data_25684 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; SOLUTION STRUCTURE OF THE LIPID DROPLET ANCHORING PEPTIDE OF CGI-58 BOUND TO DPC MICELLES ; _BMRB_accession_number 25684 _BMRB_flat_file_name bmr25684.str _Entry_type original _Submission_date 2015-07-01 _Accession_date 2015-07-01 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Solution structure of the N-terminal lipid droplet binding motif of CGI-58' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Boeszoermenyi Andras B.A. . 2 Arthanari Haribabu A.H. . 3 Wagner Gerhard G.W. . 4 Nagy Harald N.H.M. . 5 Zangger Klaus Z.K. . 6 Lindermuth Hanna L.H. . 7 Oberer Monika O.M. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 4 spectral_peak_list 10 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 550 "13C chemical shifts" 216 "15N chemical shifts" 71 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-08-12 update BMRB 'update entry citation' 2015-09-14 original author 'original release' stop_ _Original_release_date 2015-09-14 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structure of a CGI-58 Motif Provides the Molecular Basis of Lipid Droplet Anchoring ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 26350461 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Boeszoermenyi Andras B.A. . 2 Arthanari Haribabu A.H. . 3 Wagner Gerhard G.W. . 4 Nagy Harald N.H.M. . 5 Zangger Klaus Z.K. . 6 Lindermuth Hanna L.H. . 7 Oberer Monika O.M. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 290 _Journal_issue 44 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 26361 _Page_last 26372 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'LIPID DROPLET ANCHORING PEPTIDE OF CGI-58' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'wr10 43' $wr10_43 stop_ _System_molecular_weight 3976.3072 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_wr10_43 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common wr10_43 _Molecular_mass 3976.3072 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 39 _Mol_residue_sequence ; GAMGSVDSADAGGGSGWLTG WLPTWCPTSTSHLKEAEEK ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 5 GLY 2 6 ALA 3 7 MET 4 8 GLY 5 9 SER 6 10 VAL 7 11 ASP 8 12 SER 9 13 ALA 10 14 ASP 11 15 ALA 12 16 GLY 13 17 GLY 14 18 GLY 15 19 SER 16 20 GLY 17 21 TRP 18 22 LEU 19 23 THR 20 24 GLY 21 25 TRP 22 26 LEU 23 27 PRO 24 28 THR 25 29 TRP 26 30 CYS 27 31 PRO 28 32 THR 29 33 SER 30 34 THR 31 35 SER 32 36 HIS 33 37 LEU 34 38 LYS 35 39 GLU 36 40 ALA 37 41 GLU 38 42 GLU 39 43 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB TmpAcc TmpAcc . . . . . UNP ABHD5_MOUSE Q9DBL9 . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $wr10_43 Mouse 10090 Eukaryota Metazoa Mus musculus 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 $wr10_43 'recombinant technology' 'ESCHERICHIA COLI' ESCHERICHIA COLI BL21(DE3) pSumo stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_wr10_43_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $wr10_43 1 mM '[U-13C; U-15N]' NaPP 20 mM 'natural abundance' NaCl 50 mM 'natural abundance' EDTA 1 mM 'natural abundance' DTT 5 mM 'natural abundance' stop_ save_ save_wr10_43_D2O _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $wr10_43 1 mM '[U-13C; U-15N]' NaPP 20 mM 'natural abundance' NaCl 50 mM 'natural abundance' EDTA 1 mM 'natural abundance' DTT 5 mM 'natural abundance' stop_ save_ save_wr18_39 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $wr10_43 1 mM '[U-13C; U-15N]' NaPP 20 mM 'natural abundance' NaCl 50 mM 'natural abundance' EDTA 1 mM 'natural abundance' DTT 5 mM 'natural abundance' stop_ save_ save_sample_new_1 _Saveframe_category sample _Sample_type solution _Details '1 mmol/l' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $wr10_43 1 mM '[U-13C; U-15N]' NaPP 20 mM 'natural abundance' NaCl 50 mM 'natural abundance' EDTA 1 mM 'natural abundance' DTT 5 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Saveframe_category software _Name CcpNmr_Analysis _Version 2.4 loop_ _Vendor _Address _Electronic_address CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk stop_ loop_ _Task 'Spectrum analysis, peak integration, distance restraint calibration' stop_ _Details 'The CCPN NMR assignment and data analysis application' save_ save_Cyana _Saveframe_category software _Name Cyana _Version 3.0 loop_ _Vendor _Address _Electronic_address GUNTERT . . stop_ loop_ _Task 'Simulated annealing' stop_ _Details . save_ save_TALOS+ _Saveframe_category software _Name TALOS+ _Version 1 loop_ _Vendor _Address _Electronic_address 'Shen, Cornilescu, Delaglio. and Bax' . . stop_ loop_ _Task 'Prediction of dihedral angle restraints' stop_ _Details . save_ save_nmrDraw _Saveframe_category software _Name nmrDraw _Version any loop_ _Vendor _Address _Electronic_address 'F. Delaglio' . . stop_ loop_ _Task 'Spectrum display' stop_ _Details . save_ save_nmrPipe _Saveframe_category software _Name nmrPipe _Version any loop_ _Vendor _Address _Electronic_address 'F. Delaglio' . . stop_ loop_ _Task 'Spectrum processing' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Bruker_600 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_Varian_700 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model dd2 _Field_strength 700 _Details . save_ save_Bruker_750 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 750 _Details . save_ save_Varian_500 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model UnityInova _Field_strength 500 _Details . save_ save_Bruker_900 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ save_BRUKER_DD2-600 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DD2 _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC/HMQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC/HMQC' _Sample_label $wr10_43_1 save_ save_HNCACB_(H[N[ca[CB]]])_2 _Saveframe_category NMR_applied_experiment _Experiment_name 'HNCACB (H[N[ca[CB]]])' _Sample_label $wr10_43_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $wr10_43_1 save_ save_3D_1H-15N_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $wr10_43_1 save_ save_HNCACO_(H[N[ca[CO]]])_5 _Saveframe_category NMR_applied_experiment _Experiment_name 'HNCACO (H[N[ca[CO]]])' _Sample_label $wr10_43_1 save_ save_HCCONH_(HccoNH)_6 _Saveframe_category NMR_applied_experiment _Experiment_name 'HCCONH (HccoNH)' _Sample_label $wr10_43_1 save_ save_CCONH_(hC_cacoNH.relayed)_7 _Saveframe_category NMR_applied_experiment _Experiment_name 'CCONH (hC_cacoNH.relayed)' _Sample_label $wr10_43_1 save_ save_3D_HCCH-TOCSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $wr10_43_1 save_ save_2D_1H-13C_HSQC/HMQC_9 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC/HMQC' _Sample_label $wr10_43_D2O save_ save_3D_1H-13C_NOESY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $wr10_43_D2O save_ save_2D_1H-1H_NOESY_11 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $wr18_39 save_ save_2D_1H-15N_HSQC/HMQC_12 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC/HMQC' _Sample_label $wr10_43_1 save_ save_2D_1H-1H_TOCSY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $wr10_43_1 save_ save_HNCA_14 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label $sample_new_1 save_ save_HNCACB_15 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label $sample_new_1 save_ save_HNCACO_16 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACO _Sample_label $sample_new_1 save_ save_HSQC_17 _Saveframe_category NMR_applied_experiment _Experiment_name HSQC _Sample_label $sample_new_1 save_ ####################### # Sample conditions # ####################### save_1 _Saveframe_category sample_conditions _Details '20 mM NaPP, 50 mM NaCl, 1 mM EDTA, 5 mM DTT, pH 6.0' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 70.000 . mM pH 6.000 . pH pressure 1.000 . atm temperature 310.000 . K stop_ save_ save_2 _Saveframe_category sample_conditions _Details '20 mM NaPP, 50 mM NaCl, 1 mM EDTA, 5 mM DTT, pH 6.0' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 70.000 . mM pH 6.000 . pH pressure 1.000 . atm temperature 303.000 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $CcpNmr_Analysis stop_ loop_ _Experiment_label '2D 1H-1H NOESY' '2D 1H-1H TOCSY' stop_ loop_ _Sample_label $wr18_39 $wr10_43_1 stop_ _Sample_conditions_label $2 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'wr10 43' _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 19 15 SER H H 8.726 0.001 1 2 19 15 SER HA H 4.445 . 1 3 19 15 SER HB2 H 3.783 . 2 4 19 15 SER HB3 H 3.808 . 2 5 20 16 GLY H H 8.600 0.001 1 6 20 16 GLY HA2 H 3.973 0.0 1 7 20 16 GLY HA3 H 3.973 0.0 1 8 21 17 TRP H H 8.360 0.001 1 9 21 17 TRP HA H 4.438 0.0 1 10 21 17 TRP HB2 H 3.313 0.001 2 11 21 17 TRP HB3 H 3.195 0.001 2 12 21 17 TRP HD1 H 7.408 0.001 1 13 21 17 TRP HE1 H 10.635 0.005 1 14 21 17 TRP HZ2 H 7.371 0.002 1 15 22 18 LEU H H 7.986 0.002 1 16 22 18 LEU HA H 3.957 0.002 1 17 22 18 LEU HB2 H 1.265 0.002 2 18 22 18 LEU HB3 H 1.391 0.001 2 19 22 18 LEU HD1 H 0.529 0.001 1 20 22 18 LEU HD2 H 0.675 0.002 1 21 23 19 THR H H 7.674 0.001 1 22 23 19 THR HA H 3.916 0.001 1 23 23 19 THR HB H 4.125 0.001 1 24 23 19 THR HG2 H 1.132 0.0 1 25 24 20 GLY H H 8.271 0.002 1 26 24 20 GLY HA2 H 3.818 0.001 1 27 24 20 GLY HA3 H 3.818 0.001 1 28 25 21 TRP H H 7.727 0.002 1 29 25 21 TRP HA H 4.402 . 1 30 25 21 TRP HB2 H 3.092 0.001 2 31 25 21 TRP HB3 H 3.230 0.0 2 32 25 21 TRP HD1 H 7.170 0.002 1 33 25 21 TRP HE1 H 10.184 0.001 1 34 25 21 TRP HZ2 H 7.381 . 1 35 26 22 LEU H H 7.259 0.001 1 36 26 22 LEU HA H 4.197 0.002 1 37 26 22 LEU HB2 H 1.472 0.001 2 38 26 22 LEU HB3 H 1.515 0.001 2 39 26 22 LEU HG H 1.262 0.001 1 40 26 22 LEU HD1 H 0.765 0.001 2 41 26 22 LEU HD2 H 0.699 0.001 1 42 27 23 PRO HA H 4.321 0.0 1 43 27 23 PRO HB2 H 1.728 0.161 1 44 27 23 PRO HB3 H 1.728 0.161 1 45 27 23 PRO HG2 H 1.369 0.001 1 46 27 23 PRO HG3 H 1.369 0.001 1 47 27 23 PRO HD2 H 3.588 0.001 1 48 27 23 PRO HD3 H 3.588 0.001 1 49 28 24 THR H H 8.440 0.002 1 50 28 24 THR HA H 3.971 0.002 1 51 28 24 THR HB H 4.170 0.001 1 52 28 24 THR HG2 H 1.177 0.0 1 53 29 25 TRP H H 7.147 0.001 1 54 29 25 TRP HA H 4.541 . 1 55 29 25 TRP HB2 H 3.368 0.003 2 56 29 25 TRP HB3 H 3.160 0.002 2 57 29 25 TRP HD1 H 7.287 0.001 1 58 29 25 TRP HE1 H 10.716 0.0 1 59 29 25 TRP HZ2 H 7.392 . 1 60 30 26 CYS H H 7.496 0.0 1 61 30 26 CYS HA H 4.463 . 1 62 30 26 CYS HB2 H 2.713 0.003 2 63 30 26 CYS HB3 H 2.275 0.006 2 64 31 27 PRO HA H 4.453 . 1 65 31 27 PRO HB2 H 2.303 0.004 1 66 31 27 PRO HB3 H 2.303 0.004 1 67 31 27 PRO HG2 H 1.937 0.001 1 68 31 27 PRO HG3 H 1.937 0.001 1 69 31 27 PRO HD2 H 3.736 0.001 1 70 31 27 PRO HD3 H 3.736 0.001 1 71 32 28 THR H H 8.108 0.001 1 72 32 28 THR HA H 4.305 0.0 1 73 32 28 THR HG2 H 1.109 . 1 74 33 29 SER H H 8.053 0.002 1 75 33 29 SER HA H 4.482 . 1 76 33 29 SER HB2 H 3.892 0.003 2 77 33 29 SER HB3 H 3.749 0.001 2 78 34 30 THR H H 8.267 0.002 1 79 34 30 THR HA H 4.262 0.001 1 80 34 30 THR HG2 H 1.127 . 1 81 35 31 SER H H 8.127 0.002 1 82 35 31 SER HA H 4.269 0.0 1 83 35 31 SER HB2 H 3.736 0.001 1 84 36 32 HIS H H 8.357 0.002 1 85 36 32 HIS HB2 H 3.257 0.001 2 86 36 32 HIS HB3 H 3.058 0.001 2 87 37 33 LEU H H 8.076 0.001 1 88 37 33 LEU HA H 4.257 . 1 89 37 33 LEU HB2 H 1.522 . 2 90 37 33 LEU HB3 H 1.609 0.001 2 91 37 33 LEU HD1 H 0.858 . 2 92 37 33 LEU HD2 H 0.809 0.001 2 93 38 34 LYS H H 8.082 0.002 1 94 38 34 LYS HA H 4.274 . 1 95 38 34 LYS HB2 H 1.675 . 2 96 38 34 LYS HB3 H 1.793 . 2 97 38 34 LYS HG2 H 1.353 . 1 98 38 34 LYS HG3 H 1.353 . 1 99 39 35 GLU H H 7.924 0.002 1 100 39 35 GLU HA H 4.077 0.0 1 101 39 35 GLU HB2 H 1.828 0.002 1 102 39 35 GLU HB3 H 1.828 0.002 1 103 39 35 GLU HG2 H 2.206 . 2 104 39 35 GLU HG3 H 1.998 0.003 2 stop_ save_ save_assigned_chem_shift_list_1_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $CcpNmr_Analysis stop_ loop_ _Experiment_label '2D 1H-13C HSQC/HMQC' '3D 1H-13C NOESY' stop_ loop_ _Sample_label $wr10_43_D2O stop_ _Sample_conditions_label $1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'wr10 43' _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 6 2 ALA HA H 4.423 0.001 1 2 6 2 ALA HB H 1.440 0.0 1 3 6 2 ALA CA C 52.208 . 1 4 6 2 ALA CB C 18.684 . 1 5 7 3 MET HA H 4.526 0.001 1 6 7 3 MET HB2 H 2.664 0.029 2 7 7 3 MET HB3 H 2.615 0.0 2 8 7 3 MET CA C 55.311 . 1 9 7 3 MET CB C 31.742 0.007 1 10 8 4 GLY HA2 H 4.041 0.034 1 11 8 4 GLY CA C 44.799 0.006 1 12 9 5 SER HA H 4.574 0.005 1 13 9 5 SER HB2 H 3.924 0.0 1 14 9 5 SER CA C 57.743 . 1 15 9 5 SER CB C 63.556 0.0 1 16 10 6 VAL HA H 4.238 0.003 1 17 10 6 VAL HB H 2.178 0.0 1 18 10 6 VAL HG1 H 0.994 0.004 2 19 10 6 VAL HG2 H 0.989 . 2 20 10 6 VAL CA C 61.968 . 1 21 10 6 VAL CB C 32.414 . 1 22 10 6 VAL CG1 C 20.870 . 2 23 10 6 VAL CG2 C 19.967 . 2 24 11 7 ASP HA H 4.704 0.0 1 25 11 7 ASP HB2 H 2.786 0.0 2 26 11 7 ASP HB3 H 2.678 0.0 2 27 11 7 ASP CA C 53.989 . 1 28 11 7 ASP CB C 41.059 0.003 1 29 12 8 SER HA H 4.457 0.001 1 30 12 8 SER HB2 H 3.972 0.0 2 31 12 8 SER HB3 H 3.873 0.0 2 32 12 8 SER CA C 58.149 0.025 1 33 12 8 SER CB C 63.355 0.014 1 34 13 9 ALA HA H 4.355 0.0 1 35 13 9 ALA HB H 1.453 0.0 1 36 13 9 ALA CA C 52.639 . 1 37 13 9 ALA CB C 18.975 0.0 1 38 14 10 ASP HA H 4.627 0.001 1 39 14 10 ASP HB2 H 2.769 0.003 2 40 14 10 ASP HB3 H 2.680 0.002 2 41 14 10 ASP CA C 53.940 0.005 1 42 14 10 ASP CB C 41.019 0.001 1 43 15 11 ALA HA H 4.374 0.0 1 44 15 11 ALA HB H 1.468 0.003 1 45 15 11 ALA CA C 52.535 0.0 1 46 15 11 ALA CB C 19.046 . 1 47 16 12 GLY HA2 H 4.049 . 2 48 16 12 GLY HA3 H 3.999 . 2 49 16 12 GLY CA C 44.983 0.012 1 50 17 13 GLY HA2 H 4.071 . 2 51 17 13 GLY HA3 H 4.017 . 2 52 17 13 GLY CA C 44.854 0.006 1 53 18 14 GLY HA2 H 4.093 . 2 54 18 14 GLY HA3 H 4.047 . 2 55 18 14 GLY CA C 44.799 0.012 1 56 19 15 SER HA H 4.464 0.0 1 57 19 15 SER HB2 H 3.903 0.008 1 58 19 15 SER CA C 58.159 0.0 1 59 19 15 SER CB C 63.480 0.0 1 60 20 16 GLY HA2 H 4.066 . 1 61 20 16 GLY CA C 45.149 . 1 62 21 17 TRP HB2 H 3.297 0.038 1 63 21 17 TRP CB C 29.085 0.01 1 64 22 18 LEU HA H 4.320 0.002 1 65 22 18 LEU HB2 H 1.543 0.006 2 66 22 18 LEU HB3 H 1.512 0.005 2 67 22 18 LEU HG H 1.387 0.002 1 68 22 18 LEU HD1 H 0.875 0.001 1 69 22 18 LEU HD2 H 0.793 0.002 1 70 22 18 LEU CA C 55.083 0.0 1 71 22 18 LEU CB C 41.938 0.059 1 72 22 18 LEU CG C 26.485 0.008 1 73 22 18 LEU CD1 C 24.614 . 1 74 22 18 LEU CD2 C 23.192 0.011 1 75 23 19 THR HA H 3.969 . 1 76 23 19 THR HB H 4.211 0.001 1 77 23 19 THR HG2 H 1.229 0.0 1 78 23 19 THR CA C 63.688 . 1 79 23 19 THR CB C 69.221 0.003 1 80 23 19 THR CG2 C 21.392 . 1 81 24 20 GLY HA2 H 3.956 . 1 82 24 20 GLY CA C 45.265 . 1 83 25 21 TRP HA H 4.567 0.001 1 84 25 21 TRP HB3 H 3.248 0.019 1 85 25 21 TRP HD1 H 7.209 . 1 86 25 21 TRP HE3 H 7.545 . 1 87 25 21 TRP CA C 57.300 0.021 1 88 25 21 TRP CB C 29.549 0.005 1 89 26 22 LEU HA H 4.511 0.001 1 90 26 22 LEU HB2 H 1.426 0.003 2 91 26 22 LEU HB3 H 1.386 0.003 2 92 26 22 LEU HG H 1.519 . 1 93 26 22 LEU HD1 H 0.886 0.004 2 94 26 22 LEU HD2 H 0.850 . 2 95 26 22 LEU CA C 52.214 0.011 1 96 26 22 LEU CB C 42.426 0.002 1 97 26 22 LEU CD1 C 23.577 . 1 98 26 22 LEU CD2 C 24.990 . 