 112 ILE N N 120.010 . 1 524 113 113 ILE H H 9.200 . 1 525 113 113 ILE HA H 4.560 . 1 526 113 113 ILE C C 174.560 . 1 527 113 113 ILE CA C 58.800 . 1 528 113 113 ILE CB C 37.330 . 1 529 113 113 ILE N N 127.410 . 1 530 114 114 LEU H H 8.430 . 1 531 114 114 LEU HA H 5.320 . 1 532 114 114 LEU C C 173.450 . 1 533 114 114 LEU CA C 54.140 . 1 534 114 114 LEU CB C 43.350 . 1 535 114 114 LEU N N 130.420 . 1 536 115 115 VAL H H 9.080 . 1 537 115 115 VAL HA H 4.750 . 1 538 115 115 VAL C C 174.070 . 1 539 115 115 VAL CA C 60.240 . 1 540 115 115 VAL CB C 34.940 . 1 541 115 115 VAL N N 128.400 . 1 542 116 116 GLY H H 8.450 . 1 543 116 116 GLY HA2 H 3.320 . 2 544 116 116 GLY HA3 H 3.320 . 2 545 116 116 GLY C C 171.430 . 1 546 116 116 GLY CA C 44.650 . 1 547 116 116 GLY N N 112.160 . 1 548 118 118 LYS C C 178.600 . 1 549 119 119 LYS H H 8.740 . 1 550 119 119 LYS C C 177.310 . 1 551 119 119 LYS N N 116.320 . 1 552 120 120 ASP H H 8.800 . 1 553 120 120 ASP HA H 3.780 . 1 554 120 120 ASP C C 176.340 . 1 555 120 120 ASP CA C 55.370 . 1 556 120 120 ASP CB C 40.190 . 1 557 120 120 ASP N N 115.530 . 1 558 121 121 LEU H H 8.120 . 1 559 121 121 LEU C C 177.790 . 1 560 121 121 LEU CA C 55.000 . 1 561 121 121 LEU CB C 40.670 . 1 562 121 121 LEU N N 118.300 . 1 563 122 122 ARG H H 7.360 . 1 564 122 122 ARG HA H 3.580 . 1 565 122 122 ARG C C 175.620 . 1 566 122 122 ARG CA C 60.470 . 1 567 122 122 ARG CB C 29.680 . 1 568 122 122 ARG N N 118.020 . 1 569 123 123 ASN H H 7.800 . 1 570 123 123 ASN HA H 4.970 . 1 571 123 123 ASN C C 174.430 . 1 572 123 123 ASN CA C 51.670 . 1 573 123 123 ASN CB C 38.720 . 1 574 123 123 ASN N N 111.730 . 1 575 124 124 ASP H H 7.110 . 1 576 124 124 ASP HA H 4.710 . 1 577 124 124 ASP C C 175.660 . 1 578 124 124 ASP CA C 54.000 . 1 579 124 124 ASP CB C 44.160 . 1 580 124 124 ASP N N 121.270 . 1 581 125 125 GLU H H 9.220 . 1 582 125 125 GLU C C 178.160 . 1 583 125 125 GLU CA C 60.190 . 1 584 125 125 GLU CB C 29.710 . 1 585 125 125 GLU N N 130.090 . 1 586 126 126 HIS H H 8.540 . 1 587 126 126 HIS HA H 4.310 . 1 588 126 126 HIS C C 177.010 . 1 589 126 126 HIS CA C 60.190 . 1 590 126 126 HIS CB C 29.610 . 1 591 126 126 HIS N N 119.640 . 1 592 127 127 THR H H 8.350 . 1 593 127 127 THR C C 176.300 . 1 594 127 127 THR CA C 67.260 . 1 595 127 127 THR CB C 68.910 . 1 596 127 127 THR N N 117.780 . 1 597 128 128 ARG H H 8.280 . 1 598 128 128 ARG HA H 3.830 . 1 599 128 128 ARG C C 179.560 . 1 600 128 128 ARG CA C 60.720 . 1 601 128 128 ARG CB C 30.200 . 1 602 128 128 ARG N N 118.880 . 1 603 129 129 ARG H H 8.390 . 1 604 129 129 ARG HA H 4.070 . 1 605 129 129 ARG C C 179.370 . 1 606 129 129 ARG CA C 59.640 . 1 607 129 129 ARG CB C 30.290 . 1 608 129 129 ARG N N 120.890 . 1 609 130 130 GLU H H 8.390 . 1 610 130 130 GLU HA H 3.970 . 1 611 130 130 GLU C C 180.590 . 1 612 130 130 GLU CA C 59.230 . 1 613 130 130 GLU CB C 29.340 . 1 614 130 130 GLU N N 120.050 . 1 615 131 131 LEU H H 8.460 . 1 616 131 131 LEU HA H 4.100 . 1 617 131 131 LEU C C 180.330 . 1 618 131 131 LEU CA C 57.640 . 1 619 131 131 LEU CB C 41.680 . 1 620 131 131 LEU N N 119.600 . 1 621 132 132 ALA H H 8.120 . 1 622 132 132 ALA HA H 4.370 . 1 623 132 132 ALA C C 181.750 . 1 624 132 132 ALA CA C 55.210 . 1 625 132 132 ALA CB C 17.760 . 1 626 132 132 ALA N N 122.310 . 1 627 133 133 LYS H H 7.480 . 1 628 133 133 LYS HA H 4.170 . 1 629 133 133 LYS C C 177.770 . 1 630 133 133 LYS CA C 59.560 . 1 631 133 133 LYS CB C 32.700 . 1 632 133 133 LYS N N 119.590 . 1 633 134 134 MET H H 7.400 . 1 634 134 134 MET HA H 4.200 . 1 635 134 134 MET C C 174.870 . 1 636 134 134 MET CA C 53.670 . 1 637 134 134 MET CB C 32.030 . 1 638 134 134 MET N N 116.080 . 1 639 135 135 LYS H H 8.010 . 1 640 135 135 LYS HA H 3.950 . 1 641 135 135 LYS C C 175.330 . 1 642 135 135 LYS CA C 57.350 . 1 643 135 135 LYS CB C 28.810 . 1 644 135 135 LYS N N 114.720 . 1 645 136 136 GLN H H 7.880 . 1 646 136 136 GLN C C 173.220 . 1 647 136 136 GLN CA C 53.960 . 1 648 136 136 GLN CB C 33.750 . 1 649 136 136 GLN N N 116.130 . 1 650 137 137 GLU H H 8.250 . 1 651 137 137 GLU HA H 4.830 . 1 652 137 137 GLU C C 171.760 . 1 653 137 137 GLU CA C 54.220 . 1 654 137 137 GLU CB C 31.670 . 1 655 137 137 GLU N N 119.200 . 1 656 138 138 PRO C C 175.980 . 1 657 138 138 PRO CA C 63.170 . 1 658 138 138 PRO CB C 32.050 . 1 659 139 139 VAL H H 8.860 . 1 660 139 139 VAL C C 176.770 . 1 661 139 139 VAL CA C 64.200 . 1 662 139 139 VAL CB C 33.750 . 1 663 139 139 VAL N N 123.590 . 1 664 140 140 LYS H H 9.180 . 1 665 140 140 LYS C C 175.710 . 1 666 140 140 LYS CA C 55.110 . 1 667 140 140 LYS CB C 31.890 . 1 668 140 140 LYS N N 130.530 . 1 669 141 141 PRO C C 179.270 . 1 670 141 141 PRO CA C 66.030 . 1 671 141 141 PRO CB C 31.600 . 1 672 142 142 GLU H H 9.570 . 1 673 142 142 GLU HA H 3.870 . 1 674 142 142 GLU C C 178.720 . 1 675 142 142 GLU CA C 59.780 . 1 676 142 142 GLU CB C 28.430 . 1 677 142 142 GLU N N 115.170 . 1 678 143 143 GLU H H 7.260 . 1 679 143 143 GLU HA H 4.090 . 1 680 143 143 GLU C C 180.570 . 1 681 143 143 GLU CA C 58.290 . 1 682 143 143 GLU CB C 29.680 . 1 683 143 143 GLU N N 118.930 . 1 684 144 144 GLY H H 7.430 . 1 685 144 144 GLY C C 174.310 . 1 686 144 144 GLY CA C 46.670 . 1 687 144 144 GLY N N 108.430 . 1 688 145 145 ARG H H 7.660 . 1 689 145 145 ARG C C 178.830 . 1 690 145 145 ARG CA C 59.230 . 1 691 145 145 ARG CB C 30.150 . 1 692 145 145 ARG N N 121.200 . 1 693 146 146 ASP H H 7.960 . 1 694 146 146 ASP HA H 4.450 . 1 695 146 146 ASP C C 178.930 . 1 696 146 146 ASP CA C 57.150 . 1 697 146 146 ASP CB C 40.600 . 1 698 146 146 ASP N N 118.860 . 1 699 147 147 MET H H 7.610 . 1 700 147 147 MET HA H 4.540 . 1 701 147 147 MET C C 177.460 . 1 702 147 147 MET CA C 56.670 . 1 703 147 147 MET CB C 29.640 . 1 704 147 147 MET N N 120.520 . 1 705 148 148 ALA H H 8.200 . 1 706 148 148 ALA HA H 4.070 . 1 707 148 148 ALA C C 179.100 . 1 708 148 148 ALA CA C 55.500 . 1 709 148 148 ALA CB C 18.560 . 1 710 148 148 ALA N N 121.650 . 1 711 149 149 ASN H H 7.810 . 1 712 149 149 ASN HA H 4.570 . 1 713 149 149 ASN C C 178.170 . 1 714 149 149 ASN CA C 55.570 . 1 715 149 149 ASN CB C 38.100 . 1 716 149 149 ASN N N 116.110 . 1 717 150 150 ARG H H 8.210 . 1 718 150 150 ARG HA H 4.010 . 1 719 150 150 ARG C C 178.930 . 1 720 150 150 ARG CA C 59.710 . 1 721 150 150 ARG CB C 30.470 . 1 722 150 150 ARG N N 122.520 . 1 723 151 151 ILE H H 7.900 . 1 724 151 151 ILE HA H 4.440 . 1 725 151 151 ILE C C 176.180 . 1 726 151 151 ILE CA C 61.630 . 1 727 151 151 ILE CB C 38.680 . 1 728 151 151 ILE N N 109.030 . 1 729 152 152 GLY H H 7.640 . 1 730 152 152 GLY C C 175.980 . 1 731 152 152 GLY CA C 46.200 . 1 732 152 152 GLY N N 110.520 . 1 733 153 153 ALA H H 8.580 . 1 734 153 153 ALA HA H 4.360 . 1 735 153 153 ALA C C 176.690 . 1 736 153 153 ALA CA C 52.600 . 1 737 153 153 ALA CB C 18.900 . 1 738 153 153 ALA N N 122.140 . 1 739 154 154 PHE H H 9.760 . 1 740 154 154 PHE HA H 4.200 . 1 741 154 154 PHE C C 176.000 . 1 742 154 154 PHE CA C 60.330 . 1 743 154 154 PHE CB C 39.780 . 1 744 154 154 PHE N N 125.120 . 1 745 155 155 GLY H H 7.310 . 1 746 155 155 GLY C C 169.190 . 1 747 155 155 GLY CA C 44.950 . 1 748 155 155 GLY N N 99.880 . 1 749 156 156 TYR H H 8.270 . 1 750 156 156 TYR HA H 5.850 . 1 751 156 156 TYR C C 174.210 . 1 752 156 156 TYR CA C 55.560 . 1 753 156 156 TYR CB C 41.680 . 1 754 156 156 TYR N N 120.010 . 1 755 157 157 MET H H 8.250 . 1 756 157 157 MET HA H 4.570 . 1 757 157 157 MET C C 172.470 . 1 758 157 157 MET CA C 52.330 . 1 759 157 157 MET CB C 36.990 . 1 760 157 157 MET N N 125.800 . 1 761 158 158 GLU H H 7.810 . 1 762 158 158 GLU HA H 5.200 . 1 763 158 158 GLU C C 176.690 . 1 764 158 158 GLU CA C 53.580 . 1 765 158 158 GLU CB C 33.120 . 1 766 158 158 GLU N N 116.550 . 1 767 159 159 CYS H H 9.140 . 1 768 159 159 CYS HA H 5.120 . 1 769 159 159 CYS C C 172.100 . 1 770 159 159 CYS CA C 55.790 . 1 771 159 159 CYS CB C 31.800 . 1 772 159 159 CYS N N 114.900 . 1 773 160 160 SER H H 8.810 . 1 774 160 160 SER HA H 5.200 . 1 775 160 160 SER C C 175.010 . 1 776 160 160 SER CA C 55.860 . 1 777 160 160 SER CB C 64.450 . 1 778 160 160 SER N N 112.020 . 1 779 161 161 ALA H H 9.450 . 1 780 161 161 ALA HA H 5.310 . 1 781 161 161 ALA C C 174.250 . 1 782 161 161 ALA CA C 54.800 . 1 783 161 161 ALA CB C 17.650 . 1 784 161 161 ALA N N 134.190 . 1 785 162 162 LYS H H 7.150 . 1 786 162 162 LYS C C 177.710 . 1 787 162 162 LYS CA C 58.220 . 1 788 162 162 LYS CB C 34.390 . 1 789 162 162 LYS N N 114.800 . 1 790 163 163 THR H H 7.850 . 1 791 163 163 THR HA H 4.320 . 1 792 163 163 THR C C 175.370 . 1 793 163 163 THR CA C 61.130 . 1 794 163 163 THR CB C 69.450 . 1 795 163 163 THR N N 106.160 . 1 796 164 164 LYS H H 7.810 . 1 797 164 164 LYS HA H 3.710 . 1 798 164 164 LYS C C 175.430 . 1 799 164 164 LYS CA C 59.970 . 1 800 164 164 LYS CB C 30.160 . 1 801 164 164 LYS N N 118.240 . 1 802 165 165 ASP H H 7.920 . 1 803 165 165 ASP HA H 4.560 . 1 804 165 165 ASP C C 177.260 . 1 805 165 165 ASP CA C 55.140 . 1 806 165 165 ASP CB C 42.140 . 1 807 165 165 ASP N N 121.960 . 1 808 166 166 GLY H H 9.160 . 1 809 166 166 GLY HA2 H 4.090 . 2 810 166 166 GLY HA3 H 4.090 . 2 811 166 166 GLY C C 174.680 . 1 812 166 166 GLY CA C 46.440 . 1 813 166 166 GLY N N 115.460 . 1 814 167 167 VAL H H 7.390 . 1 815 167 167 VAL HA H 3.350 . 1 816 167 167 VAL C C 177.170 . 1 817 167 167 VAL CA C 67.600 . 1 818 167 167 VAL CB C 31.360 . 1 819 167 167 VAL N N 120.110 . 1 820 168 168 ARG H H 8.710 . 1 821 168 168 ARG HA H 4.010 . 1 822 168 168 ARG C C 178.460 . 1 823 168 168 ARG CA C 60.230 . 1 824 168 168 ARG CB C 29.080 . 1 825 168 168 ARG N N 119.180 . 1 826 169 169 GLU H H 9.400 . 1 827 169 169 GLU HA H 4.000 . 1 828 169 169 GLU C C 179.980 . 1 829 169 169 GLU CA C 61.360 . 1 830 169 169 GLU CB C 28.710 . 1 831 169 169 GLU N N 118.370 . 1 832 170 170 VAL H H 7.850 . 1 833 170 170 VAL HA H 3.250 . 1 834 170 170 VAL C C 176.590 . 1 835 170 170 VAL CA C 67.200 . 1 836 170 170 VAL CB C 31.160 . 1 837 170 170 VAL N N 121.360 . 1 838 171 171 PHE H H 7.020 . 1 839 171 171 PHE HA H 3.570 . 1 840 171 171 PHE C C 179.330 . 1 841 171 171 PHE CA C 62.650 . 1 842 171 171 PHE CB C 39.150 . 1 843 171 171 PHE N N 116.570 . 1 844 172 172 GLU H H 9.040 . 1 845 172 172 GLU HA H 3.850 . 1 846 172 172 GLU C C 177.720 . 1 847 172 172 GLU CA C 60.580 . 1 848 172 172 GLU CB C 29.690 . 1 849 172 172 GLU N N 124.220 . 1 850 173 173 MET H H 7.960 . 1 851 173 173 MET HA H 4.080 . 1 852 173 173 MET C C 177.940 . 1 853 173 173 MET CA C 59.230 . 1 854 173 173 MET CB C 32.770 . 1 855 173 173 MET N N 119.640 . 1 856 174 174 ALA H H 8.200 . 1 857 174 174 ALA HA H 3.600 . 1 858 174 174 ALA C C 178.290 . 1 859 174 174 ALA CA C 54.630 . 1 860 174 174 ALA CB C 18.630 . 1 861 174 174 ALA N N 119.140 . 1 862 175 175 THR H H 7.840 . 1 863 175 175 THR HA H 3.440 . 1 864 175 175 THR C C 175.770 . 1 865 175 175 THR CA C 68.130 . 1 866 175 175 THR N N 114.490 . 1 867 176 176 ARG H H 8.210 . 1 868 176 176 ARG HA H 3.790 . 1 869 176 176 ARG C C 179.460 . 1 870 176 176 ARG CA C 61.100 . 1 871 176 176 ARG CB C 29.420 . 1 872 176 176 ARG N N 120.780 . 1 873 177 177 ALA H H 8.030 . 1 874 177 177 ALA HA H 3.250 . 1 875 177 177 ALA C C 179.560 . 1 876 177 177 ALA CA C 55.140 . 1 877 177 177 ALA CB C 16.620 . 1 878 177 177 ALA N N 120.620 . 1 879 178 178 ALA H H 7.830 . 1 880 178 178 ALA HA H 3.970 . 1 881 178 178 ALA C C 178.510 . 1 882 178 178 ALA CA C 53.800 . 1 883 178 178 ALA CB C 17.290 . 1 884 178 178 ALA N N 119.120 . 1 885 179 179 LEU H H 7.820 . 1 886 179 179 LEU C C 177.900 . 1 887 179 179 LEU CA C 55.770 . 1 888 179 179 LEU CB C 42.450 . 1 889 179 179 LEU N N 116.090 . 1 890 180 180 GLN H H 7.420 . 