1 99 27 23 PRO HA H 4.236 0.003 1 100 27 23 PRO HB2 H 1.716 0.003 2 101 27 23 PRO HB3 H 2.154 0.001 2 102 27 23 PRO HG3 H 1.933 0.0 1 103 27 23 PRO HD2 H 3.545 0.001 2 104 27 23 PRO HD3 H 3.515 0.004 2 105 27 23 PRO CA C 62.850 0.0 1 106 27 23 PRO CB C 31.530 0.007 1 107 27 23 PRO CG C 26.906 . 1 108 27 23 PRO CD C 49.992 0.004 1 109 28 24 THR HA H 4.280 0.001 1 110 28 24 THR HB H 4.273 0.001 1 111 28 24 THR HG2 H 1.240 0.0 1 112 28 24 THR CA C 61.973 0.002 1 113 28 24 THR CB C 69.187 0.003 1 114 28 24 THR CG2 C 21.237 . 1 115 29 25 TRP HA H 4.702 0.002 1 116 29 25 TRP HB2 H 3.343 . 2 117 29 25 TRP HB3 H 3.300 0.003 2 118 29 25 TRP HD1 H 7.266 . 1 119 29 25 TRP HE3 H 7.573 . 1 120 29 25 TRP CA C 57.030 0.021 1 121 29 25 TRP CB C 29.206 . 1 122 30 26 CYS HA H 4.663 0.001 1 123 30 26 CYS HB2 H 2.806 0.001 2 124 30 26 CYS HB3 H 2.720 0.003 2 125 30 26 CYS CA C 55.617 0.003 1 126 30 26 CYS CB C 27.389 0.003 1 127 31 27 PRO HA H 4.320 0.003 1 128 31 27 PRO HB2 H 1.993 0.003 2 129 31 27 PRO HB3 H 2.311 0.002 2 130 31 27 PRO HG3 H 2.017 0.0 1 131 31 27 PRO HD2 H 3.689 0.0 2 132 31 27 PRO HD3 H 3.441 0.002 2 133 31 27 PRO CA C 63.150 0.009 1 134 31 27 PRO CB C 31.877 0.006 1 135 31 27 PRO CG C 26.877 0.006 1 136 31 27 PRO CD C 50.373 0.003 1 137 32 28 THR HA H 4.447 0.001 1 138 32 28 THR HB H 4.343 0.001 1 139 32 28 THR HG2 H 1.262 0.008 1 140 32 28 THR CA C 61.583 0.0 1 141 32 28 THR CB C 69.329 0.016 1 142 32 28 THR CG2 C 21.416 . 1 143 33 29 SER HA H 4.584 0.0 1 144 33 29 SER HB2 H 3.945 0.002 2 145 33 29 SER HB3 H 3.904 . 2 146 33 29 SER CA C 58.031 . 1 147 33 29 SER CB C 63.434 0.021 1 148 34 30 THR HA H 4.302 . 1 149 34 30 THR HB H 4.351 0.006 1 150 34 30 THR HG2 H 1.256 0.001 1 151 34 30 THR CA C 61.625 . 1 152 34 30 THR CB C 69.128 . 1 153 34 30 THR CG2 C 21.121 . 1 154 35 31 SER HB2 H 3.870 . 1 155 35 31 SER CB C 63.649 . 1 156 36 32 HIS HA H 4.733 0.0 1 157 36 32 HIS HB2 H 3.276 0.025 2 158 36 32 HIS HB3 H 3.168 0.003 2 159 36 32 HIS CA C 55.490 . 1 160 36 32 HIS CB C 29.437 . 1 161 37 33 LEU HA H 4.374 0.001 1 162 37 33 LEU HB2 H 1.675 0.001 2 163 37 33 LEU HB3 H 1.616 0.003 2 164 37 33 LEU HG H 1.523 0.009 1 165 37 33 LEU HD1 H 0.961 0.004 2 166 37 33 LEU HD2 H 0.896 0.01 2 167 37 33 LEU CA C 54.820 0.041 1 168 37 33 LEU CB C 42.017 0.011 1 169 37 33 LEU CG C 26.595 . 1 170 37 33 LEU CD1 C 24.638 0.0 2 171 37 33 LEU CD2 C 23.197 0.009 2 172 38 34 LYS HA H 4.350 0.001 1 173 38 34 LYS HB2 H 1.895 0.001 2 174 38 34 LYS HB3 H 1.813 0.002 2 175 38 34 LYS HG2 H 1.494 0.0 2 176 38 34 LYS HG3 H 1.477 . 2 177 38 34 LYS HD2 H 1.711 . 2 178 38 34 LYS HD3 H 1.745 0.0 2 179 38 34 LYS HE2 H 3.049 0.0 1 180 38 34 LYS CA C 56.073 0.0 1 181 38 34 LYS CB C 32.721 0.008 1 182 38 34 LYS CD C 28.715 0.001 1 183 38 34 LYS CE C 41.622 . 1 184 39 35 GLU HA H 4.303 0.0 1 185 39 35 GLU HB2 H 2.140 0.0 2 186 39 35 GLU HB3 H 2.014 0.001 2 187 39 35 GLU HG2 H 2.358 0.0 1 188 39 35 GLU CA C 56.435 0.001 1 189 39 35 GLU CB C 29.861 0.001 1 190 39 35 GLU CG C 35.916 0.0 1 191 40 36 ALA HA H 4.356 0.0 1 192 40 36 ALA HB H 1.465 0.0 1 193 40 36 ALA CA C 52.291 0.001 1 194 40 36 ALA CB C 18.793 . 1 195 41 37 GLU HA H 4.344 . 1 196 41 37 GLU HB2 H 2.131 . 2 197 41 37 GLU HB3 H 2.001 . 2 198 41 37 GLU HG2 H 2.352 . 2 199 41 37 GLU HG3 H 2.252 . 2 200 41 37 GLU CA C 56.247 . 1 201 41 37 GLU CB C 30.203 0.003 1 202 41 37 GLU CG C 36.425 0.003 1 203 42 38 GLU HA H 4.358 . 1 204 42 38 GLU HB2 H 2.119 . 2 205 42 38 GLU HB3 H 1.999 . 2 206 42 38 GLU HG2 H 2.327 . 1 207 42 38 GLU CA C 56.258 . 1 208 42 38 GLU CB C 30.008 . 1 209 42 38 GLU CG C 35.765 . 1 210 43 39 LYS HA H 4.239 0.003 1 211 43 39 LYS HB2 H 1.901 . 2 212 43 39 LYS HB3 H 1.775 . 2 213 43 39 LYS CA C 57.186 . 1 214 43 39 LYS CB C 33.504 0.004 1 stop_ save_ save_assigned_chem_shift_list_1_2_3 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $CcpNmr_Analysis stop_ loop_ _Experiment_label '2D 1H-15N HSQC/HMQC' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $wr10_43_1 stop_ _Sample_conditions_label $1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'wr10 43' _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 6 2 ALA HA H 4.364 . 1 2 6 2 ALA HB H 1.401 . 1 3 7 3 MET H H 8.560 0.003 1 4 7 3 MET HA H 4.460 0.001 1 5 7 3 MET HB2 H 2.589 0.032 1 6 7 3 MET HG2 H 2.127 0.004 2 7 7 3 MET HG3 H 2.030 . 2 8 7 3 MET N N 119.619 0.0 1 9 8 4 GLY H H 8.414 0.003 1 10 8 4 GLY HA2 H 3.992 . 1 11 8 4 GLY N N 110.213 . 1 12 9 5 SER H H 8.156 0.001 1 13 9 5 SER HA H 4.510 . 1 14 9 5 SER HB2 H 3.878 0.003 1 15 9 5 SER N N 115.680 0.0 1 16 10 6 VAL H H 8.218 0.002 1 17 10 6 VAL HA H 4.173 0.006 1 18 10 6 VAL HB H 2.122 0.002 1 19 10 6 VAL HG1 H 0.935 0.011 1 20 10 6 VAL N N 120.988 . 1 21 11 7 ASP H H 8.377 0.003 1 22 11 7 ASP HA H 4.640 0.001 1 23 11 7 ASP HB2 H 2.724 0.002 2 24 11 7 ASP HB3 H 2.619 . 2 25 11 7 ASP N N 123.609 0.0 1 26 12 8 SER H H 8.191 0.002 1 27 12 8 SER HA H 4.413 0.006 1 28 12 8 SER HB2 H 3.917 0.0 2 29 12 8 SER HB3 H 3.852 . 2 30 12 8 SER N N 116.317 0.0 1 31 13 9 ALA H H 8.380 0.003 1 32 13 9 ALA HA H 4.309 . 1 33 13 9 ALA HB H 1.401 . 1 34 13 9 ALA N N 125.738 0.004 1 35 14 10 ASP H H 8.155 0.002 1 36 14 10 ASP HA H 4.580 0.002 1 37 14 10 ASP HB2 H 2.712 . 2 38 14 10 ASP HB3 H 2.628 0.003 2 39 14 10 ASP N N 118.889 0.0 1 40 15 11 ALA H H 8.195 0.002 1 41 15 11 ALA HB H 1.419 0.004 1 42 15 11 ALA N N 124.672 0.0 1 43 16 12 GLY H H 8.398 0.003 1 44 16 12 GLY HA3 H 3.977 0.004 1 45 16 12 GLY N N 107.549 0.013 1 46 17 13 GLY H H 8.240 0.003 1 47 17 13 GLY HA3 H 3.984 . 1 48 17 13 GLY N N 108.423 0.004 1 49 18 14 GLY H H 8.374 0.005 1 50 18 14 GLY HA3 H 4.006 0.003 1 51 18 14 GLY N N 108.762 0.009 1 52 19 15 SER H H 8.294 0.003 1 53 19 15 SER HA H 4.468 0.001 1 54 19 15 SER HB2 H 3.852 . 1 55 19 15 SER N N 115.066 0.007 1 56 20 16 GLY H H 8.478 0.002 1 57 20 16 GLY HA3 H 3.996 0.002 1 58 20 16 GLY N N 110.645 0.01 1 59 21 17 TRP H H 8.243 0.001 1 60 21 17 TRP HA H 4.509 0.003 1 61 21 17 TRP HB2 H 3.263 0.034 2 62 21 17 TRP HB3 H 3.339 0.0 2 63 21 17 TRP HD1 H 7.414 0.001 1 64 21 17 TRP HE1 H 10.316 0.005 1 65 21 17 TRP HE3 H 6.781 . 1 66 21 17 TRP N N 121.301 0.0 1 67 21 17 TRP NE1 N 129.844 0.018 1 68 22 18 LEU H H 7.859 0.003 1 69 22 18 LEU HA H 4.029 . 1 70 22 18 LEU HB2 H 1.406 0.005 2 71 22 18 LEU HB3 H 1.459 0.003 2 72 22 18 LEU HG H 1.290 0.001 1 73 22 18 LEU HD1 H 0.676 0.002 1 74 22 18 LEU HD2 H 0.529 0.003 1 75 22 18 LEU N N 119.225 0.015 1 76 23 19 THR H H 7.695 0.002 1 77 23 19 THR HA H 4.020 . 1 78 23 19 THR HB H 4.175 0.002 1 79 23 19 THR HG2 H 1.165 0.002 1 80 23 19 THR N N 111.186 0.004 1 81 24 20 GLY H H 8.284 0.004 1 82 24 20 GLY HA3 H 3.894 0.001 1 83 24 20 GLY N N 109.672 0.035 1 84 25 21 TRP H H 7.744 0.002 1 85 25 21 TRP HA H 4.546 0.002 1 86 25 21 TRP HB2 H 3.138 0.0 2 87 25 21 TRP HB3 H 3.251 0.001 2 88 25 21 TRP HD1 H 7.222 0.001 1 89 25 21 TRP HE1 H 10.021 0.005 1 90 25 21 TRP HZ2 H 7.328 . 1 91 25 21 TRP HH2 H 6.966 . 1 92 25 21 TRP N N 119.299 0.025 1 93 25 21 TRP NE1 N 129.169 0.001 1 94 26 22 LEU H H 7.438 0.001 1 95 26 22 LEU HB2 H 1.419 . 1 96 26 22 LEU HD1 H 0.705 . 1 97 26 22 LEU HD2 H 0.657 . 1 98 26 22 LEU N N 120.415 0.008 1 99 27 23 PRO HG2 H 1.692 . 1 100 28 24 THR H H 7.798 0.005 1 101 28 24 THR HA H 4.228 0.0 1 102 28 24 THR HG2 H 1.148 . 1 103 28 24 THR N N 111.222 0.023 1 104 29 25 TRP H H 7.742 0.002 1 105 29 25 TRP HA H 4.691 . 1 106 29 25 TRP HB2 H 3.298 0.002 2 107 29 25 TRP HB3 H 3.215 0.0 2 108 29 25 TRP HD1 H 7.288 . 1 109 29 25 TRP HE3 H 7.484 . 1 110 29 25 TRP N N 121.050 0.015 1 111 30 26 CYS H H 7.955 0.001 1 112 30 26 CYS HA H 4.692 . 1 113 30 26 CYS HB2 H 2.804 . 1 114 30 26 CYS N N 119.070 0.015 1 115 31 27 PRO HA H 4.438 0.003 1 116 31 27 PRO HB2 H 1.941 0.004 2 117 31 27 PRO HB3 H 2.255 0.004 2 118 31 27 PRO HD2 H 3.619 0.0 1 119 32 28 THR H H 8.188 0.002 1 120 32 28 THR HA H 4.237 0.002 1 121 32 28 THR HB H 4.351 0.002 1 122 32 28 THR HG2 H 1.207 0.002 1 123 32 28 THR N N 113.618 0.009 1 124 33 29 SER H H 8.281 0.001 1 125 33 29 SER HA H 4.535 0.0 1 126 33 29 SER HB3 H 3.876 . 1 127 33 29 SER N N 117.677 0.0 1 128 34 30 THR H H 8.194 0.002 1 129 34 30 THR HA H 4.263 0.0 1 130 34 30 THR HG2 H 1.188 0.005 1 131 34 30 THR N N 115.410 0.0 1 132 35 31 SER H H 8.216 0.003 1 133 35 31 SER HA H 4.375 . 1 134 35 31 SER HB2 H 3.819 . 1 135 35 31 SER N N 117.746 0.0 1 136 36 32 HIS H H 8.447 0.004 1 137 36 32 HIS HB2 H 3.249 . 2 138 36 32 HIS HB3 H 3.128 . 2 139 36 32 HIS N N 120.607 0.017 1 140 37 33 LEU H H 8.153 0.001 1 141 37 33 LEU HA H 4.303 . 1 142 37 33 LEU HB2 H 1.578 . 2 143 37 33 LEU HB3 H 1.629 . 2 144 37 33 LEU HG H 1.519 . 1 145 37 33 LEU HD1 H 0.912 0.001 2 146 37 33 LEU HD2 H 0.848 0.001 2 147 37 33 LEU N N 123.242 0.0 1 148 38 34 LYS H H 8.282 0.001 1 149 38 34 LYS HA H 4.301 . 1 150 38 34 LYS HB2 H 1.850 0.002 2 151 38 34 LYS HB3 H 1.805 0.0 2 152 38 34 LYS HG3 H 1.431 0.0 1 153 38 34 LYS HD2 H 1.720 0.001 2 154 38 34 LYS HD3 H 1.749 0.002 2 155 38 34 LYS N N 122.166 0.0 1 156 39 35 GLU H H 8.451 0.002 1 157 39 35 GLU HA H 4.283 . 1 158 39 35 GLU HB2 H 2.070 0.002 2 159 39 35 GLU HB3 H 1.950 . 2 160 39 35 GLU HG2 H 2.299 0.002 1 161 39 35 GLU N N 122.287 0.002 1 162 40 36 ALA H H 8.254 0.003 1 163 40 36 ALA HA H 4.259 . 1 164 40 36 ALA HB H 1.402 0.0 1 165 40 36 ALA N N 124.163 0.0 1 166 41 37 GLU H H 8.253 0.003 1 167 41 37 GLU HA H 4.291 . 1 168 41 37 GLU HB2 H 2.069 0.003 2 169 41 37 GLU HB3 H 1.946 0.0 2 170 41 37 GLU HG3 H 2.283 0.0 1 171 41 37 GLU N N 119.567 . 1 172 42 38 GLU H H 8.313 0.003 1 173 42 38 GLU HA H 4.289 . 1 174 42 38 GLU HB2 H 2.065 . 2 175 42 38 GLU HB3 H 1.948 . 2 176 42 38 GLU HG2 H 2.283 . 1 177 42 38 GLU N N 122.512 0.005 1 178 43 39 LYS H H 7.932 0.002 1 179 43 39 LYS HA H 4.305 . 1 180 43 39 LYS HB2 H 1.832 . 2 181 43 39 LYS HB3 H 1.710 . 2 182 43 39 LYS HE2 H 2.589 . 1 183 43 39 LYS N N 127.795 0.0 1 stop_ save_ save_assigned_chem_shift_list_1_2_3_4 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $CcpNmr_Analysis stop_ loop_ _Experiment_label '2D 1H-15N HSQC/HMQC' 'HNCACB (H[N[ca[CB]]])' '3D HNCA' 'HNCACO (H[N[ca[CO]]])' 'HCCONH (HccoNH)' 'CCONH (hC_cacoNH.relayed)' '3D HCCH-TOCSY' stop_ loop_ _Sample_label $wr10_43_1 stop_ _Sample_conditions_label $1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'wr10 43' _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 6 2 ALA HA H 4.415 . 1 2 6 2 ALA HB H 1.451 . 1 3 6 2 ALA C C 177.833 . 1 4 6 2 ALA CA C 52.253 . 1 5 6 2 ALA CB C 19.149 0.005 1 6 7 3 MET H H 8.560 0.004 1 7 7 3 MET HA H 4.501 0.008 1 8 7 3 MET HB2 H 2.633 0.03 1 9 7 3 MET HG2 H 2.161 0.009 2 10 7 3 MET HG3 H 2.074 0.003 2 11 7 3 MET C C 176.651 0.001 1 12 7 3 MET CA C 55.205 0.029 1 13 7 3 MET CB C 32.401 0.007 1 14 7 3 MET CG C 31.512 . 1 15 7 3 MET N N 119.291 0.0 1 16 8 4 GLY H H 8.407 0.007 1 17 8 4 GLY HA2 H 4.045 0.031 1 18 8 4 GLY C C 174.067 . 1 19 8 4 GLY CA C 44.876 0.011 1 20 8 4 GLY N N 109.980 0.007 1 21 9 5 SER H H 8.168 0.005 1 22 9 5 SER HA H 4.562 . 1 23 9 5 SER HB2 H 3.925 . 1 24 9 5 SER C C 174.726 0.003 1 25 9 5 SER CA C 57.836 0.147 1 26 9 5 SER CB C 63.683 0.013 1 27 9 5 SER N N 115.641 0.004 1 28 10 6 VAL H H 8.203 0.006 1 29 10 6 VAL HA H 4.222 0.01 1 30 10 6 VAL HB H 2.162 0.008 1 31 10 6 VAL HG1 H 0.964 0.016 1 32 10 6 VAL C C 175.850 0.007 1 33 10 6 VAL CA C 61.960 0.068 1 34 10 6 VAL CB C 32.286 0.202 1 35 10 6 VAL CG1 C 20.766 . 2 36 10 6 VAL CG2 C 19.756 0.015 2 37 10 6 VAL N N 120.804 0.007 1 38 11 7 ASP H H 8.355 0.022 1 39 11 7 ASP HA H 4.677 0.012 1 40 11 7 ASP HB2 H 2.761 0.013 2 41 11 7 ASP HB3 H 2.657 0.009 2 42 11 7 ASP C C 176.315 0.005 1 43 11 7 ASP CA C 53.867 0.058 1 44 11 7 ASP CB C 41.116 0.023 1 45 11 7 ASP N N 123.132 0.17 1 46 12 8 SER H H 8.181 0.009 1 47 12 8 SER HA H 4.431 0.015 1 48 12 8 SER HB2 H 3.948 0.013 2 49 12 8 SER HB3 H 3.874 0.024 2 50 12 8 SER C C 174.588 0.004 1 51 12 8 SER CA C 58.009 0.071 1 52 12 8 SER CB C 63.565 0.089 1 53 12 8 SER N N 116.170 0.064 1 54 13 9 ALA H H 8.375 0.007 1 55 13 9 ALA HA H 4.340 0.012 1 56 13 9 ALA HB H 1.438 0.008 1 57 13 9 ALA C C 177.615 0.004 1 58 13 9 ALA CA C 52.459 0.012 1 59 13 9 ALA CB C 18.858 0.01 1 60 13 9 ALA N N 125.705 0.003 1 61 14 10 ASP H H 8.163 0.006 1 62 14 10 ASP HA H 4.600 0.014 1 63 14 10 ASP HB2 H 2.745 0.022 2 64 14 10 ASP HB3 H 2.666 0.009 2 65 14 10 ASP C C 176.271 0.007 1 66 14 10 ASP CA C 53.771 0.086 1 67 14 10 ASP CB C 41.060 0.028 1 68 14 10 ASP N N 118.864 0.028 1 69 15 11 ALA H H 8.189 0.007 1 70 15 11 ALA HA H 4.381 0.004 1 71 15 11 ALA HB H 1.452 0.017 1 72 15 11 ALA C C 178.378 . 1 73 15 11 ALA CA C 52.406 0.004 1 74 15 11 ALA CB C 18.903 0.013 1 75 15 11 ALA N N 124.558 0.004 1 76 16 12 GLY H H 8.401 0.005 1 77 16 12 GLY HA2 H 4.052 . 2 78 16 12 GLY HA3 H 4.004 . 2 79 16 12 GLY C C 174.968 0.001 1 80 16 12 GLY CA C 45.063 0.009 1 81 16 12 GLY N N 107.563 0.016 1 82 17 13 GLY H H 8.263 0.004 1 83 17 13 GLY HA2 H 4.072 . 2 84 17 13 GLY HA3 H 4.021 . 2 85 17 13 GLY C C 174.877 0.001 1 86 17 13 GLY CA C 44.958 0.001 1 87 17 13 GLY N N 108.445 0.003 1 88 18 14 GLY H H 8.411 0.003 1 89 18 14 GLY HA2 H 4.093 . 2 90 18 14 GLY HA3 H 4.051 . 2 91 18 14 GLY C C 174.354 . 1 92 18 14 GLY CA C 44.901 0.022 1 93 18 14 GLY N N 108.770 0.008 1 94 19 15 SER H H 8.365 0.005 1 95 19 15 SER HA H 4.493 0.013 1 96 19 15 SER HB2 H 3.910 0.011 2 97 19 15 SER HB3 H 3.808 . 2 98 19 15 SER C C 175.212 0.001 1 99 19 15 SER CA C 58.194 0.048 1 100 19 15 SER CB C 63.638 0.008 1 101 19 15 SER N N 115.273 0.011 1 102 20 16 GLY H H 8.515 0.004 1 103 20 16 GLY HA2 H 4.079 . 2 104 20 16 GLY HA3 H 3.973 . 2 105 20 16 GLY C C 174.950 0.005 1 106 20 16 GLY CA C 45.342 0.01 1 107 20 16 GLY N N 110.641 0.01 1 108 21 17 TRP H H 8.470 0.004 1 109 21 17 TRP HA H 4.559 . 1 110 21 17 TRP HB2 H 3.366 0.04 2 111 21 17 TRP HB3 H 3.195 . 2 112 21 17 TRP HD1 H 7.408 . 1 113 21 17 TRP HE1 H 10.635 . 1 114 21 17 TRP HZ2 H 7.371 . 1 115 21 17 TRP C C 176.720 0.01 1 116 21 17 TRP CA C 58.473 0.005 1 117 21 17 TRP CB C 28.961 0.006 1 118 21 17 TRP N N 121.655 0.003 1 119 22 18 LEU H H 8.158 0.036 1 120 22 18 LEU HA H 4.115 . 1 121 22 18 LEU HB2 H 1.553 . 2 122 22 18 LEU HB3 H 1.441 . 2 123 22 18 LEU HG H 1.293 . 1 124 22 18 LEU HD1 H 0.697 0.071 1 125 22 18 LEU HD2 H 0.767 0.001 1 126 22 18 LEU C C 177.419 0.003 1 127 22 18 LEU CA C 55.793 0.226 1 128 22 18 LEU CB C 41.505 0.088 1 129 22 18 LEU CG C 26.543 . 1 130 22 18 LEU CD1 C 23.714 0.055 1 131 22 18 LEU CD2 C 24.663 0.012 1 132 22 18 LEU N N 118.878 0.36 1 133 23 19 THR H H 7.747 0.026 1 134 23 19 THR HA H 4.057 . 1 135 23 19 THR HB H 4.231 . 1 136 23 19 THR HG2 H 1.254 . 1 137 23 19 THR C C 175.755 . 1 138 23 19 THR CA C 63.781 0.019 1 139 23 19 THR CB C 68.894 0.058 1 140 23 19 THR N N 111.294 0.383 1 141 24 20 GLY H H 8.351 . 1 142 24 20 GLY HA2 H 3.955 . 2 143 24 20 GLY HA3 H 3.818 . 2 144 24 20 GLY C C 174.084 0.003 1 145 24 20 GLY CA C 45.503 0.001 1 146 24 20 GLY N N 109.671 0.034 1 147 25 21 TRP H H 7.835 0.003 1 148 25 21 TRP HA H 4.574 . 1 149 25 21 TRP HB2 H 3.359 . 2 150 25 21 TRP HB3 H 3.228 . 2 151 25 21 TRP HD1 H 7.170 . 1 152 25 21 TRP HE1 H 10.184 . 1 153 25 21 TRP HZ2 H 7.381 . 1 154 25 21 TRP C C 175.364 0.014 1 155 25 21 TRP CA C 57.410 0.031 1 156 25 21 TRP CB C 30.052 0.032 1 157 25 21 TRP N N 119.612 0.033 1 158 26 22 LEU H H 7.470 0.03 1 159 26 22 LEU HA H 4.197 . 1 160 26 22 LEU HB2 H 1.472 . 2 161 26 22 LEU HB3 H 1.515 . 2 162 26 22 LEU HG H 1.262 . 1 163 26 22 LEU HD1 H 0.765 . 2 164 26 22 LEU HD2 H 0.699 . 1 165 26 22 LEU C C 174.672 . 1 166 26 22 LEU CA C 52.103 . 1 167 26 22 LEU CB C 41.671 . 1 168 26 22 LEU N N 119.606 0.484 1 169 27 23 PRO HA H 4.321 . 1 170 27 23 PRO HB2 H 1.728 . 1 171 27 23 PRO HB3 H 1.728 . 1 172 27 23 PRO HG2 H 1.369 . 1 173 27 23 PRO HG3 H 1.369 . 1 174 27 23 PRO HD2 H 3.588 . 1 175 27 23 PRO HD3 H 3.588 . 1 176 27 23 PRO C C 176.235 . 1 177 27 23 PRO CA C 62.766 0.096 1 178 27 23 PRO CB C 31.238 . 1 179 28 24 THR H H 7.941 0.001 1 180 28 24 THR HA H 4.241 . 1 181 28 24 THR HB H 4.170 . 1 182 28 24 THR HG2 H 1.226 . 1 183 28 24 THR C C 174.484 . 1 184 28 24 THR CA C 62.015 0.117 1 185 28 24 THR CB C 69.059 0.052 1 186 28 24 THR N N 111.325 0.007 1 187 29 25 TRP H H 7.854 0.008 1 188 29 25 TRP HA H 4.363 . 1 189 29 25 TRP HB2 H 3.412 . 2 190 29 25 TRP HB3 H 3.316 . 2 191 29 25 TRP HD1 H 7.287 . 1 192 29 25 TRP HE1 H 10.716 . 1 193 29 25 TRP HZ2 H 7.392 . 1 194 29 25 TRP C C 175.333 0.001 1 195 29 25 TRP CA C 56.999 0.001 1 196 29 25 TRP CB C 29.825 0.008 1 197 29 25 TRP N N 121.829 0.005 1 198 30 26 CYS H H 8.095 0.004 1 199 30 26 CYS HA H 4.463 . 1 200 30 26 CYS HB2 H 2.713 . 2 201 30 26 CYS HB3 H 2.275 . 2 202 30 26 CYS C C 172.496 . 1 203 30 26 CYS N N 118.755 0.063 1 204 31 27 PRO HA H 4.492 . 1 205 31 27 PRO HB2 H 1.982 0.016 2 206 31 27 PRO HB3 H 2.307 0.01 2 207 31 27 PRO HG2 H 2.093 . 2 208 31 27 PRO HG3 H 1.937 . 2 209 31 27 PRO HD2 H 3.696 . 2 210 31 27 PRO HD3 H 3.736 . 2 211 31 27 PRO C C 176.934 . 1 212 31 27 PRO CA C 62.956 0.025 1 213 31 27 PRO CB C 31.581 0.0 1 214 31 27 PRO CG C 26.963 . 1 215 32 28 THR H H 8.218 0.004 1 216 32 28 THR HA H 4.298 . 1 217 32 28 THR HB H 4.398 . 1 218 32 28 THR HG2 H 1.258 . 1 219 32 28 THR C C 174.777 0.005 1 220 32 28 THR CA C 61.415 . 1 221 32 28 THR CB C 69.568 0.019 1 222 32 28 THR CG2 C 21.585 . 1 223 32 28 THR N N 113.528 0.005 1 224 33 29 SER H H 8.291 0.003 1 225 33 29 SER HA H 4.579 . 1 226 33 29 SER HB2 H 3.966 . 2 227 33 29 SER HB3 H 3.908 . 2 228 33 29 SER C C 174.829 0.002 1 229 33 29 SER CA C 57.896 0.059 1 230 33 29 SER CB C 63.639 0.016 1 231 33 29 SER N N 117.608 0.01 1 232 34 30 THR H H 8.208 0.002 1 233 34 30 THR HA H 4.320 . 1 234 34 30 THR HB H 4.425 . 1 235 34 30 THR HG2 H 1.230 . 1 236 34 30 THR C C 174.741 0.004 1 237 34 30 THR CA C 61.508 0.084 1 238 34 30 THR CB C 69.262 0.109 1 239 34 30 THR CG2 C 21.292 . 1 240 34 30 THR N N 115.134 0.005 1 241 35 31 SER H H 8.223 0.005 1 242 35 31 SER HA H 4.269 . 1 243 35 31 SER HB2 H 3.736 . 1 244 35 31 SER C C 174.768 . 1 245 35 31 SER CA C 58.407 . 1 246 35 31 SER CB C 63.538 . 1 247 35 31 SER N N 117.691 0.011 1 248 36 32 HIS H H 8.357 . 1 249 36 32 HIS HA H 4.746 . 1 250 36 32 HIS HB2 H 3.295 . 2 251 36 32 HIS HB3 H 3.173 . 2 252 36 32 HIS C C 174.693 . 1 253 36 32 HIS CA C 55.423 . 1 254 36 32 HIS CB C 29.382 . 1 255 37 33 LEU H H 8.111 0.021 1 256 37 33 LEU HA H 4.355 . 1 257 37 33 LEU HB2 H 1.662 . 2 258 37 33 LEU HB3 H 1.606 . 2 259 37 33 LEU HG H 1.552 . 1 260 37 33 LEU HD1 H 0.954 . 2 261 37 33 LEU HD2 H 0.899 . 2 262 37 33 LEU C C 177.088 0.005 1 263 37 33 LEU CA C 54.856 0.02 1 264 37 33 LEU CB C 41.981 0.131 1 265 37 33 LEU CG C 26.405 . 1 266 37 33 LEU CD1 C 24.488 . 2 267 37 33 LEU CD2 C 22.988 . 2 268 37 33 LEU N N 123.020 0.0 1 269 38 34 LYS H H 8.248 0.014 1 270 38 34 LYS HA H 4.351 0.004 1 271 38 34 LYS HB2 H 1.858 0.007 2 272 38 34 LYS HB3 H 1.802 0.006 2 273 38 34 LYS HG2 H 1.504 . 2 274 38 34 LYS HG3 H 1.459 0.005 2 275 38 34 LYS HD2 H 1.720 0.001 2 276 38 34 LYS HD3 H 1.756 . 2 277 38 34 LYS HE2 H 3.033 0.009 1 278 38 34 LYS C C 176.563 0.008 1 279 38 34 LYS CA C 55.971 0.005 1 280 38 34 LYS CB C 32.642 0.122 1 281 38 34 LYS CG C 24.285 . 1 282 38 34 LYS CD C 28.565 0.0 1 283 38 34 LYS CE C 41.489 . 1 284 38 34 LYS N N 121.958 0.0 1 285 39 35 GLU H H 8.449 0.007 1 286 39 35 GLU HA H 4.267 0.015 1 287 39 35 GLU HB2 H 2.109 0.0 2 288 39 35 GLU HB3 H 1.982 0.002 2 289 39 35 GLU HG2 H 2.328 0.003 2 290 39 35 GLU HG3 H 1.998 . 2 291 39 35 GLU C C 176.271 0.0 1 292 39 35 GLU CA C 56.333 0.004 1 293 39 35 GLU CB C 29.979 0.029 1 294 39 35 GLU CG C 35.588 . 1 295 39 35 GLU N N 122.104 0.0 1 296 40 36 ALA H H 8.239 0.007 1 297 40 36 ALA HA H 4.349 . 1 298 40 36 ALA HB H 1.451 . 1 299 40 36 ALA C C 177.535 0.002 1 300 40 36 ALA CA C 52.133 0.002 1 301 40 36 ALA CB C 19.006 0.152 1 302 40 36 ALA N N 124.046 . 1 303 41 37 GLU H H 8.248 0.005 1 304 41 37 GLU HA H 4.325 0.007 1 305 41 37 GLU HB2 H 2.104 0.005 2 306 41 37 GLU HB3 H 1.982 0.005 2 307 41 37 GLU HG2 H 2.347 0.004 2 308 41 37 GLU HG3 H 2.281 0.01 2 309 41 37 GLU C C 176.315 0.001 1 310 41 37 GLU CA C 56.038 0.016 1 311 41 37 GLU CB C 30.289 0.017 1 312 41 37 GLU CG C 35.689 . 1 313 41 37 GLU N N 119.561 0.0 1 314 42 38 GLU H H 8.313 0.005 1 315 42 38 GLU HA H 4.366 . 1 316 42 38 GLU HB2 H 2.107 . 2 317 42 38 GLU HB3 H 1.986 . 2 318 42 38 GLU HG2 H 2.318 0.033 1 319 42 38 GLU C C 175.311 0.0 1 320 42 38 GLU CA C 56.110 0.003 1 321 42 38 GLU CB C 30.088 0.008 1 322 42 38 GLU CG C 35.531 . 1 323 42 38 GLU N N 122.451 0.0 1 324 43 39 LYS H H 7.917 0.007 1 325 43 39 LYS HA H 4.198 0.002 1 326 43 39 LYS HB2 H 1.860 0.001 2 327 43 39 LYS HB3 H 1.725 0.019 2 328 43 39 LYS HG2 H 1.414 0.001 2 329 43 39 LYS HG3 H 1.463 0.0 2 330 43 39 LYS HD2 H 1.574 0.002 1 331 43 39 LYS HE2 H 3.015 . 1 332 43 39 LYS C C 181.185 . 1 333 43 39 LYS CA C 56.963 0.057 1 334 43 39 LYS CB C 33.307 0.093 1 335 43 39 LYS CG C 24.133 . 1 336 43 39 LYS N N 127.711 . 1 stop_ save_ save_peak_list_1 _Saveframe_category spectral_peak_list _Details 'Default list' _Experiment_label '3D 1H-15N NOESY' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H 3 N 15N stop_ _Sample_label $wr10_43_1 _Sample_conditions_label $1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 1 >> _Spectral_peak_list.Sample_ID 1 >> _Spectral_peak_list.Sample_label $wr10_43_1 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $1 >> _Spectral_peak_list.Experiment_ID 4 >> _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _Spectral_peak_list.Details 'Default list' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 5580.35693359 Hz . . . 25684 1 >> 2 H 1 1H . . 8396.57910156 Hz . . . 25684 1 >> 3 N 15 15N . . 1772.50000000 Hz . . . 25684 1 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 . 25684 1 >> 10 1.0 . 25684 1 >> 100 1.0 . 25684 1 >> 101 1.0 . 25684 1 >> 102 1.0 . 25684 1 >> 103 1.0 . 25684 1 >> 104 1.0 . 25684 1 >> 105 1.0 . 25684 1 >> 106 1.0 . 25684 1 >> 107 1.0 . 25684 1 >> 108 1.0 . 25684 1 >> 109 1.0 . 25684 1 >> 11 1.0 . 25684 1 >> 110 1.0 . 25684 1 >> 111 1.0 . 25684 1 >> 112 1.0 . 25684 1 >> 113 1.0 . 25684 1 >> 114 1.0 . 25684 1 >> 115 1.0 . 25684 1 >> 116 1.0 . 25684 1 >> 117 1.0 . 25684 1 >> 118 1.0 . 25684 1 >> 119 1.0 . 25684 1 >> 12 1.0 . 25684 1 >> 120 1.0 . 25684 1 >> 121 1.0 . 25684 1 >> 122 1.0 . 25684 1 >> 123 1.0 . 25684 1 >> 124 1.0 . 25684 1 >> 125 1.0 . 25684 1 >> 126 1.0 . 25684 1 >> 127 1.0 . 25684 1 >> 128 1.0 . 25684 1 >> 129 1.0 . 25684 1 >> 13 1.0 . 25684 1 >> 130 1.0 . 25684 1 >> 131 1.0 . 25684 1 >> 132 1.0 . 25684 1 >> 133 1.0 . 25684 1 >> 134 1.0 . 25684 1 >> 135 1.0 . 25684 1 >> 136 1.0 . 25684 1 >> 137 1.0 . 25684 1 >> 138 1.0 . 25684 1 >> 139 1.0 . 25684 1 >> 14 1.0 . 25684 1 >> 140 1.0 . 25684 1 >> 141 1.0 . 25684 1 >> 142 1.0 . 25684 1 >> 143 1.0 . 25684 1 >> 144 1.0 . 25684 1 >> 145 1.0 . 25684 1 >> 146 1.0 . 25684 1 >> 147 1.0 . 25684 1 >> 148 1.0 . 25684 1 >> 149 1.0 . 25684 1 >> 15 1.0 . 25684 1 >> 150 1.0 . 25684 1 >> 151 1.0 . 25684 1 >> 152 1.0 . 25684 1 >> 153 1.0 . 25684 1 >> 154 1.0 . 25684 1 >> 155 1.0 . 25684 1 >> 156 1.0 . 25684 1 >> 157 1.0 . 25684 1 >> 158 1.0 . 25684 1 >> 159 1.0 . 25684 1 >> 16 1.0 . 25684 1 >> 160 1.0 . 25684 1 >> 161 1.0 . 25684 1 >> 162 1.0 . 25684 1 >> 163 1.0 . 25684 1 >> 164 1.0 . 25684 1 >> 165 1.0 . 25684 1 >> 166 1.0 . 25684 1 >> 167 1.0 . 25684 1 >> 168 1.0 . 25684 1 >> 169 1.0 . 25684 1 >> 17 1.0 . 25684 1 >> 170 1.0 . 25684 1 >> 171 1.0 . 25684 1 >> 172 1.0 . 25684 1 >> 173 1.0 . 25684 1 >> 174 1.0 . 25684 1 >> 175 1.0 . 25684 1 >> 176 1.0 . 25684 1 >> 177 1.0 . 25684 1 >> 178 1.0 . 25684 1 >> 179 1.0 . 25684 1 >> 18 1.0 . 25684 1 >> 180 1.0 . 25684 1 >> 181 1.0 . 25684 1 >> 182 1.0 . 25684 1 >> 183 1.0 . 25684 1 >> 184 1.0 . 25684 1 >> 185 1.0 . 25684 1 >> 186 1.0 . 25684 1 >> 187 1.0 . 25684 1 >> 188 1.0 . 25684 1 >> 189 1.0 . 25684 1 >> 19 1.0 . 25684 1 >> 190 1.0 . 25684 1 >> 191 1.0 . 25684 1 >> 192 1.0 . 25684 1 >> 193 1.0 . 25684 1 >> 194 1.0 . 25684 1 >> 195 1.0 . 25684 1 >> 196 1.0 . 25684 1 >> 197 1.0 . 25684 1 >> 198 1.0 . 25684 1 >> 199 1.0 . 25684 1 >> 2 1.0 . 25684 1 >> 20 1.0 . 25684 1 >> 200 1.0 . 25684 1 >> 201 1.0 . 25684 1 >> 202 1.0 . 25684 1 >> 203 1.0 . 25684 1 >> 204 1.0 . 25684 1 >> 205 1.0 . 25684 1 >> 206 1.0 . 25684 1 >> 207 1.0 . 25684 1 >> 208 1.0 . 25684 1 >> 209 1.0 . 25684 1 >> 21 1.0 . 25684 1 >> 210 1.0 . 25684 1 >> 211 1.0 . 25684 1 >> 212 1.0 . 25684 1 >> 213 1.0 . 25684 1 >> 214 1.0 . 25684 1 >> 215 1.0 . 25684 1 >> 216 1.0 . 25684 1 >> 217 1.0 . 25684 1 >> 218 1.0 . 25684 1 >> 219 1.0 . 25684 1 >> 22 1.0 . 25684 1 >> 220 1.0 . 25684 1 >> 221 1.0 . 25684 1 >> 222 1.0 . 25684 1 >> 223 1.0 . 25684 1 >> 224 1.0 . 25684 1 >> 225 1.0 . 25684 1 >> 226 1.0 . 25684 1 >> 227 1.0 . 25684 1 >> 228 1.0 . 25684 1 >> 229 1.0 . 25684 1 >> 23 1.0 . 25684 1 >> 230 1.0 . 25684 1 >> 231 1.0 . 25684 1 >> 232 1.0 . 25684 1 >> 233 1.0 . 25684 1 >> 234 1.0 . 25684 1 >> 235 1.0 . 25684 1 >> 236 1.0 . 25684 1 >> 237 1.0 . 25684 1 >> 238 1.0 . 25684 1 >> 239 1.0 . 25684 1 >> 24 1.0 . 25684 1 >> 240 1.0 . 25684 1 >> 241 1.0 . 25684 1 >> 242 1.0 . 25684 1 >> 243 1.0 . 25684 1 >> 244 1.0 . 25684 1 >> 245 1.0 . 25684 1 >> 246 1.0 . 25684 1 >> 247 1.0 . 25684 1 >> 248 1.0 . 25684 1 >> 249 1.0 . 25684 1 >> 25 1.0 . 25684 1 >> 250 1.0 . 25684 1 >> 251 1.0 . 25684 1 >> 252 1.0 . 25684 1 >> 253 1.0 . 25684 1 >> 254 1.0 . 25684 1 >> 255 1.0 . 25684 1 >> 256 1.0 . 25684 1 >> 257 1.0 . 25684 1 >> 258 1.0 . 25684 1 >> 259 1.0 . 25684 1 >> 26 1.0 . 25684 1 >> 260 1.0 . 25684 1 >> 261 1.0 . 25684 1 >> 262 1.0 . 25684 1 >> 263 1.0 . 25684 1 >> 264 1.0 . 25684 1 >> 265 1.0 . 25684 1 >> 266 1.0 . 25684 1 >> 267 1.0 . 25684 1 >> 268 1.0 . 25684 1 >> 269 1.0 . 25684 1 >> 27 1.0 . 25684 1 >> 270 1.0 . 25684 1 >> 271 1.0 . 25684 1 >> 272 1.0 . 25684 1 >> 273 1.0 . 25684 1 >> 274 1.0 . 25684 1 >> 275 1.0 . 25684 1 >> 276 1.0 . 25684 1 >> 277 1.0 . 25684 1 >> 278 1.0 . 25684 1 >> 279 1.0 . 25684 1 >> 28 1.0 . 25684 1 >> 280 1.0 . 25684 1 >> 281 1.0 . 25684 1 >> 282 1.0 . 25684 1 >> 283 1.0 . 25684 1 >> 284 1.0 . 25684 1 >> 285 1.0 . 25684 1 >> 286 1.0 . 25684 1 >> 287 1.0 . 25684 1 >> 288 1.0 . 25684 1 >> 289 1.0 . 25684 1 >> 29 1.0 . 25684 1 >> 290 1.0 . 25684 1 >> 291 1.0 . 25684 1 >> 292 1.0 . 25684 1 >> 293 1.0 . 25684 1 >> 294 1.0 . 25684 1 >> 295 1.0 . 25684 1 >> 296 1.0 . 25684 1 >> 297 1.0 . 25684 1 >> 298 1.0 . 25684 1 >> 299 1.0 . 25684 1 >> 3 1.0 . 25684 1 >> 30 1.0 . 25684 1 >> 31 1.0 . 25684 1 >> 32 1.0 . 25684 1 >> 33 1.0 . 25684 1 >> 34 1.0 . 25684 1 >> 35 1.0 . 25684 1 >> 36 1.0 . 25684 1 >> 37 1.0 . 25684 1 >> 38 1.0 . 25684 1 >> 39 1.0 . 25684 1 >> 4 1.0 . 25684 1 >> 40 1.0 . 25684 1 >> 41 1.0 . 25684 1 >> 42 1.0 . 25684 1 >> 43 1.0 . 25684 1 >> 44 1.0 . 25684 1 >> 45 1.0 . 25684 1 >> 46 1.0 . 25684 1 >> 47 1.0 . 25684 1 >> 48 1.0 . 25684 1 >> 49 1.0 . 25684 1 >> 5 1.0 . 25684 1 >> 50 1.0 . 25684 1 >> 51 1.0 . 25684 1 >> 52 1.0 . 25684 1 >> 53 1.0 . 25684 1 >> 54 1.0 . 25684 1 >> 55 1.0 . 25684 1 >> 56 1.0 . 25684 1 >> 57 1.0 . 25684 1 >> 58 1.0 . 25684 1 >> 59 1.0 . 25684 1 >> 6 1.0 . 25684 1 >> 60 1.0 . 25684 1 >> 61 1.0 . 25684 1 >> 62 1.0 . 25684 1 >> 63 1.0 . 25684 1 >> 64 1.0 . 25684 1 >> 65 1.0 . 25684 1 >> 66 1.0 . 25684 1 >> 67 1.0 . 25684 1 >> 68 1.0 . 25684 1 >> 69 1.0 . 25684 1 >> 7 1.0 . 25684 1 >> 70 1.0 . 25684 1 >> 71 1.0 . 25684 1 >> 72 1.0 . 25684 1 >> 73 1.0 . 25684 1 >> 74 1.0 . 25684 1 >> 75 1.0 . 25684 1 >> 76 1.0 . 25684 1 >> 77 1.0 . 25684 1 >> 78 1.0 . 25684 1 >> 79 1.0 . 25684 1 >> 8 1.0 . 25684 1 >> 80 1.0 . 25684 1 >> 81 1.0 . 25684 1 >> 82 1.0 . 25684 1 >> 83 1.0 . 25684 1 >> 84 1.0 . 25684 1 >> 85 1.0 . 25684 1 >> 86 1.0 . 25684 1 >> 87 1.0 . 25684 1 >> 88 1.0 . 25684 1 >> 89 1.0 . 25684 1 >> 9 1.0 . 25684 1 >> 90 1.0 . 25684 1 >> 91 1.0 . 25684 1 >> 92 1.0 . 25684 1 >> 93 1.0 . 25684 1 >> 94 1.0 . 25684 1 >> 95 1.0 . 25684 1 >> 96 1.0 . 25684 1 >> 97 1.0 . 25684 1 >> 98 1.0 . 25684 1 >> 99 1.0 . 25684 1 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 36210.26562500 . height 25684 1 >> 1 666443.85058600 . volume 25684 1 >> 2 359584.62500000 . height 25684 1 >> 2 4349338.61328000 . volume 25684 1 >> 3 343309.65625000 . height 25684 1 >> 3 4339926.32422000 . volume 25684 1 >> 4 55739.60937500 . height 25684 1 >> 4 797302.52246100 . volume 25684 1 >> 5 43344.40625000 . height 25684 1 >> 5 710623.03710900 . volume 25684 1 >> 6 71423.64843750 . height 25684 1 >> 6 941444.14941400 . volume 25684 1 >> 7 209752.00000000 . height 25684 1 >> 7 2939179.57812000 . volume 25684 1 >> 8 100584.89062500 . height 25684 1 >> 8 1303308.89062000 . volume 25684 1 >> 9 17487194.00000000 . height 25684 1 >> 9 216950614.75000000 . volume 25684 1 >> 10 168817.04687500 . height 25684 1 >> 10 2386220.99609000 . volume 25684 1 >> 11 616313.00000000 . height 25684 1 >> 11 8388936.45312000 . volume 25684 1 >> 12 584472.31250000 . height 25684 1 >> 12 8974946.17188000 . volume 25684 1 >> 13 69788.17187500 . height 25684 1 >> 13 982132.50976600 . volume 25684 1 >> 14 44775.07421880 . height 25684 1 >> 14 690850.73144500 . volume 25684 1 >> 15 81650.29687500 . height 25684 1 >> 15 1167180.16211000 . volume 25684 1 >> 16 26342.24218750 . height 25684 1 >> 16 245209.86035200 . volume 25684 1 >> 17 148599.60937500 . height 25684 1 >> 17 2015205.35742000 . volume 25684 1 >> 18 19084542.00000000 . height 25684 1 >> 18 219805001.75000000 . volume 25684 1 >> 19 178089.90625000 . height 25684 1 >> 19 2124226.55811000 . volume 25684 1 >> 20 1781812.00000000 . height 25684 1 >> 20 28333674.21880000 . volume 25684 1 >> 21 662403.25000000 . height 25684 1 >> 21 9831028.34375000 . volume 25684 1 >> 22 441308.56250000 . height 25684 1 >> 22 6520069.22656000 . volume 25684 1 >> 23 32922.85937500 . height 25684 1 >> 23 515449.91894500 . volume 25684 1 >> 24 815492.25000000 . height 25684 1 >> 24 12270136.16410000 . volume 25684 1 >> 25 585823.50000000 . height 25684 1 >> 25 9122242.53906000 . volume 25684 1 >> 26 410787.50000000 . height 25684 1 >> 26 6546467.29688000 . volume 25684 1 >> 27 612393.37500000 . height 25684 1 >> 27 9715599.85547000 . volume 25684 1 >> 28 503888.28125000 . height 25684 1 >> 28 9084325.10938000 . volume 25684 1 >> 29 35837272.00000000 . height 25684 1 >> 29 