1 891 180 180 GLN HA H 4.200 . 1 892 180 180 GLN C C 174.780 . 1 893 180 180 GLN CA C 56.690 . 1 894 180 180 GLN CB C 29.420 . 1 895 180 180 GLN N N 118.160 . 1 896 181 181 ALA H H 7.720 . 1 897 181 181 ALA HA H 4.160 . 1 898 181 181 ALA C C 182.410 . 1 899 181 181 ALA CA C 54.140 . 1 900 181 181 ALA CB C 20.110 . 1 901 181 181 ALA N N 130.010 . 1 stop_ save_ save_spectral_peak_list_GDP_hsqc _Saveframe_category spectral_peak_list _Details . loop_ _Software_label $NMRView stop_ _Experiment_label '2D 1H-15N HSQC' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 2 H H 2 N N stop_ _Sample_label $sample_1 _Sample_conditions_label $sample_conditions_1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_spectral_peak_list_GDP_hsqc >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode spectral_peak_list_GDP_hsqc >> _Spectral_peak_list.Entry_ID 16668 >> _Spectral_peak_list.ID 1 >> _Spectral_peak_list.Sample_ID 1 >> _Spectral_peak_list.Sample_label $sample_1 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 >> _Spectral_peak_list.Experiment_ID 1 >> _Spectral_peak_list.Experiment_name '2D 1H-15N HSQC' >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Details . >> _Spectral_peak_list.Text_data_format text >> _Spectral_peak_list.Text_data >>; >>loop_ >> _Peak_list_number >> _Intensity_height >> _Intensity_volume >> _Intensity_volume2 >> _Peak_status >> _flag >> _comment >> _Dim_1_label >> _Dim_1_chem_shift >> _Dim_1_line_width >> _Dim_1_bounds >> _Dim_1_error >> _Dim_1_j >> _Dim_1_link0 >> _Dim_1_link1 >> _Dim_1_thread >> _Dim_1_user >> _Dim_2_label >> _Dim_2_chem_shift >> _Dim_2_line_width >> _Dim_2_bounds >> _Dim_2_error >> _Dim_2_j >> _Dim_2_link0 >> _Dim_2_link1 >> _Dim_2_thread >> _Dim_2_user >> >> 0 0.061 0.000 0.000 0 2 {?} >>{?} 11.39700031 0.03400000 0.05800000 {++} 0.00000000 0 0 0 {?} >>{?} 132.04499817 0.20500000 0.42300001 {++} 0.00000000 0 0 0 {?} >> 1 0.054 0.000 0.000 0 2 {?} >>{?} 10.58300018 0.04500000 0.07300000 {++} 0.00000000 0 0 0 {?} >>{?} 125.11799622 0.26300001 0.47499999 {++} 0.00000000 0 0 0 {?} >> 2 0.029 0.000 0.000 0 2 {?} >>{?} 10.33600044 0.04100000 0.05600000 {++} 0.00000000 0 0 0 {?} >>{?} 124.35099792 0.28900000 0.40300000 {++} 0.00000000 0 0 0 {?} >> 3 0.028 0.000 0.000 0 2 {?} >>{?} 10.21399975 0.04700000 0.06100000 {++} 0.00000000 0 0 0 {?} >>{?} 117.09500122 0.30899999 0.42199999 {++} 0.00000000 0 0 0 {?} >> 4 0.105 0.000 0.000 0 2 {?} >>{?} 10.06000042 0.03700000 0.07200000 {++} 0.00000000 0 0 0 {?} >>{?} 128.42700195 0.25600001 0.51999998 {++} 0.00000000 0 0 0 {?} >> 5 0.054 0.000 0.000 0 2 {?} >>{?} 9.76200008 0.03500000 0.06300000 {++} 0.00000000 0 0 0 {?} >>{?} 125.12300110 0.28600001 0.50800002 {++} 0.00000000 0 0 0 {?} >> 6 0.097 0.000 0.000 0 2 {?} >>{?} 9.56599998 0.03100000 0.06400000 {++} 0.00000000 0 0 0 {?} >>{?} 115.17400360 0.26300001 0.54299998 {++} 0.00000000 0 0 0 {?} >> 7 0.048 0.000 0.000 0 2 {?} >>{?} 9.44799995 0.02800000 0.04900000 {++} 0.00000000 0 0 0 {?} >>{?} 134.18699646 0.24400000 0.38900000 {++} 0.00000000 0 0 0 {?} >> 8 0.078 0.000 0.000 0 2 {?} >>{?} 9.40400028 0.04100000 0.07300000 {++} 0.00000000 0 0 0 {?} >>{?} 130.03999329 0.33800000 0.54699999 {++} 0.00000000 0 0 0 {?} >> 9 0.100 0.000 0.000 0 2 {?} >>{?} 9.39500046 0.03400000 0.07300000 {++} 0.00000000 0 0 0 {?} >>{?} 118.37200165 0.20900001 0.47200000 {++} 0.00000000 0 0 0 {?} >> 10 0.072 0.000 0.000 0 2 {?} >>{?} 9.34599972 0.03800000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 128.23800659 0.29300001 0.55500001 {++} 0.00000000 0 0 0 {?} >> 11 0.043 0.000 0.000 0 2 {?} >>{?} 9.30700016 0.04100000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 113.72499847 0.30800000 0.48800001 {++} 0.00000000 0 0 0 {?} >> 12 0.095 0.000 0.000 0 2 {?} >>{?} 9.27499962 0.03200000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 125.29799652 0.30899999 0.54000002 {++} 0.00000000 0 0 0 {?} >> 13 0.071 0.000 0.000 0 2 {?} >>{?} 9.22000027 0.03100000 0.06900000 {++} 0.00000000 0 0 0 {?} >>{?} 130.09399414 0.24900000 0.48600000 {++} 0.00000000 0 0 0 {?} >> 14 0.100 0.000 0.000 0 2 {?} >>{?} 9.20400047 0.04700000 0.07800000 { ?} 0.00000000 0 0 0 {?} >>{?} 127.40499878 0.30700001 0.61400002 {++} 0.00000000 0 0 0 {?} >> 15 0.057 0.000 0.000 0 2 {?} >>{?} 9.18299961 0.03500000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 130.52699280 0.28000000 0.74199998 { ?} 0.00000000 0 0 0 {?} >> 16 0.082 0.000 0.000 0 2 {?} >>{?} 9.16199970 0.03600000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 115.45899963 0.12400000 0.48600000 { ?} 0.00000000 0 0 0 {?} >> 17 0.079 0.000 0.000 0 2 {?} >>{?} 9.14000034 0.03400000 0.06700000 {++} 0.00000000 0 0 0 {?} >>{?} 126.70500183 0.33399999 0.55400002 { ?} 0.00000000 0 0 0 {?} >> 18 0.059 0.000 0.000 0 2 {?} >>{?} 9.13899994 0.04100000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 114.90000153 0.39700001 0.59700000 { ?} 0.00000000 0 0 0 {?} >> 19 0.058 0.000 0.000 0 2 {?} >>{?} 9.12600040 0.02300000 0.02700000 { ?} 0.00000000 0 0 0 {?} >>{?} 127.37200165 0.32800001 0.63700002 { ?} 0.00000000 0 0 0 {?} >> 20 0.076 0.000 0.000 0 2 {?} >>{?} 9.10499954 0.03500000 0.07000000 {++} 0.00000000 0 0 0 {?} >>{?} 129.02600098 0.29600000 0.56400001 {++} 0.00000000 0 0 0 {?} >> 21 0.120 0.000 0.000 0 2 {?} >>{?} 9.10000038 0.03800000 0.07700000 {++} 0.00000000 0 0 0 {?} >>{?} 119.37500000 0.30199999 0.58399999 {++} 0.00000000 0 0 0 {?} >> 22 0.052 0.000 0.000 0 2 {?} >>{?} 9.08100033 0.03600000 0.06500000 {++} 0.00000000 0 0 0 {?} >>{?} 128.40400696 0.33500001 0.52700001 {++} 0.00000000 0 0 0 {?} >> 23 0.103 0.000 0.000 0 2 {?} >>{?} 9.07900047 0.03400000 0.10200000 { ?} 0.00000000 0 0 0 {?} >>{?} 122.77300262 0.33800000 0.58099997 {++} 0.00000000 0 0 0 {?} >> 24 0.111 0.000 0.000 0 2 {?} >>{?