538386557.50000000 . volume 25684 1 >> 30 25189.16796880 . height 25684 1 >> 30 425783.36132800 . volume 25684 1 >> 31 21351.17968750 . height 25684 1 >> 31 347397.43139600 . volume 25684 1 >> 32 434500.37500000 . height 25684 1 >> 32 6268031.52734000 . volume 25684 1 >> 33 121513.29687500 . height 25684 1 >> 33 1623061.99609000 . volume 25684 1 >> 34 305055.53125000 . height 25684 1 >> 34 4489112.49805000 . volume 25684 1 >> 35 858136.43750000 . height 25684 1 >> 35 12118757.71090000 . volume 25684 1 >> 36 666504.43750000 . height 25684 1 >> 36 9098062.73438000 . volume 25684 1 >> 37 243919.10937500 . height 25684 1 >> 37 3322675.09766000 . volume 25684 1 >> 38 254255.96875000 . height 25684 1 >> 38 3326909.97656000 . volume 25684 1 >> 39 2203563.25000000 . height 25684 1 >> 39 30933691.46880000 . volume 25684 1 >> 40 409506.56250000 . height 25684 1 >> 40 5738075.81836000 . volume 25684 1 >> 41 650020.87500000 . height 25684 1 >> 41 10671837.13280000 . volume 25684 1 >> 42 678408.12500000 . height 25684 1 >> 42 11898121.09380000 . volume 25684 1 >> 43 48536572.00000000 . height 25684 1 >> 43 646865397.50000000 . volume 25684 1 >> 44 42969760.00000000 . height 25684 1 >> 44 532482317.00000000 . volume 25684 1 >> 45 1967671.62500000 . height 25684 1 >> 45 23908116.31250000 . volume 25684 1 >> 46 506576.21875000 . height 25684 1 >> 46 7269425.56250000 . volume 25684 1 >> 47 111281.75781200 . height 25684 1 >> 47 1330788.98828000 . volume 25684 1 >> 48 570987.12500000 . height 25684 1 >> 48 9144851.64844000 . volume 25684 1 >> 49 125763.40625000 . height 25684 1 >> 49 1464248.24268000 . volume 25684 1 >> 50 2159923.25000000 . height 25684 1 >> 50 26996081.12500000 . volume 25684 1 >> 51 99125.87500000 . height 25684 1 >> 51 1363171.32031000 . volume 25684 1 >> 52 120398.87500000 . height 25684 1 >> 52 1640559.74219000 . volume 25684 1 >> 53 192628.04687500 . height 25684 1 >> 53 2807038.20312000 . volume 25684 1 >> 54 280150.62500000 . height 25684 1 >> 54 3963742.75781000 . volume 25684 1 >> 55 943613.87500000 . height 25684 1 >> 55 11515026.25780000 . volume 25684 1 >> 56 1947412.00000000 . height 25684 1 >> 56 24467809.18750000 . volume 25684 1 >> 57 1296627.50000000 . height 25684 1 >> 57 17392278.40620000 . volume 25684 1 >> 58 47190512.00000000 . height 25684 1 >> 58 572905272.75000000 . volume 25684 1 >> 59 693591.37500000 . height 25684 1 >> 59 11496479.64060000 . volume 25684 1 >> 60 57761912.00000000 . height 25684 1 >> 60 758600692.50000000 . volume 25684 1 >> 61 759706.43750000 . height 25684 1 >> 61 12461002.82030000 . volume 25684 1 >> 62 1432430.00000000 . height 25684 1 >> 62 21936555.75780000 . volume 25684 1 >> 63 717386.68750000 . height 25684 1 >> 63 11321030.11330000 . volume 25684 1 >> 64 944680.87500000 . height 25684 1 >> 64 15130120.85160000 . volume 25684 1 >> 65 637005.56250000 . height 25684 1 >> 65 9701402.63672000 . volume 25684 1 >> 66 1231160.50000000 . height 25684 1 >> 66 15958497.78120000 . volume 25684 1 >> 67 51087432.00000000 . height 25684 1 >> 67 707322733.12500000 . volume 25684 1 >> 68 2219208.00000000 . height 25684 1 >> 68 28812853.87500000 . volume 25684 1 >> 69 1050136.12500000 . height 25684 1 >> 69 14056843.60940000 . volume 25684 1 >> 70 216869.75000000 . height 25684 1 >> 70 2945270.88281000 . volume 25684 1 >> 71 283029.59375000 . height 25684 1 >> 71 4085020.64453000 . volume 25684 1 >> 72 375639.87500000 . height 25684 1 >> 72 5385441.64844000 . volume 25684 1 >> 73 2874895.75000000 . height 25684 1 >> 73 33314939.62500000 . volume 25684 1 >> 74 1050368.00000000 . height 25684 1 >> 74 17770273.87500000 . volume 25684 1 >> 75 39548388.00000000 . height 25684 1 >> 75 525325829.25000000 . volume 25684 1 >> 76 1045869.93750000 . height 25684 1 >> 76 15796929.57810000 . volume 25684 1 >> 77 3480227.00000000 . height 25684 1 >> 77 49344548.65620000 . volume 25684 1 >> 78 69739.93750000 . height 25684 1 >> 78 1187355.59766000 . volume 25684 1 >> 79 54103.12109380 . height 25684 1 >> 79 880847.30273400 . volume 25684 1 >> 80 500771.03125000 . height 25684 1 >> 80 7316529.70312000 . volume 25684 1 >> 81 235862.06250000 . height 25684 1 >> 81 3347318.62109000 . volume 25684 1 >> 82 28065.09570310 . height 25684 1 >> 82 445911.83337400 . volume 25684 1 >> 83 42431.58984380 . height 25684 1 >> 83 675798.35351600 . volume 25684 1 >> 84 6649294.50000000 . height 25684 1 >> 84 82073719.37500000 . volume 25684 1 >> 85 32178744.00000000 . height 25684 1 >> 85 423402303.00000000 . volume 25684 1 >> 86 1262232.12500000 . height 25684 1 >> 86 19339312.35940000 . volume 25684 1 >> 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25684 1 >> 2 1 8.560 . 16.8785579559 . . . . . . . . . . 2 25684 1 >> 2 2 4.459 . 40.8352660318 . . . . . . . . . . 2 25684 1 >> 2 3 119.619 . 20.4703840613 . . . . . . . . . . 2 25684 1 >> 3 1 8.560 . 17.0026234228 . . . . . . . . . . 2 25684 1 >> 3 2 4.364 . 44.6368750029 . . . . . . . . . . 2 25684 1 >> 3 3 119.619 . 20.4836254319 . . . . . . . . . . 2 25684 1 >> 4 1 8.560 . 18.1135581666 . . . . . . . . . . 2 25684 1 >> 4 2 2.622 . 90.6035123856 . . . . . . . . . . 2 25684 1 >> 4 3 119.619 . 20.2923298876 . . . . . . . . . . 2 25684 1 >> 5 1 8.560 . 17.4436711684 . . . . . . . . . . 2 25684 1 >> 5 2 2.557 . 97.5591155294 . . . . . . . . . . 2 25684 1 >> 5 3 119.619 . 24.6682506800 . . . . . . . . . . 2 25684 1 >> 6 1 8.560 . 15.9645314063 . . . . . . . . . . 2 25684 1 >> 6 2 2.131 . 125.7593868160 . . . . . . . . . . 2 25684 1 >> 6 3 119.619 . 22.6738748948 . . . . . . . . . . 2 25684 1 >> 7 1 8.560 . 17.0548440081 . . . . . . . . . . 2 25684 1 >> 7 2 2.030 . 56.0016639070 . . . . . . . . . . 2 25684 1 >> 7 3 119.619 . 21.1788678169 . . . . . . . . . . 2 25684 1 >> 8 1 8.560 . 17.4746043813 . . . . . . . . . . 2 25684 1 >> 8 2 1.401 . 43.2545627362 . . . . . . . . . . 2 25684 1 >> 8 3 119.619 . 20.1964003841 . . . . . . . . . . 2 25684 1 >> 9 1 8.413 . 19.1286997349 . . . . . . . . . . 2 25684 1 >> 9 2 8.413 . 36.0656130702 . . . . . . . . . . 2 25684 1 >> 9 3 110.213 . 21.1087167263 . . . . . . . . . . 2 25684 1 >> 10 1 8.413 . 17.6159658383 . . . . . . . . . . 2 25684 1 >> 10 2 8.155 . 44.6623992338 . . . . . . . . . . 2 25684 1 >> 10 3 110.213 . 22.4014407396 . . . . . . . . . . 2 25684 1 >> 11 1 8.413 . 17.5883587773 . . . . . . . . . . 2 25684 1 >> 11 2 4.461 . 42.8336631648 . . . . . . . . . . 2 25684 1 >> 11 3 110.213 . 21.9830697775 . . . . . . . . . . 2 25684 1 >> 12 1 8.413 . 18.6054960367 . . . . . . . . . . 2 25684 1 >> 12 2 3.992 . 61.6515274766 . . . . . . . . . . 2 25684 1 >> 12 3 110.213 . 20.6418879827 . . . . . . . . . . 2 25684 1 >> 13 1 8.413 . 15.5191596632 . . . . . . . . . . 2 25684 1 >> 13 2 2.123 . 57.5691519662 . . . . . . . . . . 2 25684 1 >> 13 3 110.213 . 21.7905064424 . . . . . . . . . . 2 25684 1 >> 14 1 8.413 . 18.4245533718 . . . . . . . . . . 2 25684 1 >> 14 2 2.030 . 119.9538754860 . . . . . . . . . . 2 25684 1 >> 14 3 110.213 . 24.1036611795 . . . . . . . . . . 2 25684 1 >> 15 1 8.413 . 19.5404773435 . . . . . . . . . . 2 25684 1 >> 15 2 1.263 . 43.9201946387 . . . . . . . . . . 2 25684 1 >> 15 3 110.213 . 22.3776344458 . . . . . . . . . . 2 25684 1 >> 16 1 8.413 . 16.1411500736 . . . . . . . . . . 2 25684 1 >> 16 2 0.944 . 34.7389786600 . . . . . . . . . . 2 25684 1 >> 16 3 110.213 . 21.2984627485 . . . . . . . . . . 2 25684 1 >> 17 1 8.155 . 17.0059495748 . . . . . . . . . . 2 25684 1 >> 17 2 8.413 . 48.7825606154 . . . . . . . . . . 2 25684 1 >> 17 3 115.680 . 20.8008548617 . . . . . . . . . . 2 25684 1 >> 18 1 8.155 . 18.0037951530 . . . . . . . . . . 2 25684 1 >> 18 2 8.155 . 35.7373013950 . . . . . . . . . . 2 25684 1 >> 18 3 115.680 . 19.7471798460 . . . . . . . . . . 2 25684 1 >> 19 1 8.155 . 17.1469784165 . . . . . . . . . . 2 25684 1 >> 19 2 4.510 . 31.1851048706 . . . . . . . . . . 2 25684 1 >> 19 3 115.680 . 24.6896622578 . . . . . . . . . . 2 25684 1 >> 20 1 8.218 . 19.6944781777 . . . . . . . . . . 2 25684 1 >> 20 2 4.510 . 46.1558169760 . . . . . . . . . . 2 25684 1 >> 20 3 120.988 . 23.7603716056 . . . . . . . . . . 2 25684 1 >> 21 1 8.155 . 18.4737804203 . . . . . . . . . . 2 25684 1 >> 21 2 3.992 . 61.8166842645 . . . . . . . . . . 2 25684 1 >> 21 3 115.680 . 20.9049545725 . . . . . . . . . . 2 25684 1 >> 22 1 8.155 . 18.1637830607 . . . . . . . . . . 2 25684 1 >> 22 2 3.875 . 144.9050623280 . . . . . . . . . . 2 25684 1 >> 22 3 115.680 . 21.8448805809 . . . . . . . . . . 2 25684 1 >> 23 1 8.155 . 15.7529881437 . . . . . . . . . . 2 25684 1 >> 23 2 0.944 . 59.2112108174 . . . . . . . . . . 2 25684 1 >> 23 3 115.680 . 24.3538385630 . . . . . . . . . . 2 25684 1 >> 24 1 8.218 . 19.1030883650 . . . . . . . . . . 2 25684 1 >> 24 2 0.944 . 43.3511544333 . . . . . . . . . . 2 25684 1 >> 24 3 120.988 . 23.3703850706 . . . . . . . . . . 2 25684 1 >> 25 1 8.218 . 19.7294027730 . . . . . . . . . . 2 25684 1 >> 25 2 2.120 . 47.3914900341 . . . . . . . . . . 2 25684 1 >> 25 3 120.988 . 22.9042606552 . . . . . . . . . . 2 25684 1 >> 26 1 8.218 . 20.3354276542 . . . . . . . . . . 2 25684 1 >> 26 2 3.880 . 49.3063078229 . . . . . . . . . . 2 25684 1 >> 26 3 120.988 . 23.9268747966 . . . . . . . . . . 2 25684 1 >> 27 1 8.218 . 20.5167029342 . . . . . . . . . . 2 25684 1 >> 27 2 4.178 . 43.5883796377 . . . . . . . . . . 2 25684 1 >> 27 3 120.988 . 24.3527820706 . . . . . . . . . . 2 25684 1 >> 28 1 8.218 . 18.9963188882 . . . . . . . . . . 2 25684 1 >> 28 2 8.375 . 65.3631760458 . . . . . . . . . . 2 25684 1 >> 28 3 120.988 . 22.9516619444 . . . . . . . . . . 2 25684 1 >> 29 1 8.218 . 19.1183886639 . . . . . . . . . . 2 25684 1 >> 29 2 8.218 . 40.5077050693 . . . . . . . . . . 2 25684 1 >> 29 3 120.988 . 23.5555529594 . . . . . . . . . . 2 25684 1 >> 30 1 8.218 . 22.0969577149 . . . . . . . . . . 2 25684 1 >> 30 2 2.726 . 44.8380659990 . . . . . . . . . . 2 25684 1 >> 30 3 120.988 . 29.8342868686 . . . . . . . . . . 2 25684 1 >> 31 1 8.218 . 20.5572819877 . . . . . . . . . . 2 25684 1 >> 31 2 2.619 . 40.9758995391 . . . . . . . . . . 2 25684 1 >> 31 3 120.988 . 29.2148301999 . . . . . . . . . . 2 25684 1 >> 32 1 8.377 . 16.8566053532 . . . . . . . . . . 2 25684 1 >> 32 2 0.944 . 47.9630326151 . . . . . . . . . . 2 25684 1 >> 32 3 123.609 . 22.7218396465 . . . . . . . . . . 2 25684 1 >> 33 1 8.190 . 16.4158902228 . . . . . . . . . . 2 25684 1 >> 33 2 0.944 . 49.9499188203 . . . . . . . . . . 2 25684 1 >> 33 3 116.317 . 20.8917132020 . . . . . . . . . . 2 25684 1 >> 34 1 8.375 . 16.7724537094 . . . . . . . . . . 2 25684 1 >> 34 2 2.124 . 49.0465612384 . . . . . . . . . . 2 25684 1 >> 34 3 123.609 . 22.9151425262 . . . . . . . . . . 2 25684 1 >> 35 1 8.376 . 16.9826665113 . . . . . . . . . . 2 25684 1 >> 35 2 2.619 . 45.4606570417 . . . . . . . . . . 2 25684 1 >> 35 3 123.609 . 22.7147963643 . . . . . . . . . . 2 25684 1 >> 36 1 8.376 . 16.9377634602 . . . . . . . . . . 2 25684 1 >> 36 2 2.726 . 44.5047495727 . . . . . . . . . . 2 25684 1 >> 36 3 123.609 . 22.3339308798 . . . . . . . . . . 2 25684 1 >> 37 1 8.189 . 17.0358849421 . . . . . . . . . . 2 25684 1 >> 37 2 2.619 . 48.5335742458 . . . . . . . . . . 2 25684 1 >> 37 3 116.317 . 21.4100987713 . . . . . . . . . . 2 25684 1 >> 38 1 8.189 . 17.1077298237 . . . . . . . . . . 2 25684 1 >> 38 2 2.721 . 45.8510276311 . . . . . . . . . . 2 25684 1 >> 38 3 116.317 . 20.9634138147 . . . . . . . . . . 2 25684 1 >> 39 1 8.376 . 16.9377634602 . . . . . . . . . . 2 25684 1 >> 39 2 4.177 . 44.7039386683 . . . . . . . . . . 2 25684 1 >> 39 3 123.609 . 22.5820657114 . . . . . . . . . . 2 25684 1 >> 40 1 8.375 . 15.0046039600 . . . . . . . . . . 2 25684 1 >> 40 2 4.639 . 116.0176387090 . . . . . . . . . . 2 25684 1 >> 40 3 123.609 . 22.2467702627 . . . . . . . . . . 2 25684 1 >> 41 1 8.376 . 16.9361003843 . . . . . . . . . . 2 25684 1 >> 41 2 8.193 . 71.0114130713 . . . . . . . . . . 2 25684 1 >> 41 3 123.609 . 23.8298183680 . . . . . . . . . . 2 25684 1 >> 42 1 8.376 . 17.0102735723 . . . . . . . . . . 2 25684 1 >> 42 2 8.218 . 69.6016997920 . . . . . . . . . . 2 25684 1 >> 42 3 123.609 . 23.3559463422 . . . . . . . . . . 2 25684 1 >> 43 1 8.376 . 16.9064976321 . . . . . . . . . . 2 25684 1 >> 43 2 8.376 . 38.8683988312 . . . . . . . . . . 2 25684 1 >> 43 3 123.609 . 22.6301008960 . . . . . . . . . . 2 25684 1 >> 44 1 8.191 . 18.2323017904 . . . . . . . . . . 2 25684 1 >> 44 2 8.191 . 38.0317295582 . . . . . . . . . . 2 25684 1 >> 44 3 116.317 . 20.5703986684 . . . . . . . . . . 2 25684 1 >> 45 1 8.191 . 17.8361570959 . . . . . . . . . . 2 25684 1 >> 45 2 4.641 . 37.2723836905 . . . . . . . . . . 2 25684 1 >> 45 3 116.317 . 20.7317602634 . . . . . . . . . . 2 25684 1 >> 46 1 8.191 . 16.2129949552 . . . . . . . . . . 2 25684 1 >> 46 2 4.420 . 48.0476129095 . . . . . . . . . . 2 25684 1 >> 46 3 116.317 . 22.6890179515 . . . . . . . . . . 2 25684 1 >> 47 1 8.191 . 16.7934084666 . . . . . . . . . . 2 25684 1 >> 47 2 4.164 . 33.7855735665 . . . . . . . . . . 2 25684 1 >> 47 3 116.317 . 22.8694668412 . . . . . . . . . . 2 25684 1 >> 48 1 8.190 . 17.1885553156 . . . . . . . . . . 2 25684 1 >> 48 2 3.852 . 87.1347193657 . . . . . . . . . . 2 25684 1 >> 48 3 116.317 . 21.9324285785 . . . . . . . . . . 2 25684 1 >> 49 1 8.191 . 15.9139738970 . . . . . . . . . . 2 25684 1 >> 49 2 1.401 . 31.0299575851 . . . . . . . . . . 2 25684 1 >> 49 3 116.317 . 21.8069877227 . . . . . . . . . . 2 25684 1 >> 50 1 8.379 . 15.9721815557 . . . . . . . . . . 2 25684 1 >> 50 2 1.401 . 41.2231342457 . . . . . . . . . . 2 25684 1 >> 50 3 125.737 . 20.1868919532 . . . . . . . . . . 2 25684 1 >> 51 1 8.379 . 14.6021395768 . . . . . . . . . . 2 25684 1 >> 51 2 2.627 . 51.2151199103 . . . . . . . . . . 2 25684 1 >> 51 3 125.737 . 26.2268585960 . . . . . . . . . . 2 25684 1 >> 52 1 8.379 . 15.7845865870 . . . . . . . . . . 2 25684 1 >> 52 2 2.722 . 46.6337707105 . . . . . . . . . . 2 25684 1 >> 52 3 125.749 . 24.3729962905 . . . . . . . . . . 2 25684 1 >> 53 1 8.379 . 15.9572138720 . . . . . . . . . . 2 25684 1 >> 53 2 3.852 . 100.2046269860 . . . . . . . . . . 2 25684 1 >> 53 3 125.737 . 20.7624337574 . . . . . . . . . . 2 25684 1 >> 54 1 8.379 . 16.2875007584 . . . . . . . . . . 2 25684 1 >> 54 2 3.917 . 86.8114124417 . . . . . . . . . . 2 25684 1 >> 54 3 125.737 . 20.1959777872 . . . . . . . . . . 2 25684 1 >> 55 1 8.379 . 16.1694223650 . . . . . . . . . . 2 25684 1 >> 55 2 4.309 . 43.7710530545 . . . . . . . . . . 2 25684 1 >> 55 3 125.737 . 21.4415118098 . . . . . . . . . . 2 25684 1 >> 56 1 8.379 . 15.9538877201 . . . . . . . . . . 2 25684 1 >> 56 2 4.407 . 47.1252372731 . . . . . . . . . . 2 25684 1 >> 56 3 125.737 . 20.3873437643 . . . . . . . . . . 2 25684 1 >> 57 1 8.379 . 15.7972259643 . . . . . . . . . . 2 25684 1 >> 57 2 8.155 . 55.5363471692 . . . . . . . . . . 2 25684 1 >> 57 3 125.737 . 20.6057911615 . . . . . . . . . . 2 25684 1 >> 58 1 8.379 . 16.0589941210 . . . . . . . . . . 2 25684 1 >> 58 2 8.379 . 39.7240861585 . . . . . . . . . . 2 25684 1 >> 58 3 125.737 . 20.6074463328 . . . . . . . . . . 2 25684 1 >> 59 1 8.155 . 