} 9.05799961 0.03300000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 118.70200348 0.21200000 0.51099998 {++} 0.00000000 0 0 0 {?} >> 25 0.081 0.000 0.000 0 2 {?} >>{?} 9.04199982 0.03100000 0.06500000 {++} 0.00000000 0 0 0 {?} >>{?} 124.22399902 0.28999999 0.55500001 {++} 0.00000000 0 0 0 {?} >> 26 0.046 0.000 0.000 0 2 {?} >>{?} 8.99400043 0.03300000 0.07000000 { ?} 0.00000000 0 0 0 {?} >>{?} 122.59999847 0.34000000 0.51499999 {++} 0.00000000 0 0 0 {?} >> 27 0.072 0.000 0.000 0 2 {?} >>{?} 8.98900032 0.04200000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 130.91099548 0.28400001 0.53500003 {++} 0.00000000 0 0 0 {?} >> 28 0.042 0.000 0.000 0 2 {?} >>{?} 8.96399975 0.03700000 0.07000000 {++} 0.00000000 0 0 0 {?} >>{?} 123.62899780 0.31600001 0.46399999 {++} 0.00000000 0 0 0 {?} >> 29 0.066 0.000 0.000 0 2 {?} >>{?} 8.96000004 0.03700000 0.06700000 {++} 0.00000000 0 0 0 {?} >>{?} 115.17099762 0.28099999 0.53600001 {++} 0.00000000 0 0 0 {?} >> 30 0.032 0.000 0.000 0 2 {?} >>{?} 8.94999981 0.04900000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 120.36299896 0.35600001 0.49800000 {++} 0.00000000 0 0 0 {?} >> 31 0.071 0.000 0.000 0 2 {?} >>{?} 8.92500019 0.03900000 0.07600000 {++} 0.00000000 0 0 0 {?} >>{?} 127.36199951 0.32100001 0.55199999 {++} 0.00000000 0 0 0 {?} >> 32 0.057 0.000 0.000 0 2 {?} >>{?} 8.88099957 0.03800000 0.06500000 {++} 0.00000000 0 0 0 {?} >>{?} 117.05799866 0.20600000 0.41600001 {++} 0.00000000 0 0 0 {?} >> 33 0.062 0.000 0.000 0 2 {?} >>{?} 8.86400032 0.04300000 0.07300000 {++} 0.00000000 0 0 0 {?} >>{?} 107.39800262 0.21300000 0.43700001 {++} 0.00000000 0 0 0 {?} >> 34 0.053 0.000 0.000 0 2 {?} >>{?} 8.85900021 0.04600000 0.08000000 {++} 0.00000000 0 0 0 {?} >>{?} 126.01100159 0.25500000 0.48800001 {++} 0.00000000 0 0 0 {?} >> 35 0.064 0.000 0.000 0 2 {?} >>{?} 8.86200047 0.03400000 0.07700000 { ?} 0.00000000 0 0 0 {?} >>{?} 123.58499908 0.30899999 0.58899999 {++} 0.00000000 0 0 0 {?} >> 36 0.058 0.000 0.000 0 2 {?} >>{?} 8.81000042 0.04200000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 112.02200317 0.27700001 0.49500000 {++} 0.00000000 0 0 0 {?} >> 37 0.055 0.000 0.000 0 2 {?} >>{?} 8.79699993 0.03900000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 115.53399658 0.27100000 0.44800001 {++} 0.00000000 0 0 0 {?} >> 38 0.099 0.000 0.000 0 2 {?} >>{?} 8.79500008 0.03800000 0.07100000 {++} 0.00000000 0 0 0 {?} >>{?} 103.76399994 0.31000000 0.56300002 {++} 0.00000000 0 0 0 {?} >> 39 0.079 0.000 0.000 0 2 {?} >>{?} 8.78999996 0.02300000 0.05800000 {++} 0.00000000 0 0 0 {?} >>{?} 113.73999786 0.21699999 0.50099999 {++} 0.00000000 0 0 0 {?} >> 40 0.048 0.000 0.000 0 2 {?} >>{?} 8.77400017 0.03900000 0.06200000 {++} 0.00000000 0 0 0 {?} >>{?} 121.51899719 0.31700000 0.51499999 {++} 0.00000000 0 0 0 {?} >> 41 0.072 0.000 0.000 0 2 {?} >>{?} 8.75000000 0.04100000 0.07000000 {++} 0.00000000 0 0 0 {?} >>{?} 117.53399658 0.32100001 0.74199998 { ?} 0.00000000 0 0 0 {?} >> 42 0.030 0.000 0.000 0 2 {?} >>{?} 8.73700047 0.05100000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 121.16300201 0.42199999 0.54799998 {++} 0.00000000 0 0 0 {?} >> 43 0.068 0.000 0.000 0 2 {?} >>{?} 8.74499989 0.03800000 0.06200000 { ?} 0.00000000 0 0 0 {?} >>{?} 116.96900177 0.32400000 0.47999999 { ?} 0.00000000 0 0 0 {?} >> 44 0.046 0.000 0.000 0 2 {?} >>{?} 8.74300003 0.04200000 0.06000000 {++} 0.00000000 0 0 0 {?} >>{?} 116.31700134 0.17600000 0.28000000 {++} 0.00000000 0 0 0 {?} >> 45 0.080 0.000 0.000 0 2 {?} >>{?} 8.71000004 0.02800000 0.07600000 { ?} 0.00000000 0 0 0 {?} >>{?} 119.18099976 0.32300001 0.58899999 {++} 0.00000000 0 0 0 {?} >> 46 0.082 0.000 0.000 0 2 {?} >>{?} 8.68999958 0.03300000 0.06000000 { ?} 0.00000000 0 0 0 {?} >>{?} 116.93599701 0.25000000 0.56699997 {++} 0.00000000 0 0 0 {?} >> 47 0.074 0.000 0.000 0 2 {?} >>{?} 8.59000015 0.03200000 0.07400000 { ?} 0.00000000 0 0 0 {?} >>{?} 117.13300323 0.31999999 0.55299997 {++} 0.00000000 0 0 0 {?} >> 48 0.078 0.000 0.000 0 2 {?} >>{?} 8.57499981 0.03300000 0.06100000 {++} 0.00000000 0 0 0 {?} >>{?} 122.13500214 0.26899999 0.51300001 {++} 0.00000000 0 0 0 {?} >> 49 0.104 0.000 0.000 0 2 {?} >>{?} 8.56799984 0.04000000 0.07700000 {++} 0.00000000 0 0 0 {?} >>{?} 128.24600220 0.28099999 0.55100000 {++} 0.00000000 0 0 0 {?} >> 50 0.081 0.000 0.000 0 2 {?} >>{?} 8.56599998 0.03700000 0.07500000 {++} 0.00000000 0 0 0 {?} >>{?} 120.41100311 0.33199999 0.53500003 {++} 0.00000000 0 0 0 {?} >> 51 0.075 0.000 0.000 0 2 {?} >>{?} 8.54899979 0.03600000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 112.33699799 0.24699999 0.51499999 {++} 0.00000000 0 0 0 {?} >> 52 0.015 0.000 0.000 0 2 {?} >>{?} 8.53800011 0.02700000 0.02200000 {++} 0.00000000 0 0 0 {?} >>{?} 126.07599640 0.27900001 0.27900001 {++} 0.00000000 0 0 0 {?} >> 53 0.122 0.000 0.000 0 2 {?} >>{?} 8.53699970 0.03600000 0.08600000 { ?} 0.00000000 0 0 0 {?} >>{?} 119.64199829 0.31900001 0.53700000 {++} 0.00000000 0 0 0 {?} >> 54 0.080 0.000 0.000 0 2 {?} >>{?} 8.52000046 0.04200000 0.07500000 {++} 0.00000000 0 0 0 {?} >>{?} 123.59200287 0.23999999 0.51800001 {++} 0.00000000 0 0 0 {?} >> 55 0.030 0.000 0.000 0 2 {?} >>{?} 8.52200031 0.04400000 0.06000000 {++} 0.00000000 0 0 0 {?} >>{?} 118.50800323 0.31299999 0.41499999 {++} 0.00000000 0 0 0 {?} >> 56 0.081 0.000 0.000 0 2 {?} >>{?} 8.46199989 0.03000000 0.07700000 { ?} 0.00000000 0 0 0 {?} >>{?} 119.59999847 0.21400000 0.44200000 {++} 0.00000000 0 0 0 {?} >> 57 0.042 0.000 0.000 0 2 {?} >>{?} 8.44999981 0.04300000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 112.16100311 0.25099999 0.46300000 {++} 0.00000000 0 0 0 {?} >> 58 0.051 0.000 0.000 0 2 {?} >>{?} 8.43299961 0.03500000 0.06200000 {++} 0.00000000 0 0 0 {?} >>{?} 130.41799927 0.23300000 0.44499999 {++} 0.00000000 0 0 0 {?} >> 59 0.062 0.000 0.000 0 2 {?} >>{?