17.1014101351 . . . . . . . . . . 2 25684 1 >> 59 2 8.379 . 50.5348491106 . . . . . . . . . . 2 25684 1 >> 59 3 118.889 . 24.3574306369 . . . . . . . . . . 2 25684 1 >> 60 1 8.155 . 17.7360399228 . . . . . . . . . . 2 25684 1 >> 60 2 8.155 . 35.2056717044 . . . . . . . . . . 2 25684 1 >> 60 3 118.889 . 23.7627663215 . . . . . . . . . . 2 25684 1 >> 61 1 8.155 . 17.2138340702 . . . . . . . . . . 2 25684 1 >> 61 2 4.581 . 48.5205618928 . . . . . . . . . . 2 25684 1 >> 61 3 118.889 . 24.1223963102 . . . . . . . . . . 2 25684 1 >> 62 1 8.155 . 17.1310128872 . . . . . . . . . . 2 25684 1 >> 62 2 4.309 . 44.8410688497 . . . . . . . . . . 2 25684 1 >> 62 3 118.889 . 24.1127470136 . . . . . . . . . . 2 25684 1 >> 63 1 8.155 . 16.7352008079 . . . . . . . . . . 2 25684 1 >> 63 2 2.712 . 109.5249750460 . . . . . . . . . . 2 25684 1 >> 63 3 118.889 . 24.1919839382 . . . . . . . . . . 2 25684 1 >> 64 1 8.155 . 16.8732361128 . . . . . . . . . . 2 25684 1 >> 64 2 2.630 . 100.5624666930 . . . . . . . . . . 2 25684 1 >> 64 3 118.889 . 24.3663051724 . . . . . . . . . . 2 25684 1 >> 65 1 8.155 . 16.8442985911 . . . . . . . . . . 2 25684 1 >> 65 2 1.401 . 44.2249839836 . . . . . . . . . . 2 25684 1 >> 65 3 118.889 . 24.2664314310 . . . . . . . . . . 2 25684 1 >> 66 1 8.194 . 16.9933101974 . . . . . . . . . . 2 25684 1 >> 66 2 8.398 . 48.4950376620 . . . . . . . . . . 2 25684 1 >> 66 3 124.672 . 18.6317352454 . . . . . . . . . . 2 25684 1 >> 67 1 8.194 . 17.5833695494 . . . . . . . . . . 2 25684 1 >> 67 2 8.194 . 42.4157664440 . . . . . . . . . . 2 25684 1 >> 67 3 124.672 . 20.8944952985 . . . . . . . . . . 2 25684 1 >> 68 1 8.194 . 16.3234231992 . . . . . . . . . . 2 25684 1 >> 68 2 4.578 . 43.8256048420 . . . . . . . . . . 2 25684 1 >> 68 3 124.672 . 21.3898845514 . . . . . . . . . . 2 25684 1 >> 69 1 8.194 . 16.2964813686 . . . . . . . . . . 2 25684 1 >> 69 2 4.309 . 47.9410117100 . . . . . . . . . . 2 25684 1 >> 69 3 124.672 . 20.6973186135 . . . . . . . . . . 2 25684 1 >> 70 1 8.194 . 16.7937410818 . . . . . . . . . . 2 25684 1 >> 70 2 3.982 . 48.2703243355 . . . . . . . . . . 2 25684 1 >> 70 3 124.672 . 20.9715135892 . . . . . . . . . . 2 25684 1 >> 71 1 8.194 . 15.9229545072 . . . . . . . . . . 2 25684 1 >> 71 2 2.712 . 112.4392416390 . . . . . . . . . . 2 25684 1 >> 71 3 124.672 . 21.6376672188 . . . . . . . . . . 2 25684 1 >> 72 1 8.194 . 16.1145408582 . . . . . . . . . . 2 25684 1 >> 72 2 2.628 . 103.0263056820 . . . . . . . . . . 2 25684 1 >> 72 3 124.672 . 21.6863010824 . . . . . . . . . . 2 25684 1 >> 73 1 8.194 . 15.6408968237 . . . . . . . . . . 2 25684 1 >> 73 2 1.420 . 37.2033181246 . . . . . . . . . . 2 25684 1 >> 73 3 124.672 . 20.7805702090 . . . . . . . . . . 2 25684 1 >> 74 1 8.398 . 18.1787507444 . . . . . . . . . . 2 25684 1 >> 74 2 8.194 . 69.0270292416 . . . . . . . . . . 2 25684 1 >> 74 3 107.544 . 23.2102912664 . . . . . . . . . . 2 25684 1 >> 75 1 8.398 . 18.3390712673 . . . . . . . . . . 2 25684 1 >> 75 2 8.398 . 37.0947150248 . . . . . . . . . . 2 25684 1 >> 75 3 107.544 . 22.8982738654 . . . . . . . . . . 2 25684 1 >> 76 1 8.398 . 17.9738597856 . . . . . . . . . . 2 25684 1 >> 76 2 4.309 . 46.4641096466 . . . . . . . . . . 2 25684 1 >> 76 3 107.544 . 22.9543383916 . . . . . . . . . . 2 25684 1 >> 77 1 8.398 . 18.2605740818 . . . . . . . . . . 2 25684 1 >> 77 2 3.973 . 40.1486141745 . . . . . . . . . . 2 25684 1 >> 77 3 107.544 . 22.6824676991 . . . . . . . . . . 2 25684 1 >> 78 1 8.398 . 17.7237331607 . . . . . . . . . . 2 25684 1 >> 78 2 2.712 . 104.1698913190 . . . . . . . . . . 2 25684 1 >> 78 3 107.544 . 24.6982550621 . . . . . . . . . . 2 25684 1 >> 79 1 8.398 . 15.2128210707 . . . . . . . . . . 2 25684 1 >> 79 2 2.624 . 112.2986081320 . . . . . . . . . . 2 25684 1 >> 79 3 107.544 . 23.2800197601 . . . . . . . . . . 2 25684 1 >> 80 1 8.398 . 18.8456442058 . . . . . . . . . . 2 25684 1 >> 80 2 1.413 . 42.5483923494 . . . . . . . . . . 2 25684 1 >> 80 3 107.544 . 23.2008532683 . . . . . . . . . . 2 25684 1 >> 81 1 8.239 . 19.3113054757 . . . . . . . . . . 2 25684 1 >> 81 2 1.424 . 47.6652499218 . . . . . . . . . . 2 25684 1 >> 81 3 108.422 . 22.6879614592 . . . . . . . . . . 2 25684 1 >> 82 1 8.239 . 17.2311300602 . . . . . . . . . . 2 25684 1 >> 82 2 2.632 . 118.4969924270 . . . . . . . . . . 2 25684 1 >> 82 3 108.422 . 22.1949317058 . . . . . . . . . . 2 25684 1 >> 83 1 8.239 . 18.9886687387 . . . . . . . . . . 2 25684 1 >> 83 2 2.712 . 105.3550163910 . . . . . . . . . . 2 25684 1 >> 83 3 108.422 . 24.2181849480 . . . . . . . . . . 2 25684 1 >> 84 1 8.239 . 18.7408704201 . . . . . . . . . . 2 25684 1 >> 84 2 3.984 . 40.5119591078 . . . . . . . . . . 2 25684 1 >> 84 3 108.422 . 20.0003858407 . . . . . . . . . . 2 25684 1 >> 85 1 8.239 . 18.9683792120 . . . . . . . . . . 2 25684 1 >> 85 2 8.239 . 41.8071887046 . . . . . . . . . . 2 25684 1 >> 85 3 108.422 . 20.4903165499 . . . . . . . . . . 2 25684 1 >> 86 1 8.239 . 18.2309713296 . . . . . . . . . . 2 25684 1 >> 86 2 8.394 . 189.8713750750 . . . . . . . . . . 2 25684 1 >> 86 3 108.422 . 21.7726165056 . . . . . . . . . . 2 25684 1 >> 87 1 8.372 . 20.9038670186 . . . . . . . . . . 2 25684 1 >> 87 2 4.004 . 71.2015936149 . . . . . . . . . . 2 25684 1 >> 87 3 108.775 . 22.1901422739 . . . . . . . . . . 2 25684 1 >> 88 1 8.371 . 19.3309297721 . . . . . . . . . . 2 25684 1 >> 88 2 8.372 . 37.7050444271 . . . . . . . . . . 2 25684 1 >> 88 3 108.755 . 22.3342478275 . . . . . . . . . . 2 25684 1 >> 89 1 8.293 . 20.5196964709 . . . . . . . . . . 2 25684 1 >> 89 2 8.477 . 54.2118397782 . . . . . . . . . . 2 25684 1 >> 89 3 115.064 . 20.7842327158 . . . . . . . . . . 2 25684 1 >> 90 1 8.293 . 20.6490837809 . . . . . . . . . . 2 25684 1 >> 90 2 8.293 . 37.7278160448 . . . . . . . . . . 2 25684 1 >> 90 3 115.064 . 21.2440886100 . . . . . . . . . . 2 25684 1 >> 91 1 8.293 . 20.6248028718 . . . . . . . . . . 2 25684 1 >> 91 2 4.467 . 46.8214488785 . . . . . . . . . . 2 25684 1 >> 91 3 115.064 . 21.1105479797 . . . . . . . . . . 2 25684 1 >> 92 1 8.293 . 20.7116154371 . . . . . . . . . . 2 25684 1 >> 92 2 4.009 . 50.8222469452 . . . . . . . . . . 2 25684 1 >> 92 3 115.064 . 21.2301429113 . . . . . . . . . . 2 25684 1 >> 93 1 8.293 . 20.7102849764 . . . . . . . . . . 2 25684 1 >> 93 2 3.852 . 56.8124335928 . . . . . . . . . . 2 25684 1 >> 93 3 115.064 . 21.2852918108 . . . . . . . . . . 2 25684 1 >> 94 1 7.858 . 35.0982203690 . . . . . . . . . . 2 25684 1 >> 94 2 7.858 . 59.9205091737 . . . . . . . . . . 2 25684 1 >> 94 3 119.225 . 50.5421704054 . . . . . . . . . . 2 25684 1 >> 95 1 7.858 . 31.3612886785 . . . . . . . . . . 2 25684 1 >> 95 2 8.243 . 61.4258131999 . . . . . . . . . . 2 25684 1 >> 95 3 119.213 . 47.1557603280 . . . . . . . . . . 2 25684 1 >> 96 1 7.858 . 44.2477990911 . . . . . . . . . . 2 25684 1 >> 96 2 8.477 . 49.2819096610 . . . . . . . . . . 2 25684 1 >> 96 3 119.225 . 32.1926594774 . . . . . . . . . . 2 25684 1 >> 97 1 7.858 . 34.7366676545 . . . . . . . . . . 2 25684 1 >> 97 2 7.413 . 56.6164975854 . . . . . . . . . . 2 25684 1 >> 97 3 119.225 . 29.0514964859 . . . . . . . . . . 2 25684 1 >> 98 1 8.243 . 30.2882720667 . . . . . . . . . . 2 25684 1 >> 98 2 8.477 . 58.3626552605 . . . . . . . . . . 2 25684 1 >> 98 3 121.301 . 28.4831036131 . . . . . . . . . . 2 25684 1 >> 99 1 8.243 . 35.1254948148 . . . . . . . . . . 2 25684 1 >> 99 2 8.243 . 47.0011194447 . . . . . . . . . . 2 25684 1 >> 99 3 121.301 . 52.2629851103 . . . . . . . . . . 2 25684 1 >> 100 1 8.243 . 33.0363387892 . . . . . . . . . . 2 25684 1 >> 100 2 7.858 . 72.8540373248 . . . . . . . . . . 2 25684 1 >> 100 3 121.301 . 26.0540868839 . . . . . . . . . . 2 25684 1 >> 101 1 8.243 . 30.5716602109 . . . . . . . . . . 2 25684 1 >> 101 2 7.413 . 49.8565802115 . . . . . . . . . . 2 25684 1 >> 101 3 121.301 . 26.7134789626 . . . . . . . . . . 2 25684 1 >> 102 1 7.858 . 27.5215788934 . . . . . . . . . . 2 25684 1 >> 102 2 6.781 . 50.4851769555 . . . . . . . . . . 2 25684 1 >> 102 3 119.225 . 23.3134753505 . . . . . . . . . . 2 25684 1 >> 103 1 8.243 . 29.6150589166 . . . . . . . . . . 2 25684 1 >> 103 2 10.321 . 46.8962699081 . . . . . . . . . . 2 25684 1 >> 103 3 121.301 . 23.9341998100 . . . . . . . . . . 2 25684 1 >> 104 1 8.477 . 22.7425638041 . . . . . . . . . . 2 25684 1 >> 104 2 8.477 . 41.3869147270 . . . . . . . . . . 2 25684 1 >> 104 3 110.647 . 27.0714185635 . . . . . . . . . . 2 25684 1 >> 105 1 8.477 . 21.2740677281 . . . . . . . . . . 2 25684 1 >> 105 2 4.469 . 51.4203147073 . . . . . . . . . . 2 25684 1 >> 105 3 110.647 . 22.5583650668 . . . . . . . . . . 2 25684 1 >> 106 1 8.477 . 21.9283218122 . . . . . . . . . . 2 25684 1 >> 106 2 3.995 . 54.1804349647 . . . . . . . . . . 2 25684 1 >> 106 3 110.647 . 22.9467316469 . . . . . . . . . . 2 25684 1 >> 107 1 8.477 . 21.5178746644 . . . . . . . . . . 2 25684 1 >> 107 2 3.852 . 200.0654275670 . . . . . . . . . . 2 25684 1 >> 107 3 110.647 . 22.8746084372 . . . . . . . . . . 2 25684 1 >> 108 1 8.477 . 22.8117477641 . . . . . . . . . . 2 25684 1 >> 108 2 3.247 . 117.2943507260 . . . . . . . . . . 2 25684 1 >> 108 3 110.647 . 22.3497430484 . . . . . . . . . . 2 25684 1 >> 109 1 8.477 . 20.1192277789 . . . . . . . . . . 2 25684 1 >> 109 2 3.339 . 121.7786077540 . . . . . . . . . . 2 25684 1 >> 109 3 110.647 . 21.3948148489 . . . . . . . . . . 2 25684 1 >> 110 1 8.243 . 33.0812418402 . . . . . . . . . . 2 25684 1 >> 110 2 0.678 . 49.8288038426 . . . . . . . . . . 2 25684 1 >> 110 3 121.301 . 26.1153634389 . . . . . . . . . . 2 25684 1 >> 111 1 8.243 . 29.4770236116 . . . . . . . . . . 2 25684 1 >> 111 2 0.678 . 61.5699500329 . . . . . . . . . . 2 25684 1 >> 111 3 121.301 . 25.7362939914 . . . . . . . . . . 2 25684 1 >> 112 1 8.243 . 29.8415698629 . . . . . . . . . . 2 25684 1 >> 112 2 1.404 . 197.8883608180 . . . . . . . . . . 2 25684 1 >> 112 3 121.301 . 26.2740485867 . . . . . . . . . . 2 25684 1 >> 113 1 8.243 . 31.7008887903 . . . . . . . . . . 2 25684 1 >> 113 2 1.456 . 50.1040651557 . . . . . . . . . . 2 25684 1 >> 113 3 121.301 . 28.7831474344 . . . . . . . . . . 2 25684 1 >> 114 1 8.243 . 31.1813438592 . . . . . . . . . . 2 25684 1 >> 114 2 3.247 . 117.5135588270 . . . . . . . . . . 2 25684 1 >> 114 3 121.301 . 26.8099014958 . . . . . . . . . . 2 25684 1 >> 115 1 8.243 . 30.1159773969 . . . . . . . . . . 2 25684 1 >> 115 2 3.995 . 52.8882082186 . . . . . . . . . . 2 25684 1 >> 115 3 121.301 . 26.2705973784 . . . . . . . . . . 2 25684 1 >> 116 1 8.243 . 35.0609674674 . . . . . . . . . . 2 25684 1 >> 116 2 4.507 . 56.7293547238 . . . . . . . . . . 2 25684 1 >> 116 3 121.301 . 36.3095987837 . . . . . . . . . . 2 25684 1 >> 117 1 7.858 . 38.9196363185 . . . . . . . . . . 2 25684 1 >> 117 2 4.507 . 55.4931811905 . . . . . . . . . . 2 25684 1 >> 117 3 119.225 . 31.1950489879 . . . . . . . . . . 2 25684 1 >> 118 1 7.858 . 34.2583670073 . . . . . . . . . . 2 25684 1 >> 118 2 4.029 . 75.1368294416 . . . . . . . . . . 2 25684 1 >> 118 3 119.225 . 29.1308038433 . . . . . . . . . . 2 25684 1 >> 119 1 7.858 . 39.0337233296 . . . . . . . . . . 2 25684 1 >> 119 2 3.247 . 111.7410788540 . . . . . . . . . . 2 25684 1 >> 119 3 119.225 . 39.9572441975 . . . . . . . . . . 2 25684 1 >> 120 1 7.858 . 39.0337233296 . . . . . . . . . . 2 25684 1 >> 120 2 3.339 . 111.7410788540 . . . . . . . . . . 2 25684 1 >> 120 3 119.225 . 39.9572441975 . . . . . . . . . . 2 25684 1 >> 121 1 7.858 . 38.9728547493 . . . . . . . . . . 2 25684 1 >> 121 2 0.531 . 59.0730796858 . . . . . . . . . . 2 25684 1 >> 121 3 119.225 . 30.6546883782 . . . . . . . . . . 2 25684 1 >> 122 1 7.695 . 29.9995620794 . . . . . . . . . . 2 25684 1 >> 122 2 7.695 . 59.9163802540 . . . . . . . . . . 2 25684 1 >> 122 3 111.184 . 38.8934268554 . . . . . . . . . . 2 25684 1 >> 123 1 7.695 . 30.0531131254 . . . . . . . . . . 2 25684 1 >> 123 2 7.858 . 69.1481442194 . . . . . . . . . . 2 25684 1 >> 123 3 111.184 . 36.6657775640 . . . . . . . . . . 2 25684 1 >> 124 1 7.695 . 33.8605592368 . . . . . . . . . . 2 25684 1 >> 124 2 8.285 . 75.9091876623 . . . . . . . . . . 2 25684 1 >> 124 3 111.184 . 31.6622298956 . . . . . . . . . . 2 25684 1 >> 125 1 7.695 . 30.5660057527 . . . . . . . . . . 2 25684 1 >> 125 2 4.173 . 56.7303556740 . . . . . . . . . . 2 25684 1 >> 125 3 111.184 . 36.1989488204 . . . . . . . . . . 2 25684 1 >> 126 1 7.695 . 29.4517448570 . . . . . . . . . . 2 25684 1 >> 126 2 4.020 . 67.8924521566 . . . . . . . . . . 2 25684 1 >> 126 3 111.184 . 35.5239206553 . . . . . . . . . . 2 25684 1 >> 127 1 7.695 . 26.4884761048 . . . . . . . . . . 2 25684 1 >> 127 2 3.339 . 129.6711003120 . . . . . . . . . . 2 25684 1 >> 127 3 111.184 . 32.1877996127 . . . . . . . . . . 2 25684 1 >> 128 1 7.695 . 29.2086031511 . . . . . . . . . . 2 25684 1 >> 128 2 3.247 . 125.9370554820 . . . . . . . . . . 2 25684 1 >> 128 3 111.184 . 36.0580831766 . . . . . . . . . . 2 25684 1 >> 129 1 7.695 . 31.4494317046 . . . . . . . . . . 2 25684 1 >> 129 2 1.164 . 61.4828673630 . . . . . . . . . . 2 25684 1 >> 129 3 111.184 . 37.3061527809 . . . . . . . . . . 2 25684 1 >> 130 1 8.285 . 52.0695779637 . . . . . . . . . . 2 25684 1 >> 130 2 8.285 . 74.3593413509 . . . . . . . . . . 2 25684 1 >> 130 3 109.641 . 47.0629298687 . . . . . . . . . . 2 25684 1 >> 131 1 8.285 . 39.9776852466 . . . . . . . . . . 2 25684 1 >> 131 2 4.176 . 65.2674601802 . . . . . . . . . . 2 25684 1 >> 131 3 109.641 . 31.9934050242 . . . . . . . . . . 2 25684 1 >> 132 1 8.285 . 48.5189107812 . . . . . . . . . . 2 25684 1 >> 132 2 4.020 . 156.8724232700 . . . . . . . . . . 2 25684 1 >> 132 3 109.641 . 34.8911521832 . . . . . . . . . . 2 25684 1 >> 133 1 8.285 . 40.0195947609 . . . . . . . . . . 2 25684 1 >> 133 2 3.893 . 152.9401902940 . . . . . . . . . . 2 25684 1 >> 133 3 109.641 . 31.6867405176 . . . . . . . . . . 2 25684 1 >> 134 1 8.285 . 37.8925206033 . . . . . . . . . . 2 25684 1 >> 134 2 1.164 . 61.1515528371 . . . . . . . . . . 2 25684 1 >> 134 3 109.641 . 32.9201600949 . . . . . . . . . . 2 25684 1 >> 135 1 7.743 . 40.5248372387 . . . . . . . . . . 2 25684 1 >> 135 2 7.743 . 68.7156086015 . . . . . . . . . . 2 25684 1 >> 135 3 119.314 . 37.7197343111 . . . . . . . . . . 2 25684 1 >> 136 1 7.743 . 29.9017732127 . . . . . . . . . . 2 25684 1 >> 136 2 10.019 . 51.3115864886 . . . . . . . . . . 2 25684 1 >> 136 3 119.314 . 25.7592550914 . . . . . . . . . . 2 25684 1 >> 137 1 7.743 . 46.5418460755 . . . . . . . . . . 2 25684 1 >> 137 2 7.437 . 51.2819333381 . . . . . . . . . . 2 25684 1 >> 137 3 119.314 . 32.1478642027 . . . . . . . . . . 2 25684 1 >> 138 1 7.743 . 37.0919158343 . . . . . . . . . . 2 25684 1 >> 138 2 7.221 . 50.9844008824 . . . . . . . . . . 2 25684 1 >> 138 3 119.314 . 34.0406758587 . . . . . . . . . . 2 25684 1 >> 139 1 7.695 . 30.5660057527 . . . . . . . . . . 2 25684 1 >> 139 2 4.513 . 56.7303556740 . . . . . . . . . . 2 25684 1 >> 139 3 111.184 . 36.1989488204 . . . . . . . . . . 2 25684 1 >> 140 1 7.743 . 45.2040677702 . . . . . . . . . . 2 25684 1 >> 140 2 4.548 . 59.1421452516 . . . . . . . . . . 2 25684 1 >> 140 3 119.314 . 34.0794843435 . . . . . . . . . . 2 25684 1 >> 141 1 7.743 . 42.6658812344 . . . . . . . . . . 2 25684 1 >> 141 2 3.250 . 159.4468672600 . . . . . . . . . . 2 25684 1 >> 141 3 119.314 . 31.5946143866 . . . . . . . . . . 2 25684 1 >> 142 1 7.743 . 34.6671510792 . . . . . . . . . . 2 25684 1 >> 142 2 3.137 . 164.8890336570 . . . . . . . . . . 2 25684 1 >> 142 3 119.314 . 33.4848904610 . . . . . . . . . . 2 25684 1 >> 143 1 7.437 . 39.3769822085 . . . . . . . . . . 2 25684 1 >> 143 2 7.437 . 56.6570360697 . . . . . . . . . . 2 25684 1 >> 143 3 120.411 . 40.7408797741 . . . . . . . . . . 2 25684 1 >> 144 1 7.437 . 39.9790157074 . . . . . . . . . . 2 25684 1 >> 144 2 4.544 . 49.2937959450 . . . . . . . . . . 2 25684 1 >> 144 3 120.411 . 33.1238518159 . . . . . . . . . . 2 25684 1 >> 145 1 7.437 . 46.6020494254 . . . . . . . . . . 2 25684 1 >> 145 2 3.250 . 193.6253137920 . . . . . . . . . . 2 25684 1 >> 145 3 120.411 . 28.2442659140 . . . . . . . . . . 2 25684 1 >> 146 1 7.437 . 32.9831203583 . . . . . . . . . . 2 25684 1 >> 146 2 3.137 . 177.9519346250 . . . . . . . . . . 2 25684 1 >> 146 3 120.411 . 44.5064297318 . . . . . . . . . . 2 25684 1 >> 147 1 7.437 . 50.9470016882 . . . . . . . . . . 2 25684 1 >> 147 2 1.419 . 73.8080680121 . . . . . . . . . . 2 25684 1 >> 147 3 120.411 . 37.2115615010 . . . . . . . . . . 2 25684 1 >> 148 1 7.437 . 44.0901394897 . . . . . . . . . . 2 25684 1 >> 148 2 0.705 . 75.8770321362 . . . . . . . . . . 2 25684 1 >> 148 3 120.411 . 36.6021062930 . . . . . . . . . . 2 25684 1 >> 149 1 7.797 . 42.5102173242 . . . . . . . . . . 2 25684 1 >> 149 2 4.228 . 91.3056789715 . . . . . . . . . . 2 25684 1 >> 149 3 111.214 . 30.6896934907 . . . . . . . . . . 2 25684 1 >> 150 1 7.797 . 37.6001518489 . . . . . . . . . . 2 25684 1 >> 150 2 1.692 . 239.8817262660 . . . . . . . . . . 2 25684 1 >> 150 3 111.214 . 27.0869137843 . . . . . . . . . . 2 25684 1 >> 151 1 7.797 . 33.0107274193 . . . . . . . . . . 2 25684 1 >> 151 2 1.419 . 153.5182390520 . . . . . . . . . . 2 25684 1 >> 151 3 111.214 . 31.9721343120 . . . . . . . . . . 2 25684 1 >> 152 1 7.797 . 50.8947811030 . . . . . . . . . . 2 25684 1 >> 152 2 1.148 . 56.1237798350 . . . . . . . . . . 2 25684 1 >> 152 3 111.214 . 32.8895922502 . . . . . . . . . . 2 25684 1 >> 153 1 7.797 . 40.6312741004 . . . . . . . . . . 2 25684 1 >> 153 2 7.797 . 86.6243598676 . . . . . . . . . . 2 25684 1 >> 153 3 111.214 . 35.8038206895 . . . . . . . . . . 2 25684 1 >> 154 1 8.187 . 31.4088526511 . . . . . . . . . . 2 25684 1 >> 154 2 8.187 . 56.0913740713 . . . . . . . . . . 2 25684 1 >> 154 3 113.615 . 24.4589243333 . . . . . . . . . . 2 25684 1 >> 155 1 8.187 . 28.9022645585 . . . . . . . . . . 2 25684 1 >> 155 2 4.353 . 56.6012330944 . . . . . . . . . . 2 25684 1 >> 155 3 113.615 . 26.1886135737 . . . . . . . . . . 2 25684 1 >> 156 1 8.187 . 28.5367204617 . . . . . . . . . . 2 25684 1 >> 156 2 4.235 . 120.4333306460 . . . . . . . . . . 2 25684 1 >> 156 3 113.615 . 25.7589733601 . . . . . . . . . . 2 25684 1 >> 157 1 8.187 . 27.3762260542 . . . . . . . . . . 2 25684 1 >> 157 2 2.251 . 55.5707548333 . . . . . . . . . . 2 25684 1 >> 157 3 113.615 . 26.8209594488 . . . . . . . . . . 2 25684 1 >> 158 1 8.187 . 29.1989573105 . . . . . . . . . . 2 25684 1 >> 158 2 1.945 . 70.3948277300 . . . . . . . . . . 2 25684 1 >> 158 3 113.615 . 25.8605374893 . . . . . . . . . . 2 25684 1 >> 159 1 8.187 . 28.2829350696 . . . . . . . . . . 2 25684 1 >> 159 2 1.209 . 51.0664788012 . . . . . . . . . . 2 25684 1 >> 159 3 113.615 . 26.2973618507 . . . . . . . . . . 2 25684 1 >> 160 1 8.187 . 26.7971430036 . . . . . . . . . . 2 25684 1 >> 160 2 8.281 . 126.1831641190 . . . . . . . . . . 2 25684 1 >> 160 3 113.615 . 30.6568717957 . . . . . . . . . . 2 25684 1 >> 161 1 8.281 . 24.5489969159 . . . . . . . . . . 2 25684 1 >> 161 2 8.281 . 47.1706553898 . . . . . . . . . . 2 25684 1 >> 161 3 117.677 . 28.2486327489 . . . . . . . . . . 2 25684 1 >> 162 1 8.281 . 23.6971694072 . . . . . . . . . . 2 25684 1 >> 162 2 4.535 . 41.3867896082 . . . . . . . . . . 2 25684 1 >> 162 3 117.677 . 23.9186341564 . . . . . . . . . . 2 25684 1 >> 163 1 8.187 . 29.4464230139 . . . . . . . . . . 2 25684 1 >> 163 2 4.435 . 55.0872958725 . . . . . . . . . . 2 25684 1 >> 163 3 113.615 . 26.2359444300 . . . . . . . . . . 2 25684 1 >> 164 1 8.194 . 23.1972487725 . . . . . . . . . . 2 25684 1 >> 164 2 4.535 . 45.7264093276 . . . . . . . . . . 2 25684 1 >> 164 3 115.410 . 23.4889939427 . . . . . . . . . . 2 25684 1 >> 165 1 8.281 . 23.8125868791 . . . . . . . . . . 2 25684 1 >> 165 2 4.348 . 41.1380534762 . . . . . . . . . . 2 25684 1 >> 165 3 117.677 . 23.1537337104 . . . . . . . . . . 2 25684 1 >> 166 1 8.281 . 24.4831391077 . . . . . . . . . . 2 25684 1 >> 166 2 4.239 . 40.0470177262 . . . . . . . . . . 2 25684 1 >> 166 3 117.677 . 23.9094778895 . . . . . . . . . . 2 25684 1 >> 167 1 8.281 . 27.6433160540 . . . . . . . . . . 2 25684 1 >> 167 2 3.876 . 83.5963603050 . . . . . . . . . . 2 25684 1 >> 167 3 117.677 . 24.1400749485 . . . . . . . . . . 2 25684 1 >> 168 1 8.281 . 20.6277964086 . . . . . . . . . . 2 25684 1 >> 168 2 2.259 . 57.2553540693 . . . . . . . . . . 2 25684 1 >> 168 3 117.677 . 25.0909180443 . . . . . . . . . . 2 25684 1 >> 169 1 8.281 . 22.0450697449 . . . . . . . . . . 2 25684 1 >> 169 2 1.943 . 68.3248626557 . . . . . . . . . . 2 25684 1 >> 169 3 117.677 . 27.7098216613 . . . . . . . . . . 2 25684 1 >> 170 1 8.281 . 25.4680126934 . . . . . . . . . . 2 25684 1 >> 170 2 1.205 . 50.6275621256 . . . . . . . . . . 2 25684 1 >> 170 3 117.677 . 24.8354581992 . . . . . . . . . . 2 25684 1 >> 171 1 8.193 . 23.1327214252 . . . . . . . . . . 2 25684 1 >> 171 2 1.184 . 50.1330927123 . . . . . . . . . . 2 25684 1 >> 171 3 115.410 . 25.6181077162 . . . . . . . . . . 2 25684 1 >> 172 1 8.193 . 27.2155729161 . . . . . . . . . . 2 25684 1 >> 172 2 1.943 . 85.1328189070 . . . . . . . . . . 2 25684 1 >> 172 3 115.410 . 34.8712196946 . . . . . . . . . . 2 25684 1 >> 173 1 8.194 . 24.2523041639 . . . . . . . . . . 2 25684 1 >> 173 2 3.876 . 89.7482004146 . . . . . . . . . . 2 25684 1 >> 173 3 115.410 . 27.7053139607 . . . . . . . . . . 2 25684 1 >> 174 1 8.193 . 24.4864652596 . . . . . . . . . . 2 25684 1 >> 174 2 4.263 . 50.9833999322 . . . . . . . . . . 2 25684 1 >> 174 3 115.410 . 26.3547646006 . . . . . . . . . . 2 25684 1 >> 175 1 8.193 . 23.2843939530 . . . . . . . . . . 2 25684 1 >> 175 2 4.375 . 55.6223037701 . . . . . . . . . . 2 25684 1 >> 175 3 115.410 . 26.4742186666 . . . . . . . . . . 2 25684 1 >> 176 1 8.192 . 32.5350876937 . . . . . . . . . . 2 25684 1 >> 176 2 8.194 . 49.0438086252 . . . . . . . . . . 2 25684 1 >> 176 3 115.410 . 49.9765948455 . . . . . . . . . . 2 25684 1 >> 177 1 8.214 . 26.9032472501 . . . . . . . . . . 2 25684 1 >> 177 2 8.214 . 42.2498589435 . . . . . . . . . . 2 25684 1 >> 177 3 117.746 . 23.8939122359 . . . . . . . . . . 2 25684 1 >> 178 1 8.214 . 21.0947881392 . . . . . . . . . . 2 25684 1 >> 178 2 4.375 . 47.5446354192 . . . . . . . . . . 2 25684 1 >> 178 3 117.746 . 22.1645047267 . . . . . . . . . . 2 25684 1 >> 179 1 8.214 . 20.7205960474 . . . . . . . . . . 2 25684 1 >> 179 2 4.262 . 34.6669102435 . . . . . . . . . . 2 25684 1 >> 179 3 117.746 . 22.1026647091 . . . . . . . . . . 2 25684 1 >> 180 1 8.214 . 23.1975813877 . . . . . . . . . . 2 25684 1 >> 180 2 3.819 . 49.7482273491 . . . . . . . . . . 2 25684 1 >> 180 3 117.746 . 22.1245693167 . . . . . . . . . . 2 25684 1 >> 181 1 8.215 . 24.3444385723 . . . . . . . . . . 2 25684 1 >> 181 2 1.184 . 48.9299505366 . . . . . . . . . . 2 25684 1 >> 181 3 117.746 . 22.7730443080 . . . . . . . . . . 2 25684 1 >> 182 1 8.153 . 18.8053977675 . . . . . . . . . . 2 25684 1 >> 182 2 8.450 . 83.0535950431 . . . . . . . . . . 2 25684 1 >> 182 3 123.242 . 19.1164891422 . . . . . . . . . . 2 25684 1 >> 183 1 8.155 . 18.2811962237 . . . . . . . . . . 2 25684 1 >> 183 2 4.303 . 40.3603151480 . . . . . . . . . . 2 25684 1 >> 183 3 123.242 . 21.6787295540 . . . . . . . . . . 2 25684 1 >> 184 1 8.153 . 17.9741924008 . . . . . . . . . . 2 25684 1 >> 184 2 3.819 . 48.9875051748 . . . . . . . . . . 2 25684 1 >> 184 3 123.242 . 22.2808245321 . . . . . . . . . . 2 25684 1 >> 185 1 8.153 . 17.6801605705 . . . . . . . . . . 2 25684 1 >> 185 2 3.249 . 45.0832988052 . . . . . . . . . . 2 25684 1 >> 185 3 123.242 . 21.8006839852 . . . . . . . . . . 2 25684 1 >> 186 1 8.153 . 17.9795142439 . . . . . . . . . . 2 25684 1 >> 186 2 3.128 . 43.6028934160 . . . . . . . . . . 2 25684 1 >> 186 3 123.242 . 22.2190901637 . . . . . . . . . . 2 25684 1 >> 187 1 8.153 . 18.3034814417 . . . . . . . . . . 2 25684 1 >> 187 2 1.578 . 103.5593116790 . . . . . . . . . . 2 25684 1 >> 187 3 123.242 . 22.1052707235 . . . . . . . . . . 2 25684 1 >> 188 1 8.153 . 17.9405982664 . . . . . . . . . . 2 25684 1 >> 188 2 1.519 . 104.6488460040 . . . . . . . . . . 2 25684 1 >> 188 3 123.242 . 22.2049331665 . . . . . . . . . . 2 25684 1 >> 189 1 8.153 . 19.0674985394 . . . . . . . . . . 2 25684 1 >> 189 2 1.629 . 113.0272998990 . . . . . . . . . . 2 25684 1 >> 189 3 123.242 . 21.8449862301 . . . . . . . . . . 2 25684 1 >> 190 1 8.153 . 17.6282726004 . . . . . . . . . . 2 25684 1 >> 190 2 0.912 . 86.5776905631 . . . . . . . . . . 2 25684 1 >> 190 3 123.242 . 21.8155100942 . . . . . . . . . . 2 25684 1 >> 191 1 8.153 . 18.4628041190 . . . . . . . . . . 2 25684 1 >> 191 2 0.849 . 77.8659202419 . . . . . . . . . . 2 25684 1 >> 191 3 123.242 . 23.0545642972 . . . . . . . . . . 2 25684 1 >> 192 1 8.282 . 17.9209739700 . . . . . . . . . . 2 25684 1 >> 192 2 0.847 . 72.6169372392 . . . . . . . . . . 2 25684 1 >> 192 3 122.166 . 21.8264271816 . . . . . . . . . . 2 25684 1 >> 193 1 8.282 . 18.5901957378 . . . . . . . . . . 2 25684 1 >> 193 2 0.913 . 93.7384885039 . . . . . . . . . . 2 25684 1 >> 193 3 122.166 . 23.0172349016 . . . . . . . . . . 2 25684 1 >> 194 1 8.282 . 18.6054960367 . . . . . . . . . . 2 25684 1 >> 194 2 1.432 . 52.9177362504 . . . . . . . . . . 2 25684 1 >> 194 3 122.166 . 22.6600700617 . . . . . . . . . . 2 25684 1 >> 195 1 8.282 . 18.8769100340 . . . . . . . . . . 2 25684 1 >> 195 2 1.720 . 118.8333117040 . . . . . . . . . . 2 25684 1 >> 195 3 122.166 . 22.6243606210 . . . . . . . . . . 2 25684 1 >> 196 1 8.282 . 18.0906077183 . . . . . . . . . . 2 25684 1 >> 196 2 1.748 . 94.2544783471 . . . . . . . . . . 2 25684 1 >> 196 3 122.166 . 22.0418107510 . . . . . . . . . . 2 25684 1 >> 197 1 8.282 . 17.4410102469 . . . . . . . . . . 2 25684 1 >> 197 2 1.805 . 109.0870593210 . . . . . . . . . . 2 25684 1 >> 197 3 122.166 . 22.1184416612 . . . . . . . . . . 2 25684 1 >> 198 1 8.282 . 18.7525119519 . . . . . . . . . . 2 25684 1 >> 198 2 1.848 . 118.7762575410 . . . . . . . . . . 2 25684 1 >> 198 3 122.166 . 22.1241467198 . . . . . . . . . . 2 25684 1 >> 199 1 8.282 . 17.8980235217 . . . . . . . . . . 2 25684 1 >> 199 2 4.301 . 44.2500077393 . . . . . . . . . . 2 25684 1 >> 199 3 122.166 . 22.0965370536 . . . . . . . . . . 2 25684 1 >> 200 1 8.282 . 20.2479498585 . . . . . . . . . . 2 25684 1 >> 200 2 8.282 . 37.2493618352 . . . . . . . . . . 2 25684 1 >> 200 3 122.166 . 24.0524565180 . . . . . . . . . . 2 25684 1 >> 201 1 8.282 . 17.3867939705 . . . . . . . . . . 2 25684 1 >> 201 2 8.450 . 58.3649073985 . . . . . . . . . . 2 25684 1 >> 201 3 122.166 . 20.9507359068 . . . . . . . . . . 2 25684 1 >> 202 1 8.450 . 16.8546096621 . . . . . . . . . . 2 25684 1 >> 202 2 8.450 . 41.9589577831 . . . . . . . . . . 2 25684 1 >> 202 3 122.287 . 22.7760729194 . . . . . . . . . . 2 25684 1 >> 203 1 8.450 . 16.6763279187 . . . . . . . . . . 2 25684 1 >> 203 2 4.283 . 47.0086265714 . . . . . . . . . . 2 25684 1 >> 203 3 122.287 . 22.6500686010 . . . . . . . . . . 2 25684 1 >> 204 1 8.450 . 16.9198022398 . . . . . . . . . . 2 25684 1 >> 204 2 2.297 . 47.9585283390 . . . . . . . . . . 2 25684 1 >> 204 3 122.287 . 22.6631691058 . . . . . . . . . . 2 25684 1 >> 205 1 8.450 . 16.9064976321 . . . . . . . . . . 2 25684 1 >> 205 2 2.072 . 44.1474103408 . . . . . . . . . . 2 25684 1 >> 205 3 122.287 . 22.6414757967 . . . . . . . . . . 2 25684 1 >> 206 1 8.450 . 16.8625924267 . . . . . . . . . . 2 25684 1 >> 206 2 1.950 . 44.4221711787 . . . . . . . . . . 2 25684 1 >> 206 3 122.287 . 22.5107524792 . . . . . . . . . . 2 25684 1 >> 207 1 8.450 . 16.9387613058 . . . . . . . . . . 2 25684 1 >> 207 2 1.852 . 109.2442085070 . . . . . . . . . . 2 25684 1 >> 207 3 122.287 . 22.9090500871 . . . . . . . . . . 2 25684 1 >> 208 1 8.450 . 16.3427148804 . . . . . . . . . . 2 25684 1 >> 208 2 1.805 . 99.7582031832 . . . . . . . . . . 2 25684 1 >> 208 3 122.287 . 22.8020626307 . . . . . . . . . . 2 25684 1 >> 209 1 8.450 . 16.6021547308 . . . . . . . . . . 2 25684 1 >> 209 2 1.751 . 112.4207240600 . . . . . . . . . . 2 25684 1 >> 209 3 122.287 . 23.6362689734 . . . . . . . . . . 2 25684 1 >> 210 1 8.450 . 17.1868922396 . . . . . . . . . . 2 25684 1 >> 210 2 1.719 . 123.4516960620 . . . . . . . . . . 2 25684 1 >> 210 3 122.287 . 23.6440870166 . . . . . . . . . . 2 25684 1 >> 211 1 8.450 . 17.1536307203 . . . . . . . . . . 2 25684 1 >> 211 2 1.431 . 49.6055919415 . . . . . . . . . . 2 25684 1 >> 211 3 122.287 . 22.3673512538 . . . . . . . . . . 2 25684 1 >> 212 1 8.450 . 16.2718678444 . . . . . . . . . . 2 25684 1 >> 212 2 0.910 . 76.9925911668 . . . . . . . . . . 2 25684 1 >> 212 3 122.287 . 22.8721432885 . . . . . . . . . . 2 25684 1 >> 213 1 8.450 . 20.0986056369 . . . . . . . . . . 2 25684 1 >> 213 2 0.849 . 86.4530722596 . . . . . . . . . . 2 25684 1 >> 213 3 122.287 . 23.8399606943 . . . . . . . . . . 2 25684 1 >> 214 1 8.253 . 15.5431079571 . . . . . . . . . . 2 25684 1 >> 214 2 1.402 . 40.6110531805 . . . . . . . . . . 2 25684 1 >> 214 3 124.163 . 20.4402740300 . . . . . . . . . . 2 25684 1 >> 215 1 8.253 . 15.6804780317 . . . . . . . . . . 2 25684 1 >> 215 2 2.283 . 51.3077078065 . . . . . . . . . . 2 25684 1 >> 215 3 124.163 . 21.1919331054 . . . . . . . . . . 2 25684 1 >> 216 1 8.253 . 15.6804780317 . . . . . . . . . . 2 25684 1 >> 216 2 2.302 . 51.3077078065 . . . . . . . . . . 2 25684 1 >> 216 3 124.163 . 21.1919331054 . . . . . . . . . . 2 25684 1 >> 217 1 8.252 . 16.0423633614 . . . . . . . . . . 2 25684 1 >> 217 2 4.259 . 59.1951956138 . . . . . . . . . . 2 25684 1 >> 217 3 124.163 . 20.6884792944 . . . . . . . . . . 2 25684 1 >> 218 1 8.252 . 15.6561971226 . . . . . . . . . . 2 25684 1 >> 218 2 8.450 . 55.4985612980 . . . . . . . . . . 2 25684 1 >> 218 3 124.163 . 20.5000714958 . . . . . . . . . . 2 25684 1 >> 219 1 8.252 . 15.4436560144 . . . . . . . . . . 2 25684 1 >> 219 2 8.253 . 34.6003470532 . . . . . . . . . . 2 25684 1 >> 219 3 124.163 . 20.5484236280 . . . . . . . . . . 2 25684 1 >> 220 1 8.250 . 16.1288433115 . . . . . . . . . . 2 25684 1 >> 220 2 1.402 . 42.9112368075 . . . . . . . . . . 2 25684 1 >> 220 3 119.567 . 20.4286878308 . . . . . . . . . . 2 25684 1 >> 221 1 8.251 . 16.1707528258 . . . . . . . . . . 2 25684 1 >> 221 2 1.945 . 45.7829630155 . . . . . . . . . . 2 25684 1 >> 221 3 119.567 . 20.5963883797 . . . . . . . . . . 2 25684 1 >> 222 1 8.251 . 