} 8.42199993 0.03800000 0.08300000 {++} 0.00000000 0 0 0 {?} >>{?} 123.69599915 0.25500000 0.48500001 {++} 0.00000000 0 0 0 {?} >> 60 0.111 0.000 0.000 0 2 {?} >>{?} 8.38500023 0.02100000 0.05100000 {++} 0.00000000 0 0 0 {?} >>{?} 120.89399719 0.37099999 0.63400000 {++} 0.00000000 0 0 0 {?} >> 61 0.096 0.000 0.000 0 2 {?} >>{?} 8.38500023 0.01700000 0.05400000 { ?} 0.00000000 0 0 0 {?} >>{?} 120.05400085 0.35600001 0.60299999 {++} 0.00000000 0 0 0 {?} >> 62 0.251 0.000 0.000 0 2 {?} >>{?} 8.36100006 0.02400000 0.05300000 {++} 0.00000000 0 0 0 {?} >>{?} 125.32599640 0.20999999 0.49399999 {++} 0.00000000 0 0 0 {?} >> 63 0.068 0.000 0.000 0 2 {?} >>{?} 8.34000015 0.01900000 0.04400000 { ?} 0.00000000 0 0 0 {?} >>{?} 122.24099731 0.31299999 0.59899998 {++} 0.00000000 0 0 0 {?} >> 64 0.081 0.000 0.000 0 2 {?} >>{?} 8.32800007 0.02300000 0.04800000 {++} 0.00000000 0 0 0 {?} >>{?} 117.83999634 0.65899998 1.03799999 {++} 0.00000000 0 0 0 {?} >> 65 0.113 0.000 0.000 0 2 {?} >>{?} 8.30900002 0.03300000 0.07600000 { ?} 0.00000000 0 0 0 {?} >>{?} 121.20800018 0.23899999 0.48300001 {++} 0.00000000 0 0 0 {?} >> 66 0.033 0.000 0.000 0 2 {?} >>{?} 8.30599976 0.04000000 0.06400000 {++} 0.00000000 0 0 0 {?} >>{?} 110.16899872 0.28799999 0.42500001 {++} 0.00000000 0 0 0 {?} >> 67 0.123 0.000 0.000 0 2 {?} >>{?} 8.26500034 0.02400000 0.06300000 { ?} 0.00000000 0 0 0 {?} >>{?} 120.04000092 0.45899999 0.75500000 {++} 0.00000000 0 0 0 {?} >> 68 0.056 0.000 0.000 0 2 {?} >>{?} 8.29500008 0.04000000 0.07500000 {++} 0.00000000 0 0 0 {?} >>{?} 115.08599854 0.22300000 0.42300001 {++} 0.00000000 0 0 0 {?} >> 69 0.012 0.000 0.000 0 2 {?} >>{?} 7.61600018 0.02800000 0.01400000 { ?} 0.00000000 0 0 0 {?} >>{?} 120.52300262 0.66600001 0.33600000 { ?} 0.00000000 0 0 0 {?} >> 70 0.040 0.000 0.000 0 2 {?} >>{?} 8.27799988 0.04100000 0.06400000 {++} 0.00000000 0 0 0 {?} >>{?} 124.66000366 0.30800000 0.40400001 {++} 0.00000000 0 0 0 {?} >> 71 0.144 0.000 0.000 0 2 {?} >>{?} 8.27299976 0.03300000 0.05800000 { ?} 0.00000000 0 0 0 {?} >>{?} 122.27300262 0.31400001 0.66700000 {++} 0.00000000 0 0 0 {?} >> 72 0.074 0.000 0.000 0 2 {?} >>{?} 8.25199986 0.04100000 0.07000000 {++} 0.00000000 0 0 0 {?} >>{?} 125.80200195 0.24300000 0.70800000 {++} 0.00000000 0 0 0 {?} >> 73 0.011 0.000 0.000 0 2 {?} >>{?} 8.30300045 0.02600000 0.00500000 { ?} 0.00000000 0 0 0 {?} >>{?} 119.98600006 0.58499998 0.14300001 { ?} 0.00000000 0 0 0 {?} >> 74 0.012 0.000 0.000 0 2 {?} >>{?} 8.36499977 0.02700000 0.02700000 { ?} 0.00000000 0 0 0 {?} >>{?} 117.74500275 0.58800000 0.25200000 { ?} 0.00000000 0 0 0 {?} >> 75 0.103 0.000 0.000 0 2 {?} >>{?} 8.25199986 0.02000000 0.04600000 { ?} 0.00000000 0 0 0 {?} >>{?} 119.20400238 0.35900000 0.59799999 {++} 0.00000000 0 0 0 {?} >> 76 0.137 0.000 0.000 0 2 {?} >>{?} 8.22000027 0.04700000 0.04700000 { ?} 0.00000000 0 0 0 {?} >>{?} 122.51499939 0.17900001 0.44600001 {++} 0.00000000 0 0 0 {?} >> 77 0.218 0.000 0.000 0 2 {?} >>{?} 8.23499966 0.02600000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 123.51100159 0.37000000 0.69099998 {++} 0.00000000 0 0 0 {?} >> 78 0.069 0.000 0.000 0 2 {?} >>{?} 8.20600033 0.03700000 0.07100000 {++} 0.00000000 0 0 0 {?} >>{?} 120.77999878 0.33600000 0.52300000 {++} 0.00000000 0 0 0 {?} >> 79 0.011 0.000 0.000 0 2 {?} >>{?} 7.80000019 0.04600000 0.04600000 {++} 0.00000000 0 0 0 {?} >>{?} 116.58300018 0.25600001 0.08700000 { ?} 0.00000000 0 0 0 {?} >> 80 0.091 0.000 0.000 0 2 {?} >>{?} 8.19900036 0.04400000 0.05500000 { ?} 0.00000000 0 0 0 {?} >>{?} 119.13800049 0.27700001 0.54299998 {++} 0.00000000 0 0 0 {?} >> 81 0.152 0.000 0.000 0 2 {?} >>{?} 8.19600010 0.03100000 0.06900000 { ?} 0.00000000 0 0 0 {?} >>{?} 121.72200012 0.37900001 0.66600001 {++} 0.00000000 0 0 0 {?} >> 82 0.014 0.000 0.000 0 2 {?} >>{?} 8.18700027 0.02500000 0.02000000 {++} 0.00000000 0 0 0 {?} >>{?} 124.60299683 0.21699999 0.21699999 {++} 0.00000000 0 0 0 {?} >> 83 0.162 0.000 0.000 0 2 {?} >>{?} 8.14900017 0.03900000 0.10100000 {++} 0.00000000 0 0 0 {?} >>{?} 127.06900024 0.51999998 1.23800004 {++} 0.00000000 0 0 0 {?} >> 84 0.073 0.000 0.000 0 2 {?} >>{?} 8.14400005 0.03700000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 113.86900330 0.33899999 0.56000000 {++} 0.00000000 0 0 0 {?} >> 85 0.122 0.000 0.000 0 2 {?} >>{?} 8.11800003 0.02600000 0.07600000 {++} 0.00000000 0 0 0 {?} >>{?} 122.30899811 0.28000000 0.56300002 {++} 0.00000000 0 0 0 {?} >> 86 0.041 0.000 0.000 0 2 {?} >>{?} 8.11600018 0.04500000 0.07900000 {++} 0.00000000 0 0 0 {?} >>{?} 118.29900360 0.37700000 0.53899997 {++} 0.00000000 0 0 0 {?} >> 87 0.124 0.000 0.000 0 2 {?} >>{?} 8.10000038 0.02400000 0.06200000 { ?} 0.00000000 0 0 0 {?} >>{?} 121.73300171 0.28900000 0.56699997 { ?} 0.00000000 0 0 0 {?} >> 88 0.082 0.000 0.000 0 2 {?} >>{?} 8.08899975 0.03400000 0.07400000 { ?} 0.00000000 0 0 0 {?} >>{?} 120.53700256 0.37000000 0.57700002 {++} 0.00000000 0 0 0 {?} >> 89 0.083 0.000 0.000 0 2 {?} >>{?} 8.07299995 0.03900000 0.06700000 {++} 0.00000000 0 0 0 {?} >>{?} 116.58799744 0.41400000 0.70400000 {++} 0.00000000 0 0 0 {?} >> 90 0.103 0.000 0.000 0 2 {?} >>{?} 8.02799988 0.03800000 0.07000000 { ?} 0.00000000 0 0 0 {?} >>{?} 120.62200165 0.22600000 0.54299998 {++} 0.00000000 0 0 0 {?} >> 91 0.012 0.000 0.000 0 2 {?} >>{?} 8.63899994 0.04400000 0.04400000 {++} 0.00000000 0 0 0 {?} >>{?} 116.91500092 0.54500002 0.54500002 {++} 0.00000000 0 0 0 {?} >> 92 0.067 0.000 0.000 0 2 {?} >>{?} 8.00800037 0.03900000 0.07900000 {++} 0.00000000 0 0 0 {?} >>{?} 125.87899780 0.30899999 0.51800001 {++} 0.00000000 0 0 0 {?} >> 93 0.012 0.000 0.000 0 2 {?} >>{?} 8.02000046 0.04700000 0.04700000 { ?} 0.00000000 0 0 0 {?} >>{?} 117.31600189 0.34900001 0.34900001 {++} 0.00000000 0 0 0 {?} >> 94 0.089 0.000 0.000 0 2 {?} >>{?} 8.00899982 0.03200000 0.07000000 {++} 0.00000000 0 0 0 {?