16.0443590525 . . . . . . . . . . 2 25684 1 >> 222 2 2.066 . 41.5509454458 . . . . . . . . . . 2 25684 1 >> 222 3 119.567 . 20.5677926540 . . . . . . . . . . 2 25684 1 >> 223 1 8.252 . 16.1451414559 . . . . . . . . . . 2 25684 1 >> 223 2 2.283 . 61.2806754166 . . . . . . . . . . 2 25684 1 >> 223 3 119.567 . 20.4937677582 . . . . . . . . . . 2 25684 1 >> 224 1 8.252 . 16.4022529999 . . . . . . . . . . 2 25684 1 >> 224 2 4.291 . 46.0392062743 . . . . . . . . . . 2 25684 1 >> 224 3 119.567 . 20.8602297306 . . . . . . . . . . 2 25684 1 >> 225 1 8.251 . 16.0739618047 . . . . . . . . . . 2 25684 1 >> 225 2 8.251 . 34.6320021042 . . . . . . . . . . 2 25684 1 >> 225 3 119.567 . 20.6438601017 . . . . . . . . . . 2 25684 1 >> 226 1 8.312 . 16.7421857269 . . . . . . . . . . 2 25684 1 >> 226 2 1.948 . 42.4072583670 . . . . . . . . . . 2 25684 1 >> 226 3 122.510 . 24.8625044028 . . . . . . . . . . 2 25684 1 >> 227 1 8.312 . 17.0039538836 . . . . . . . . . . 2 25684 1 >> 227 2 2.065 . 42.5553990010 . . . . . . . . . . 2 25684 1 >> 227 3 122.510 . 24.9585043391 . . . . . . . . . . 2 25684 1 >> 228 1 8.312 . 16.8589336596 . . . . . . . . . . 2 25684 1 >> 228 2 2.283 . 61.8867507805 . . . . . . . . . . 2 25684 1 >> 228 3 122.510 . 25.3807491064 . . . . . . . . . . 2 25684 1 >> 229 1 8.312 . 17.3172773952 . . . . . . . . . . 2 25684 1 >> 229 2 4.289 . 47.8974703751 . . . . . . . . . . 2 25684 1 >> 229 3 122.510 . 27.2640171150 . . . . . . . . . . 2 25684 1 >> 230 1 8.312 . 17.2015273081 . . . . . . . . . . 2 25684 1 >> 230 2 7.932 . 47.7330642999 . . . . . . . . . . 2 25684 1 >> 230 3 122.510 . 23.1098540624 . . . . . . . . . . 2 25684 1 >> 231 1 7.932 . 15.7004349432 . . . . . . . . . . 2 25684 1 >> 231 2 8.312 . 58.6464246505 . . . . . . . . . . 2 25684 1 >> 231 3 127.795 . 19.9089288215 . . . . . . . . . . 2 25684 1 >> 232 1 7.932 . 16.4877351045 . . . . . . . . . . 2 25684 1 >> 232 2 7.932 . 37.2915268636 . . . . . . . . . . 2 25684 1 >> 232 3 127.795 . 20.2384487788 . . . . . . . . . . 2 25684 1 >> 233 1 7.932 . 16.0007864623 . . . . . . . . . . 2 25684 1 >> 233 2 4.305 . 41.2856936351 . . . . . . . . . . 2 25684 1 >> 233 3 127.795 . 20.0781788925 . . . . . . . . . . 2 25684 1 >> 234 1 7.932 . 16.5392904593 . . . . . . . . . . 2 25684 1 >> 234 2 2.072 . 46.7178505298 . . . . . . . . . . 2 25684 1 >> 234 3 127.795 . 20.1462874313 . . . . . . . . . . 2 25684 1 >> 235 1 7.932 . 15.3654914441 . . . . . . . . . . 2 25684 1 >> 235 2 1.946 . 44.0593267206 . . . . . . . . . . 2 25684 1 >> 235 3 127.795 . 22.6208918045 . . . . . . . . . . 2 25684 1 >> 236 1 7.932 . 15.9565486416 . . . . . . . . . . 2 25684 1 >> 236 2 1.832 . 33.8291149015 . . . . . . . . . . 2 25684 1 >> 236 3 127.795 . 19.2968147745 . . . . . . . . . . 2 25684 1 >> 237 1 7.932 . 15.7310355410 . . . . . . . . . . 2 25684 1 >> 237 2 1.710 . 45.0192379905 . . . . . . . . . . 2 25684 1 >> 237 3 127.795 . 19.6553530544 . . . . . . . . . . 2 25684 1 >> 238 1 8.254 . 15.5890088537 . . . . . . . . . . 2 25684 1 >> 238 2 1.950 . 42.2826400635 . . . . . . . . . . 2 25684 1 >> 238 3 124.163 . 20.7814506193 . . . . . . . . . . 2 25684 1 >> 239 1 8.252 . 15.8767209954 . . . . . . . . . . 2 25684 1 >> 239 2 2.068 . 44.0463143676 . . . . . . . . . . 2 25684 1 >> 239 3 124.163 . 20.5711382131 . . . . . . . . . . 2 25684 1 >> 240 1 8.560 . 24.1891072773 . . . . . . . . . . 2 25684 1 >> 240 2 8.560 . 37.8670732455 . . . . . . . . . . 2 25684 1 >> 240 3 119.619 . 20.7226039966 . . . . . . . . . . 2 25684 1 >> 241 1 8.560 . 16.7707906335 . . . . . . . . . . 2 25684 1 >> 241 2 8.413 . 208.2720933790 . . . . . . . . . . 2 25684 1 >> 241 3 119.619 . 21.1007578174 . . . . . . . . . . 2 25684 1 >> 242 1 8.413 . 18.2289756385 . . . . . . . . . . 2 25684 1 >> 242 2 8.555 . 189.4639883320 . . . . . . . . . . 2 25684 1 >> 242 3 110.213 . 22.6697897911 . . . . . . . . . . 2 25684 1 >> 243 1 8.190 . 17.0910990641 . . . . . . . . . . 2 25684 1 >> 243 2 3.917 . 101.2621309030 . . . . . . . . . . 2 25684 1 >> 243 3 116.317 . 21.5039152900 . . . . . . . . . . 2 25684 1 >> 244 1 8.218 . 18.6557209308 . . . . . . . . . . 2 25684 1 >> 244 2 0.921 . 44.8275560216 . . . . . . . . . . 2 25684 1 >> 244 3 120.988 . 22.7830457687 . . . . . . . . . . 2 25684 1 >> 245 1 8.190 . 17.1137168972 . . . . . . . . . . 2 25684 1 >> 245 2 0.921 . 50.2061620791 . . . . . . . . . . 2 25684 1 >> 245 3 116.317 . 19.8741702239 . . . . . . . . . . 2 25684 1 >> 246 1 8.376 . 16.9560572958 . . . . . . . . . . 2 25684 1 >> 246 2 0.921 . 52.4758167241 . . . . . . . . . . 2 25684 1 >> 246 3 123.609 . 22.7569151918 . . . . . . . . . . 2 25684 1 >> 247 1 8.379 . 15.7722798249 . . . . . . . . . . 2 25684 1 >> 247 2 8.191 . 53.7361381817 . . . . . . . . . . 2 25684 1 >> 247 3 125.737 . 20.4360832771 . . . . . . . . . . 2 25684 1 >> 248 1 8.243 . 30.4120049184 . . . . . . . . . . 2 25684 1 >> 248 2 3.339 . 119.4684146250 . . . . . . . . . . 2 25684 1 >> 248 3 121.301 . 26.4516801635 . . . . . . . . . . 2 25684 1 >> 249 1 8.243 . 31.0263451794 . . . . . . . . . . 2 25684 1 >> 249 2 6.781 . 64.7407101220 . . . . . . . . . . 2 25684 1 >> 249 3 121.301 . 28.2362365723 . . . . . . . . . . 2 25684 1 >> 250 1 7.955 . 49.1106332091 . . . . . . . . . . 2 25684 1 >> 250 2 4.229 . 69.0075107121 . . . . . . . . . . 2 25684 1 >> 250 3 119.083 . 28.5027543704 . . . . . . . . . . 2 25684 1 >> 251 1 7.955 . 6.3971880021 . . . . . . . . . . 2 25684 1 >> 251 2 7.955 . 78.9455701831 . . . . . . . . . . 2 25684 1 >> 251 3 119.083 . 29.7918158770 . . . . . . . . . . 2 25684 1 >> 252 1 7.955 . 205.0206786570 . . . . . . . . . . 2 25684 1 >> 252 2 7.741 . 90.2729485723 . . . . . . . . . . 2 25684 1 >> 252 3 119.083 . 31.7318175236 . . . . . . . . . . 2 25684 1 >> 253 1 7.741 . 54.3566400291 . . . . . . . . . . 2 25684 1 >> 253 2 7.741 . 97.9076964467 . . . . . . . . . . 2 25684 1 >> 253 3 121.065 . 53.5751485825 . . . . . . . . . . 2 25684 1 >> 254 1 7.741 . 61.8258467974 . . . . . . . . . . 2 25684 1 >> 254 2 4.691 . 76.3194521376 . . . . . . . . . . 2 25684 1 >> 254 3 121.065 . 32.5481339296 . . . . . . . . . . 2 25684 1 >> 255 1 7.741 . 47.2679450412 . . . . . . . . . . 2 25684 1 >> 255 2 1.148 . 51.4253194584 . . . . . . . . . . 2 25684 1 >> 255 3 121.065 . 31.7392834028 . . . . . . . . . . 2 25684 1 >> 256 1 7.741 . 58.8489408223 . . . . . . . . . . 2 25684 1 >> 256 2 4.228 . 64.4466809921 . . . . . . . . . . 2 25684 1 >> 256 3 121.065 . 37.7196638783 . . . . . . . . . . 2 25684 1 >> 257 1 7.955 . 34.7117215151 . . . . . . . . . . 2 25684 1 >> 257 2 4.692 . 67.0701715432 . . . . . . . . . . 2 25684 1 >> 257 3 119.083 . 35.1498519381 . . . . . . . . . . 2 25684 1 >> 258 1 7.955 . 196.6347844180 . . . . . . . . . . 2 25684 1 >> 258 2 3.299 . 184.3014624050 . . . . . . . . . . 2 25684 1 >> 258 3 119.083 . 46.0023524364 . . . . . . . . . . 2 25684 1 >> 259 1 7.955 . 119.2189309210 . . . . . . . . . . 2 25684 1 >> 259 2 3.214 . 168.1100914950 . . . . . . . . . . 2 25684 1 >> 259 3 119.083 . 42.8217470646 . . . . . . . . . . 2 25684 1 >> 260 1 8.281 . 23.6442835916 . . . . . . . . . . 2 25684 1 >> 260 2 4.440 . 115.3485034810 . . . . . . . . . . 2 25684 1 >> 260 3 117.677 . 23.7434677283 . . . . . . . . . . 2 25684 1 >> 261 1 8.443 . 22.2097142653 . . . . . . . . . . 2 25684 1 >> 261 2 8.442 . 44.4186678529 . . . . . . . . . . 2 25684 1 >> 261 3 120.624 . 56.0214917858 . . . . . . . . . . 2 25684 1 >> 262 1 8.153 . 20.0829727229 . . . . . . . . . . 2 25684 1 >> 262 2 8.153 . 36.1353042299 . . . . . . . . . . 2 25684 1 >> 262 3 123.242 . 26.2511579196 . . . . . . . . . . 2 25684 1 >> 263 1 8.312 . 16.4624563498 . . . . . . . . . . 2 25684 1 >> 263 2 8.312 . 42.0867040561 . . . . . . . . . . 2 25684 1 >> 263 3 122.510 . 19.9681628247 . . . . . . . . . . 2 25684 1 >> 264 1 7.932 . 15.8680730004 . . . . . . . . . . 2 25684 1 >> 264 2 2.589 . 42.3497037289 . . . . . . . . . . 2 25684 1 >> 264 3 127.795 . 21.4393283923 . . . . . . . . . . 2 25684 1 >> 265 1 7.797 . 49.8959376791 . . . . . . . . . . 2 25684 1 >> 265 2 3.299 . 120.7951741540 . . . . . . . . . . 2 25684 1 >> 265 3 111.214 . 32.8025372823 . . . . . . . . . . 2 25684 1 >> 266 1 7.437 . 38.6791555341 . . . . . . . . . . 2 25684 1 >> 266 2 0.657 . 80.1430820137 . . . . . . . . . . 2 25684 1 >> 266 3 120.411 . 37.4222965042 . . . . . . . . . . 2 25684 1 >> 267 1 7.797 . 40.2494318591 . . . . . . . . . . 2 25684 1 >> 267 2 0.657 . 64.9896964915 . . . . . . . . . . 2 25684 1 >> 267 3 111.214 . 31.1789198716 . . . . . . . . . . 2 25684 1 >> 268 1 7.955 . 49.1312553510 . . . . . . . . . . 2 25684 1 >> 268 2 1.935 . 99.2702399464 . . . . . . . . . . 2 25684 1 >> 268 3 119.060 . 57.5948201617 . . . . . . . . . . 2 25684 1 >> 269 1 7.954 . 187.1702191080 . . . . . . . . . . 2 25684 1 >> 269 2 1.148 . 61.3602509599 . . . . . . . . . . 2 25684 1 >> 269 3 119.060 . 34.9934206406 . . . . . . . . . . 2 25684 1 >> 270 1 7.797 . 35.2834870314 . . . . . . . . . . 2 25684 1 >> 270 2 3.215 . 149.1245680200 . . . . . . . . . . 2 25684 1 >> 270 3 111.214 . 44.8697926601 . . . . . . . . . . 2 25684 1 >> 271 1 7.797 . 130.2424636390 . . . . . . . . . . 2 25684 1 >> 271 2 0.705 . 182.0122892310 . . . . . . . . . . 2 25684 1 >> 271 3 111.214 . 34.9415820837 . . . . . . . . . . 2 25684 1 >> 272 1 8.243 . 33.0812418402 . . . . . . . . . . 2 25684 1 >> 272 2 0.527 . 49.8288038426 . . . . . . . . . . 2 25684 1 >> 272 3 121.301 . 26.1153634389 . . . . . . . . . . 2 25684 1 >> 273 1 7.743 . 139.9807712520 . . . . . . . . . . 2 25684 1 >> 273 2 0.534 . 52.4532953440 . . . . . . . . . . 2 25684 1 >> 273 3 119.314 . 29.0957282980 . . . . . . . . . . 2 25684 1 >> 274 1 7.747 . 31.7248370842 . . . . . . . . . . 2 25684 1 >> 274 2 3.295 . 85.4015740436 . . . . . . . . . . 2 25684 1 >> 274 3 121.024 . 34.7965609034 . . . . . . . . . . 2 25684 1 >> 275 1 7.437 . 50.9450059971 . . . . . . . . . . 2 25684 1 >> 275 2 7.222 . 57.7928643425 . . . . . . . . . . 2 25684 1 >> 275 3 120.432 . 35.9303180377 . . . . . . . . . . 2 25684 1 >> 276 1 7.743 . 85.1441675001 . . . . . . . . . . 2 25684 1 >> 276 2 7.484 . 103.9739553120 . . . . . . . . . . 2 25684 1 >> 276 3 121.041 . 52.4325873454 . . . . . . . . . . 2 25684 1 >> 277 1 8.153 . 16.5941719661 . . . . . . . . . . 2 25684 1 >> 277 2 1.195 . 74.3095440770 . . . . . . . . . . 2 25684 1 >> 277 3 123.242 . 22.0482553542 . . . . . . . . . . 2 25684 1 >> 278 1 7.695 . 30.1066641715 . . . . . . . . . . 2 25684 1 >> 278 2 7.413 . 56.1645685569 . . . . . . . . . . 2 25684 1 >> 278 3 111.184 . 34.9825739861 . . . . . . . . . . 2 25684 1 >> 279 1 8.192 . 20.6397705555 . . . . . . . . . . 2 25684 1 >> 279 2 8.376 . 51.8365848839 . . . . . . . . . . 2 25684 1 >> 279 3 116.316 . 20.5313788851 . . . . . . . . . . 2 25684 1 >> 280 1 7.741 . 35.5419290361 . . . . . . . . . . 2 25684 1 >> 280 2 7.288 . 79.4401647151 . . . . . . . . . . 2 25684 1 >> 280 3 121.041 . 33.6981610457 . . . . . . . . . . 2 25684 1 >> 281 1 7.742 . 75.7773910571 . . . . . . . . . . 2 25684 1 >> 281 2 3.215 . 186.1211899220 . . . . . . . . . . 2 25684 1 >> 281 3 121.041 . 42.1817240119 . . . . . . . . . . 2 25684 1 >> 282 1 8.280 . 26.7648793299 . . . . . . . . . . 2 25684 1 >> 282 2 8.187 . 130.8509703950 . . . . . . . . . . 2 25684 1 >> 282 3 117.677 . 27.9440107942 . . . . . . . . . . 2 25684 1 >> 283 1 8.187 . 29.7950037359 . . . . . . . . . . 2 25684 1 >> 283 2 3.619 . 83.7730280205 . . . . . . . . . . 2 25684 1 >> 283 3 113.615 . 25.4658319553 . . . . . . . . . . 2 25684 1 >> 284 1 7.956 . 32.1296297738 . . . . . . . . . . 2 25684 1 >> 284 2 3.619 . 93.3326031859 . . . . . . . . . . 2 25684 1 >> 284 3 119.055 . 29.3256210287 . . . . . . . . . . 2 25684 1 >> 285 1 8.283 . 21.6489250503 . . . . . . . . . . 2 25684 1 >> 285 2 3.619 . 66.2068519704 . . . . . . . . . . 2 25684 1 >> 285 3 117.677 . 22.8528446953 . . . . . . . . . . 2 25684 1 >> 286 1 7.742 . 38.3222594323 . . . . . . . . . . 2 25684 1 >> 286 2 3.895 . 159.9813746830 . . . . . . . . . . 2 25684 1 >> 286 3 119.251 . 32.8799429536 . . . . . . . . . . 2 25684 1 >> 287 1 7.742 . 32.0115513803 . . . . . . . . . . 2 25684 1 >> 287 2 8.286 . 72.6380823128 . . . . . . . . . . 2 25684 1 >> 287 3 119.251 . 44.0496024489 . . . . . . . . . . 2 25684 1 >> 288 1 7.857 . 36.0914093346 . . . . . . . . . . 2 25684 1 >> 288 2 0.672 . 57.1097158109 . . . . . . . . . . 2 25684 1 >> 288 3 119.215 . 29.1952498754 . . . . . . . . . . 2 25684 1 >> 289 1 7.857 . 40.3379075004 . . . . . . . . . . 2 25684 1 >> 289 2 1.289 . 62.8291454214 . . . . . . . . . . 2 25684 1 >> 289 3 119.215 . 31.9195914268 . . . . . . . . . . 2 25684 1 >> 290 1 7.857 . 36.9565414509 . . . . . . . . . . 2 25684 1 >> 290 2 1.412 . 69.2747644234 . . . . . . . . . . 2 25684 1 >> 290 3 119.215 . 30.0284701586 . . . . . . . . . . 2 25684 1 >> 291 1 7.857 . 39.7342109255 . . . . . . . . . . 2 25684 1 >> 291 2 1.460 . 74.8860914091 . . . . . . . . . . 2 25684 1 >> 291 3 119.215 . 33.1361775597 . . . . . . . . . . 2 25684 1 >> 292 1 7.695 . 37.8422957092 . . . . . . . . . . 2 25684 1 >> 292 2 7.220 . 52.5416292017 . . . . . . . . . . 2 25684 1 >> 292 3 111.194 . 44.5201641321 . . . . . . . . . . 2 25684 1 >> 293 1 7.695 . 32.9272410060 . . . . . . . . . . 2 25684 1 >> 293 2 0.532 . 52.7891141459 . . . . . . . . . . 2 25684 1 >> 293 3 111.194 . 35.7092998425 . . . . . . . . . . 2 25684 1 >> 294 1 8.279 . 25.7530639136 . . . . . . . . . . 2 25684 1 >> 294 2 10.031 . 53.7398604653 . . . . . . . . . . 2 25684 1 >> 294 3 109.691 . 27.4764072895 . . . . . . . . . . 2 25684 1 >> 295 1 8.279 . 36.8384630575 . . . . . . . . . . 2 25684 1 >> 295 2 7.436 . 56.7463708777 . . . . . . . . . . 2 25684 1 >> 295 3 109.691 . 31.4975579580 . . . . . . . . . . 2 25684 1 >> 296 1 8.279 . 29.1347625783 . . . . . . . . . . 2 25684 1 >> 296 2 7.223 . 47.0799442752 . . . . . . . . . . 2 25684 1 >> 296 3 109.691 . 27.9925390085 . . . . . . . . . . 2 25684 1 >> 297 1 8.279 . 32.7971884656 . . . . . . . . . . 2 25684 1 >> 297 2 0.523 . 61.6450213001 . . . . . . . . . . 2 25684 1 >> 297 3 109.691 . 29.0353673697 . . . . . . . . . . 2 25684 1 >> 298 1 7.953 . 30.3265228139 . . . . . . . . . . 2 25684 1 >> 298 2 2.804 . 86.6547637308 . . . . . . . . . . 2 25684 1 >> 298 3 119.044 . 43.3909851313 . . . . . . . . . . 2 25684 1 >> 299 1 8.189 . 23.0439131687 . . . . . . . . . . 2 25684 1 >> 299 2 2.804 . 76.8839880669 . . . . . . . . . . 2 25684 1 >> 299 3 113.645 . 27.1596004566 . . . . . . . . . . 2 25684 1 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 1 2 . 2 . . 7.749 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 1 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 2 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 2 2 . 1 . . 4.459 . 4 1 1 3 MET HA . . . . . . 195 . 25684 1 >> 2 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 3 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 3 2 . 1 . . 4.364 . 4 1 1 2 ALA HA . . . . . . 193 . 25684 1 >> 3 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 4 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 4 2 . 1 . . 2.622 . 