} >>{?} 114.72299957 0.25900000 0.52300000 {++} 0.00000000 0 0 0 {?} >> 95 0.010 0.000 0.000 0 2 {?} >>{?} 8.23200035 0.01900000 0.01900000 { ?} 0.00000000 0 0 0 {?} >>{?} 122.32299805 0.35100001 0.03700000 { ?} 0.00000000 0 0 0 {?} >> 96 0.093 0.000 0.000 0 2 {?} >>{?} 7.97300005 0.03100000 0.06500000 {++} 0.00000000 0 0 0 {?} >>{?} 116.81300354 0.29300001 0.53899997 {++} 0.00000000 0 0 0 {?} >> 97 0.023 0.000 0.000 0 2 {?} >>{?} 7.96999979 0.06000000 0.07100000 {++} 0.00000000 0 0 0 {?} >>{?} 123.36199951 0.40500000 0.45500001 {++} 0.00000000 0 0 0 {?} >> 98 0.088 0.000 0.000 0 2 {?} >>{?} 7.95800018 0.03800000 0.07900000 {++} 0.00000000 0 0 0 {?} >>{?} 119.63800049 0.40099999 0.59399998 {++} 0.00000000 0 0 0 {?} >> 99 0.101 0.000 0.000 0 2 {?} >>{?} 7.95499992 0.03300000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 118.85700226 0.23600000 0.45400000 {++} 0.00000000 0 0 0 {?} >> 100 0.075 0.000 0.000 0 2 {?} >>{?} 7.95900011 0.04100000 0.09000000 {++} 0.00000000 0 0 0 {?} >>{?} 118.11499786 0.27700001 0.52700001 {++} 0.00000000 0 0 0 {?} >> 101 0.108 0.000 0.000 0 2 {?} >>{?} 7.91499996 0.03200000 0.07300000 {++} 0.00000000 0 0 0 {?} >>{?} 121.96900177 0.30599999 0.58399999 {++} 0.00000000 0 0 0 {?} >> 102 0.096 0.000 0.000 0 2 {?} >>{?} 7.91300011 0.03000000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 110.19100189 0.24699999 0.44100001 {++} 0.00000000 0 0 0 {?} >> 103 0.184 0.000 0.000 0 2 {?} >>{?} 7.90199995 0.02100000 0.04600000 {++} 0.00000000 0 0 0 {?} >>{?} 113.23500061 0.25600001 0.57800001 {++} 0.00000000 0 0 0 {?} >> 104 0.071 0.000 0.000 0 2 {?} >>{?} 7.90399981 0.03900000 0.07000000 {++} 0.00000000 0 0 0 {?} >>{?} 109.02999878 0.22300000 0.45899999 {++} 0.00000000 0 0 0 {?} >> 105 0.116 0.000 0.000 0 2 {?} >>{?} 7.90600014 0.02200000 0.05400000 {++} 0.00000000 0 0 0 {?} >>{?} 120.40599823 0.32900000 0.56900001 {++} 0.00000000 0 0 0 {?} >> 106 0.029 0.000 0.000 0 2 {?} >>{?} 7.90299988 0.03800000 0.05300000 {++} 0.00000000 0 0 0 {?} >>{?} 115.59200287 0.44299999 0.44499999 { ?} 0.00000000 0 0 0 {?} >> 107 0.114 0.000 0.000 0 2 {?} >>{?} 7.88000011 0.03700000 0.07200000 {++} 0.00000000 0 0 0 {?} >>{?} 127.32800293 0.24500000 0.53399998 {++} 0.00000000 0 0 0 {?} >> 108 0.087 0.000 0.000 0 2 {?} >>{?} 7.88000011 0.03700000 0.07300000 { ?} 0.00000000 0 0 0 {?} >>{?} 116.13300323 0.16800000 0.54100001 { ?} 0.00000000 0 0 0 {?} >> 109 0.032 0.000 0.000 0 2 {?} >>{?} 8.14700031 0.01500000 0.02900000 { ?} 0.00000000 0 0 0 {?} >>{?} 121.75199890 0.41999999 0.59399998 {++} 0.00000000 0 0 0 {?} >> 110 0.072 0.000 0.000 0 2 {?} >>{?} 7.85799980 0.02700000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 119.92600250 0.37500000 0.60299999 {++} 0.00000000 0 0 0 {?} >> 111 0.077 0.000 0.000 0 2 {?} >>{?} 7.86199999 0.03200000 0.06300000 {++} 0.00000000 0 0 0 {?} >>{?} 116.69400024 0.26699999 0.55000001 { ?} 0.00000000 0 0 0 {?} >> 112 0.012 0.000 0.000 0 2 {?} >>{?} 8.20400047 0.03600000 0.03600000 {++} 0.00000000 0 0 0 {?} >>{?} 127.07700348 0.42199999 0.42199999 {++} 0.00000000 0 0 0 {?} >> 113 0.084 0.000 0.000 0 2 {?} >>{?} 7.84700012 0.03800000 0.06400000 {++} 0.00000000 0 0 0 {?} >>{?} 121.36000061 0.25799999 0.53299999 {++} 0.00000000 0 0 0 {?} >> 114 0.071 0.000 0.000 0 2 {?} >>{?} 7.85200024 0.03700000 0.06400000 {++} 0.00000000 0 0 0 {?} >>{?} 106.16000366 0.29300001 0.52200001 {++} 0.00000000 0 0 0 {?} >> 115 0.094 0.000 0.000 0 2 {?} >>{?} 7.82399988 0.03400000 0.08200000 {++} 0.00000000 0 0 0 {?} >>{?} 119.14099884 0.23700000 0.46599999 {++} 0.00000000 0 0 0 {?} >> 116 0.065 0.000 0.000 0 2 {?} >>{?} 7.83500004 0.03800000 0.06600000 {++} 0.00000000 0 0 0 {?} >>{?} 114.48999786 0.39600000 0.62800002 {++} 0.00000000 0 0 0 {?} >> 117 0.153 0.000 0.000 0 2 {?} >>{?} 7.76800013 0.02900000 0.04900000 { ?} 0.00000000 0 0 0 {?} >>{?} 116.07800293 0.39500001 0.61600000 {++} 0.00000000 0 0 0 {?} >> 118 0.060 0.000 0.000 0 2 {?} >>{?} 7.81300020 0.03600000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 118.24500275 0.27300000 0.46100000 {++} 0.00000000 0 0 0 {?} >> 119 0.133 0.000 0.000 0 2 {?} >>{?} 7.81300020 0.02100000 0.05000000 {++} 0.00000000 0 0 0 {?} >>{?} 112.87300110 0.20000000 0.58999997 { ?} 0.00000000 0 0 0 {?} >> 120 0.075 0.000 0.000 0 2 {?} >>{?} 7.79500008 0.04100000 0.08100000 {++} 0.00000000 0 0 0 {?} >>{?} 111.73799896 0.26199999 0.56099999 {++} 0.00000000 0 0 0 {?} >> 121 0.066 0.000 0.000 0 2 {?} >>{?} 7.77799988 0.02000000 0.05600000 {++} 0.00000000 0 0 0 {?} >>{?} 112.44000244 0.25500000 0.45800000 {++} 0.00000000 0 0 0 {?} >> 122 0.056 0.000 0.000 0 2 {?} >>{?} 7.76700020 0.04000000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 125.29699707 0.39100000 0.61299998 {++} 0.00000000 0 0 0 {?} >> 123 0.387 0.000 0.000 0 2 {?} >>{?} 7.71899986 0.02500000 0.05700000 {++} 0.00000000 0 0 0 {?} >>{?} 130.01499939 0.22000000 0.53100002 {++} 0.00000000 0 0 0 {?} >> 124 0.060 0.000 0.000 0 2 {?} >>{?} 7.70900011 0.04000000 0.07600000 { ?} 0.00000000 0 0 0 {?} >>{?} 115.67500305 0.34700000 0.57099998 {++} 0.00000000 0 0 0 {?} >> 125 0.068 0.000 0.000 0 2 {?} >>{?} 7.69799995 0.03700000 0.08100000 {++} 0.00000000 0 0 0 {?} >>{?} 125.91799927 0.24600001 0.48699999 {++} 0.00000000 0 0 0 {?} >> 126 0.061 0.000 0.000 0 2 {?} >>{?} 7.70100021 0.04100000 0.08100000 {++} 0.00000000 0 0 0 {?} >>{?} 116.99199677 0.35400000 0.51400000 {++} 0.00000000 0 0 0 {?} >> 127 0.329 0.000 0.000 0 2 {?} >>{?} 7.69899988 0.02300000 0.04500000 {++} 0.00000000 0 0 0 {?} >>{?} 112.08399963 0.28600001 0.56500000 {++} 0.00000000 0 0 0 {?} >> 128 0.033 0.000 0.000 0 2 {?} >>{?} 7.66699982 0.04100000 0.06000000 {++} 0.00000000 0 0 0 {?} >>{?} 119.81700134 0.36300001 0.47900000 {++} 0.00000000 0 0 0 {?} >> 129 0.086 0.000 0.000 0 2 {?} >>{?} 7.66300011 0.03200000 0.06700000 {++} 0.00000000 0 0 0 {?} >>{?} 121.19999695 0.26899999 0.49500000 {++} 0.00000000 0 0 0 {?} >> 130 0.054 0.000 0.000 0 2 {?} >>{?} 7.65199995 0.04600000 0.07000000 { ?} 0.00000000 0 0 0 {?} >>{?} 115.54599762 0.36899999 0.56099999 {++} 0.00000000 0 0 0 {?} >> 131 0.118 0.000 0.000 0 2 {?} >>{?} 7.65700006 0.02400000 0.05100000 {++} 0.00000000 0 0 0 {?} >>{?} 114.22699738 0.30399999 0.64399999 {++} 0.00000000 0 0 0 {?} >> 132 0.091 0.000 0.000 0 2 {?} >>{?} 7.64499998 0.04600000 0.08700000 {++} 0.00000000 0 0 0 {?} >>{?} 122.08899689 0.24800000 0.46200001 {++} 0.00000000 0 0 0 {?} >> 133 0.075 0.000 0.000 0 2 {?} >>{?} 7.63800001 0.03600000 0.06500000 {++} 0.00000000 0 0 0 {?} >>{?} 110.59100342 0.34900001 0.56400001 {++} 0.00000000 0 0 0 {?} >> 134 0.243 0.000 0.000 0 2 {?} >>{?} 7.61199999 0.02100000 0.04600000 {++} 0.00000000 0 0 0 {?} >>{?} 112.13400269 0.20400000 0.55199999 {++} 0.00000000 0 0 0 {?} >> 135 0.115 0.000 0.000 0 2 {?} >>{?} 7.57299995 0.03500000 0.07000000 {++} 0.00000000 0 0 0 {?} >>{?} 120.47799683 0.55699998 1.11600006 {++} 0.00000000 0 0 0 {?} >> 136 0.142 0.000 0.000 0 2 {?} >>{?} 7.59800005 0.02800000 0.05300000 {++} 0.00000000 0 0 0 {?} >>{?} 112.81300354 0.29600000 0.54000002 {++} 0.00000000 0 0 0 {?} >> 137 0.026 0.000 0.000 0 2 {?} >>{?} 7.56899977 0.04500000 0.05900000 {++} 0.00000000 0 0 0 {?} >>{?} 117.04799652 0.29200000 0.37300000 {++} 0.00000000 0 0 0 {?} >> 138 0.263 0.000 0.000 0 2 {?} >>{?} 7.56400013 0.02100000 0.04500000 { ?} 0.00000000 0 0 0 {?} >>{?} 112.42500305 0.20100001 0.51599997 {++} 0.00000000 0 0 0 {?} >> 139 0.055 0.000 0.000 0 2 {?} >>{?} 7.51800013 0.03600000 0.06900000 {++} 0.00000000 0 0 0 {?} >>{?} 126.68699646 0.21699999 0.41999999 {++} 0.00000000 0 0 0 {?} >> 140 0.090 0.000 0.000 0 2 {?} >>{?} 7.52199984 0.03200000 0.07600000 {++} 0.00000000 0 0 0 {?} >>{?} 113.00800323 0.28000000 0.51400000 {++} 0.00000000 0 0 0 {?} >> 141 0.044 0.000 0.000 0 2 {?} >>{?} 7.49499989 0.04900000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 122.48400116 0.31400001 0.46300000 {++} 0.00000000 0 0 0 {?} >> 142 0.109 0.000 0.000 0 2 {?} >>{?} 7.47700024 0.03200000 0.06700000 {++} 0.00000000 0 0 0 {?} >>{?} 119.59600067 0.23700000 0.54100001 {++} 0.00000000 0 0 0 {?} >> 143 0.049 0.000 0.000 0 2 {?} >>{?} 7.46600008 0.03800000 0.06200000 {++} 0.00000000 0 0 0 {?} >>{?} 113.45400238 0.26199999 0.46799999 {++} 0.00000000 0 0 0 {?} >> 144 0.055 0.000 0.000 0 2 {?} >>{?} 7.45599985 0.03800000 0.06400000 {++} 0.00000000 0 0 0 {?} >>{?} 121.82900238 0.20700000 0.37200001 {++} 0.00000000 0 0 0 {?} >> 145 0.063 0.000 0.000 0 2 {?} >>{?} 7.42799997 0.04300000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 108.43199921 0.21200000 0.44100001 {++} 0.00000000 0 0 0 {?} >> 146 0.187 0.000 0.000 0 2 {?} >>{?} 7.42299986 0.02000000 0.04800000 { ?} 0.00000000 0 0 0 {?} >>{?} 118.16200256 0.29100001 0.56300002 {++} 0.00000000 0 0 0 {?} >> 147 0.086 0.000 0.000 0 2 {?} >>{?} 7.40399981 0.02500000 0.05000000 {++} 0.00000000 0 0 0 {?} >>{?} 116.63300323 0.29400000 0.52300000 { ?} 0.00000000 0 0 0 {?} >> 148 0.165 0.000 0.000 0 2 {?} >>{?} 7.39900017 0.03700000 0.07700000 {++} 0.00000000 0 0 0 {?} >>{?} 116.08899689 0.29400000 0.55800003 { ?} 0.00000000 0 0 0 {?} >> 149 0.099 0.000 0.000 0 2 {?} >>{?} 7.39300013 0.03000000 0.06900000 {++} 0.00000000 0 0 0 {?} >>{?} 120.11399841 0.30599999 0.52700001 {++} 0.00000000 0 0 0 {?} >> 150 0.088 0.000 0.000 0 2 {?} >>{?} 7.36100006 0.05900000 0.05900000 { ?} 0.00000000 0 0 0 {?} >>{?} 118.02200317 0.31000000 0.54299998 {++} 0.00000000 0 0 0 {?} >> 151 0.082 0.000 0.000 0 2 {?} >>{?} 7.30800009 0.03500000 0.06900000 {++} 0.00000000 0 0 0 {?} >>{?} 99.88200378 0.25299999 0.51400000 {++} 0.00000000 0 0 0 {?} >> 152 0.024 0.000 0.000 0 2 {?} >>{?} 7.27799988 0.05300000 0.06300000 {++} 0.00000000 0 0 0 {?} >>{?} 115.39299774 0.25299999 0.31900001 {++} 0.00000000 0 0 0 {?} >> 153 0.069 0.000 0.000 0 2 {?} >>{?} 7.25600004 0.03900000 0.07600000 {++} 0.00000000 0 0 0 {?} >>{?} 118.93599701 0.27599999 0.50700003 {++} 0.00000000 0 0 0 {?} >> 154 0.067 0.000 0.000 0 2 {?} >>{?} 7.24700022 0.03800000 0.06100000 {++} 0.00000000 0 0 0 {?} >>{?} 109.38700104 0.33899999 0.57200003 {++} 0.00000000 0 0 0 {?} >> 155 0.055 0.000 0.000 0 2 {?} >>{?} 7.23699999 0.05800000 0.09500000 {++} 0.00000000 0 0 0 {?} >>{?} 122.15000153 0.31000000 0.54799998 {++} 0.00000000 0 0 0 {?} >> 156 0.069 0.000 0.000 0 2 {?} >>{?} 7.14400005 0.03600000 0.07100000 {++} 0.00000000 0 0 0 {?} >>{?} 124.51599884 0.26300001 0.53399998 {++} 0.00000000 0 0 0 {?} >> 157 0.116 0.000 0.000 0 2 {?} >>{?} 7.10699987 0.03700000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 121.27899933 0.32400000 0.57300001 {++} 0.00000000 0 0 0 {?} >> 158 0.116 0.000 0.000 0 2 {?} >>{?} 7.07000017 0.03600000 0.08100000 {++} 0.00000000 0 0 0 {?} >>{?} 122.18499756 0.31000000 0.54600000 {++} 0.00000000 0 0 0 {?} >> 159 0.067 0.000 0.000 0 2 {?} >>{?} 7.02400017 0.04100000 0.07600000 {++} 0.00000000 0 0 0 {?} >>{?} 116.57499695 0.24200000 0.47799999 {++} 0.00000000 0 0 0 {?} >> 160 0.291 0.000 0.000 0 2 {?} >>{?} 7.02500010 0.02200000 0.05200000 {++} 0.00000000 0 0 0 {?} >>{?} 112.11900330 0.22600000 0.49700001 {++} 0.00000000 0 0 0 {?} >> 161 0.011 0.000 0.000 0 2 {?} >>{?} 9.15799999 0.01700000 0.00500000 { ?} 0.00000000 0 0 0 {?} >>{?} 127.37200165 0.35299999 0.10900000 { ?} 0.00000000 0 0 0 {?} >> 162 0.186 0.000 0.000 0 2 {?} >>{?} 7.00799990 0.02300000 0.05100000 {++} 0.00000000 0 0 0 {?} >>{?} 113.25000000 0.29100001 0.56800002 {++} 0.00000000 0 0 0 {?} >> 163 0.116 0.000 0.000 0 2 {?} >>{?} 6.98099995 0.03000000 0.05300000 {++} 0.00000000 0 0 0 {?} >>{?} 114.25299835 0.22300000 0.49100000 {++} 0.00000000 0 0 0 {?} >> 164 0.085 0.000 0.000 0 2 {?} >>{?} 6.92500019 0.03600000 0.07600000 {++} 0.00000000 0 0 0 {?} >>{?} 116.56500244 0.26499999 0.51599997 {++} 0.00000000 0 0 0 {?} >> 165 0.139 0.000 0.000 0 2 {?} >>{?} 6.92399979 0.03000000 0.06100000 { ?} 0.00000000 0 0 0 {?} >>{?} 112.82499695 0.27500001 0.54699999 {++} 0.00000000 0 0 0 {?} >> 166 0.161 0.000 0.000 0 2 {?} >>{?} 6.88000011 0.03300000 0.05500000 { ?} 0.00000000 0 0 0 {?} >>{?} 112.86399841 0.21600001 0.51300001 {++} 0.00000000 0 0 0 {?} >> 167 0.256 0.000 0.000 0 2 {?} >>{?} 6.83599997 0.02600000 0.05600000 {++} 0.00000000 0 0 0 {?} >>{?} 112.42800140 0.19400001 0.49200001 {++} 0.00000000 0 0 0 {?} >> 168 0.097 0.000 0.000 0 2 {?} >>{?} 6.75500011 0.03300000 0.05900000 {++} 0.00000000 0 0 0 {?} >>{?} 108.75499725 0.21799999 0.58700001 {++} 0.00000000 0 0 0 {?} >> 169 0.015 0.000 0.000 0 2 {?} >>{?} 6.72399998 0.02600000 0.02300000 {++} 0.00000000 0 0 0 {?} >>{?} 116.50800323 0.29600000 0.22100000 {++} 0.00000000 0 0 0 {?} >> 170 0.237 0.000 0.000 0 2 {?} >>{?} 6.72599983 0.02700000 0.05600000 {++} 0.00000000 0 0 0 {?} >>{?} 112.11900330 0.21100000 0.51200002 {++} 0.00000000 0 0 0 {?} >> 171 0.039 0.000 0.000 0 2 {?} >>{?} 6.71500015 0.03900000 0.05500000 {++} 0.00000000 0 0 0 {?} >>{?} 117.11299896 0.29699999 0.46399999 {++} 0.00000000 0 0 0 {?} >> 172 0.055 0.000 0.000 0 2 {?} >>{?} 6.65199995 0.03800000 0.06300000 {++} 0.00000000 0 0 0 {?} >>{?} 118.65100098 0.26199999 0.45699999 {++} 0.00000000 0 0 0 {?} >> 173 0.084 0.000 0.000 0 2 {?} >>{?} 6.53599977 0.03400000 0.06800000 {++} 0.00000000 0 0 0 {?} >>{?} 115.54799652 0.22900000 0.48100001 {++} 0.00000000 0 0 0 {?} >> 174 0.134 0.000 0.000 0 2 {?} >>{?} 6.53599977 0.03300000 0.07300000 {++} 0.00000000 0 0 0 {?} >>{?} 113.40399933 0.28099999 0.55000001 {++} 0.00000000 0 0 0 {?} >> 175 0.034 0.000 0.000 0 2 {?} >>{?} 6.38100004 0.04400000 0.08500000 {++} 0.00000000 0 0 0 {?} >>{?} 106.48200226 0.22600000 0.34400001 {++} 0.00000000 0 0 0 {?} >> 176 0.023 0.000 0.000 0 2 {?} >>{?} 6.37500000 0.06300000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 120.24500275 0.33100000 0.37900001 {++} 0.00000000 0 0 0 {?} >> 177 0.016 0.000 0.000 0 2 {?} >>{?} 9.44600010 0.03700000 0.06400000 {++} 0.00000000 0 0 0 {?} >>{?} 133.77699280 0.28900000 0.46000001 {++} 0.00000000 0 0 0 {?} >> 178 0.045 0.000 0.000 0 2 {?} >>{?} 8.82999992 0.03600000 0.07500000 {++} 0.00000000 0 0 0 {?} >>{?} 124.11900330 0.41299999 0.61000001 {++} 0.00000000 0 0 0 {?} >> 179 0.021 0.000 0.000 0 2 {?} >>{?} 8.80200005 0.03500000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 123.70500183 0.44299999 0.65399998 {++} 0.00000000 0 0 0 {?} >> 180 0.060 0.000 0.000 0 2 {?} >>{?} 8.28199959 0.02700000 0.06200000 { ?} 0.00000000 0 0 0 {?} >>{?} 118.87699890 0.31400001 0.52300000 {++} 0.00000000 0 0 0 {?} >> 181 0.037 0.000 0.000 0 2 {?} >>{?} 8.42000008 0.02100000 0.05300000 {++} 0.00000000 0 0 0 {?} >>{?} 121.10099792 0.38200000 0.65399998 {++} 0.00000000 0 0 0 {?} >> 182 0.063 0.000 0.000 0 2 {?} >>{?} 6.75299978 0.02900000 0.06000000 {++} 0.00000000 0 0 0 {?} >>{?} 109.38700104 0.32900000 0.54900002 {++} 0.00000000 0 0 0 {?} >> 183 0.008 0.000 0.000 0 2 {?} >>{?} 12.76599979 0.02300000 0.02300000 { ?} 0.00000000 0 0 0 {?} >>{?} 110.19100189 0.21900000 0.21600001 {++} 0.00000000 0 0 0 {?} >> 184 0.066 0.066 0.000 0 2 {?} >>{?} 7.80499983 0.02800000 0.08100000 {++} 0.00000000 0 0 0 {?} >>{?} 112.38099670 0.20600000 0.38100001 {++} 0.00000000 0 0 0 {?} >> 185 0.021 0.000 0.000 0 2 {?} >>{?} 7.83799982 0.02500000 0.04100000 { ?} 0.00000000 0 0 0 {?} >>{?} 116.03199768 0.50900000 0.80100000 {++} 0.00000000 0 0 0 {?} >> 186 0.153 0.000 0.000 0 2 {?} >>{?} 7.80600023 0.02200000 0.03600000 { ?} 0.00000000 0 0 0 {?} >>{?} 116.07099915 0.44700000 0.70200002 {++} 0.00000000 0 0 0 {?} >> 187 0.013 0.000 0.000 0 2 {?} >>{?} 7.70499992 0.01900000 0.02100000 {++} 0.00000000 0 0 0 {?} >>{?} 111.53600311 0.17399999 0.20000000 {++} 0.00000000 0 0 0 {?} >> 188 0.014 0.000 0.000 0 2 {?} >>{?} 7.61999989 0.00900000 0.01100000 {++} 0.00000000 0 0 0 {?} >>{?} 111.58000183 0.12200000 0.14900000 {++} 0.00000000 0 0 0 {?} >> 189 0.008 0.000 0.000 0 2 {?} >>{?} 7.66099977 0.02900000 0.07400000 {++} 0.00000000 0 0 0 {?} >>{?} 113.68099976 0.22100000 0.49200001 {++} 0.00000000 0 0 0 {?} >> 190 0.013 0.000 0.000 0 2 {?} >>{?} 7.56699991 0.01600000 0.02000000 {++} 0.00000000 0 0 0 {?} >>{?} 111.87500000 0.09100000 0.10500000 {++} 0.00000000 0 0 0 {?} >> 191 0.013 0.000 0.000 0 2 {?} >>{?} 6.84299994 0.02100000 0.02400000 {++} 0.00000000 0 0 0 {?} >>{?} 111.86199951 0.08400000 0.09800000 { ?} 0.00000000 0 0 0 {?} >> 192 0.019 0.000 0.000 0 2 {?} >>{?} 6.73400021 0.01700000 0.04200000 { ?} 0.00000000 0 0 0 {?} >>{?} 111.51999664 0.30000001 0.43300000 {++} 0.00000000 0 0 0 {?} >> 193 0.011 0.000 0.000 0 2 {?} >>{?} 7.03399992 0.02300000 0.02300000 { ?} 0.00000000 0 0 0 {?} >>{?} 111.50000000 0.33500001 0.33300000 {++} 0.00000000 0 0 0 {?} >> 194 0.010 0.000 0.000 0 2 {?} >>{?} 7.14467001 0.05724000 0.09745000 {++} 0.00000000 0 0 0 {?} >>{?} 114.76840973 0.42054000 0.53838998 {++} 0.00000000 0 0 0 {?} >> >>stop_ >>; >> >> loop_ >> _Spectral_dim.ID >> _Spectral_dim.Atom_type >> _Spectral_dim.Atom_isotope_number >> _Spectral_dim.Spectral_region >> _Spectral_dim.Magnetization_linkage_ID >> _Spectral_dim.Sweep_width >> _Spectral_dim.Sweep_width_units >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 2 H 1 H . 7682 . . . 16668 1 >> 2 N 15 N . 2293 . . . 16668 1 >> >> stop_ >> >> loop_ >> _Spectral_peak_software.Software_ID >> _Spectral_peak_software.Software_label >> _Spectral_peak_software.Method_ID >> _Spectral_peak_software.Method_label >> _Spectral_peak_software.Entry_ID >> _Spectral_peak_software.Spectral_peak_list_ID >> >> 1 $NMRView . . 16668 1 >> >> stop_ >> >>save_ >> ; save_