4 1 1 3 MET HB2 . . . . . . 198 . 25684 1 >> 4 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 5 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 5 2 . 1 . . 2.557 . 4 1 1 3 MET HB2 . . . . . . 198 . 25684 1 >> 5 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 6 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 6 2 . 1 . . 2.131 . 4 1 1 3 MET HG2 . . . . . . 196 . 25684 1 >> 6 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 7 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 7 2 . 1 . . 2.030 . 4 1 1 3 MET HG3 . . . . . . 197 . 25684 1 >> 7 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 8 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 8 2 . 1 . . 1.401 . 4 1 1 2 ALA MB . . . . . . 194 . 25684 1 >> 8 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 9 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 9 2 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 9 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 10 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 10 2 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 10 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 11 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 11 2 . 1 . . 4.461 . 4 1 1 3 MET HA . . . . . . 195 . 25684 1 >> 11 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 12 1 . 2 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 12 2 . 2 . . 3.992 . 4 1 1 4 GLY HA2 . . . . . . 199 . 25684 1 >> 12 3 . 2 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 13 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 13 2 . 1 . . 2.123 . 4 1 1 3 MET HG2 . . . . . . 196 . 25684 1 >> 13 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 14 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 14 2 . 1 . . 2.030 . 4 1 1 3 MET HG3 . . . . . . 197 . 25684 1 >> 14 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 15 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 15 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 16 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 16 2 . 1 . . 0.944 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 16 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 17 1 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 17 2 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 17 3 . 1 . . 115.680 . 4 1 1 5 SER N . . . . . . 50 . 25684 1 >> 18 1 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 18 2 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 18 3 . 1 . . 115.680 . 4 1 1 5 SER N . . . . . . 50 . 25684 1 >> 19 1 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 19 2 . 1 . . 4.510 . 4 1 1 5 SER HA . . . . . . 200 . 25684 1 >> 19 3 . 1 . . 115.680 . 4 1 1 5 SER N . . . . . . 50 . 25684 1 >> 20 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 20 2 . 1 . . 4.510 . 4 1 1 5 SER HA . . . . . . 200 . 25684 1 >> 20 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 21 1 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 21 2 . 1 . . 3.992 . 4 1 1 4 GLY HA2 . . . . . . 199 . 25684 1 >> 21 3 . 1 . . 115.680 . 4 1 1 5 SER N . . . . . . 50 . 25684 1 >> 22 1 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 22 2 . 1 . . 3.875 . 4 1 1 5 SER HB2 . . . . . . 201 . 25684 1 >> 22 3 . 1 . . 115.680 . 4 1 1 5 SER N . . . . . . 50 . 25684 1 >> 23 1 . 1 . . 8.155 . 4 1 1 5 SER H . . . . . . 49 . 25684 1 >> 23 2 . 1 . . 0.944 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 23 3 . 1 . . 115.680 . 4 1 1 5 SER N . . . . . . 50 . 25684 1 >> 24 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 24 2 . 1 . . 0.944 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 24 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 25 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 25 2 . 1 . . 2.120 . 4 1 1 6 VAL HB . . . . . . 203 . 25684 1 >> 25 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 26 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 26 2 . 1 . . 3.880 . 4 1 1 5 SER HB2 . . . . . . 201 . 25684 1 >> 26 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 27 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 27 2 . 1 . . 4.178 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 1 >> 27 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 28 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 28 2 . 1 . . 8.375 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 28 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 29 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 29 2 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 29 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 30 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 30 2 . 1 . . 2.726 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 1 >> 30 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 31 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 31 2 . 1 . . 2.619 . 4 1 1 7 ASP HB3 . . . . . . 206 . 25684 1 >> 31 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 32 1 . 1 . . 8.377 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 32 2 . 1 . . 0.944 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 32 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 33 1 . 1 . . 8.190 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 33 2 . 1 . . 0.944 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 33 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 34 1 . 1 . . 8.375 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 34 2 . 1 . . 2.124 . 4 1 1 6 VAL HB . . . . . . 203 . 25684 1 >> 34 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 35 1 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 35 2 . 1 . . 2.619 . 4 1 1 7 ASP HB3 . . . . . . 206 . 25684 1 >> 35 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 36 1 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 36 2 . 1 . . 2.726 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 1 >> 36 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 37 1 . 1 . . 8.189 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 37 2 . 1 . . 2.619 . 4 1 1 7 ASP HB3 . . . . . . 206 . 25684 1 >> 37 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 38 1 . 1 . . 8.189 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 38 2 . 1 . . 2.721 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 1 >> 38 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 39 1 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 39 2 . 1 . . 4.177 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 1 >> 39 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 40 1 . 1 . . 8.375 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 40 2 . 1 . . 4.639 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 1 >> 40 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 41 1 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 41 2 . 1 . . 8.193 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 41 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 42 1 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 42 2 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 42 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 43 1 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 43 2 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 43 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 44 1 . 1 . . 8.191 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 44 2 . 1 . . 8.191 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 44 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 45 1 . 1 . . 8.191 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 45 2 . 1 . . 4.641 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 1 >> 45 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 46 1 . 1 . . 8.191 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 46 2 . 1 . . 4.420 . 4 1 1 8 SER HA . . . . . . 208 . 25684 1 >> 46 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 47 1 . 1 . . 8.191 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 47 2 . 1 . . 4.164 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 1 >> 47 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 48 1 . 1 . . 8.190 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 48 2 . 1 . . 3.852 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 1 >> 48 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 49 1 . 1 . . 8.191 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 49 2 . 1 . . 1.401 . 4 1 1 9 ALA MB . . . . . . 212 . 25684 1 >> 49 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 50 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 50 2 . 1 . . 1.401 . 4 1 1 9 ALA MB . . . . . . 212 . 25684 1 >> 50 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 51 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 51 2 . 1 . . 2.627 . 4 1 1 10 ASP HB3 . . . . . . 215 . 25684 1 >> 51 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 52 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 52 2 . 4 . . 2.722 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 1 >> 52 3 . 1 . . 125.749 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 53 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 53 2 . 1 . . 3.852 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 1 >> 53 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 54 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 54 2 . 1 . . 3.917 . 4 1 1 8 SER HB2 . . . . . . 209 . 25684 1 >> 54 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 55 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 55 2 . 1 . . 4.309 . 4 1 1 9 ALA HA . . . . . . 211 . 25684 1 >> 55 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 56 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 56 2 . 1 . . 4.407 . 4 1 1 8 SER HA . . . . . . 208 . 25684 1 >> 56 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 57 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 57 2 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 57 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 58 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 58 2 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 58 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 59 1 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 59 2 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 59 3 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 1 >> 60 1 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 60 2 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 60 3 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 1 >> 61 1 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 61 2 . 1 . . 4.581 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 1 >> 61 3 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 1 >> 62 1 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 62 2 . 1 . . 4.309 . 4 1 1 9 ALA HA . . . . . . 211 . 25684 1 >> 62 3 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 1 >> 63 1 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 63 2 . 1 . . 2.712 . 4 1 1 10 ASP HB2 . . . . . . 214 . 25684 1 >> 63 3 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 1 >> 64 1 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 64 2 . 1 . . 2.630 . 4 1 1 10 ASP HB3 . . . . . . 215 . 25684 1 >> 64 3 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 1 >> 65 1 . 1 . . 8.155 . 4 1 1 10 ASP H . . . . . . 9 . 25684 1 >> 65 2 . 1 . . 1.401 . 4 1 1 9 ALA MB . . . . . . 212 . 25684 1 >> 65 3 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 1 >> 66 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 66 2 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 66 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 67 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 67 2 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 67 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 68 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 68 2 . 1 . . 4.578 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 1 >> 68 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 69 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 69 2 . 1 . . 4.309 . 4 1 1 9 ALA HA . . . . . . 211 . 25684 1 >> 69 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 70 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 70 2 . 1 . . 3.982 . 4 1 1 12 GLY HA3 . . . . . . 219 . 25684 1 >> 70 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 71 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 71 2 . 1 . . 2.712 . 4 1 1 10 ASP HB2 . . . . . . 214 . 25684 1 >> 71 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 72 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 72 2 . 1 . . 2.628 . 4 1 1 10 ASP HB3 . . . . . . 215 . 25684 1 >> 72 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 73 1 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 73 2 . 1 . . 1.420 . 4 1 1 11 ALA MB . . . . . . 216 . 25684 1 >> 73 3 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 1 >> 74 1 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 74 2 . 1 . . 8.194 . 4 1 1 11 ALA H . . . . . . 37 . 25684 1 >> 74 3 . 1 . . 107.544 . 4 1 1 12 GLY N . . . . . . 48 . 25684 1 >> 75 1 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 75 2 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 75 3 . 1 . . 107.544 . 4 1 1 12 GLY N . . . . . . 48 . 25684 1 >> 76 1 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 76 2 . 1 . . 4.309 . 4 1 1 9 ALA HA . . . . . . 211 . 25684 1 >> 76 3 . 1 . . 107.544 . 4 1 1 12 GLY N . . . . . . 48 . 25684 1 >> 77 1 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 77 2 . 1 . . 3.973 . 4 1 1 12 GLY HA3 . . . . . . 219 . 25684 1 >> 77 3 . 1 . . 107.544 . 4 1 1 12 GLY N . . . . . . 48 . 25684 1 >> 78 1 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 78 2 . 1 . . 2.712 . 4 1 1 10 ASP HB2 . . . . . . 214 . 25684 1 >> 78 3 . 1 . . 107.544 . 4 1 1 12 GLY N . . . . . . 48 . 25684 1 >> 79 1 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 79 2 . 1 . . 2.624 . 4 1 1 10 ASP HB3 . . . . . . 215 . 25684 1 >> 79 3 . 1 . . 107.544 . 4 1 1 12 GLY N . . . . . . 48 . 25684 1 >> 80 1 . 1 . . 8.398 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 80 2 . 1 . . 1.413 . 4 1 1 11 ALA MB . . . . . . 216 . 25684 1 >> 80 3 . 1 . . 107.544 . 4 1 1 12 GLY N . . . . . . 48 . 25684 1 >> 81 1 . 1 . . 8.239 . 4 1 1 13 GLY H . . . . . . 45 . 25684 1 >> 81 2 . 1 . . 1.424 . 4 1 1 11 ALA MB . . . . . . 216 . 25684 1 >> 81 3 . 1 . . 108.422 . 4 1 1 13 GLY N . . . . . . 46 . 25684 1 >> 82 1 . 1 . . 8.239 . 4 1 1 13 GLY H . . . . . . 45 . 25684 1 >> 82 2 . 1 . . 2.632 . 4 1 1 10 ASP HB3 . . . . . . 215 . 25684 1 >> 82 3 . 1 . . 108.422 . 4 1 1 13 GLY N . . . . . . 46 . 25684 1 >> 83 1 . 1 . . 8.239 . 4 1 1 13 GLY H . . . . . . 45 . 25684 1 >> 83 2 . 1 . . 2.712 . 4 1 1 10 ASP HB2 . . . . . . 214 . 25684 1 >> 83 3 . 1 . . 108.422 . 4 1 1 13 GLY N . . . . . . 46 . 25684 1 >> 84 1 . 1 . . 8.239 . 4 1 1 13 GLY H . . . . . . 45 . 25684 1 >> 84 2 . 1 . . 3.984 . 4 1 1 13 GLY HA3 . . . . . . 221 . 25684 1 >> 84 3 . 1 . . 108.422 . 4 1 1 13 GLY N . . . . . . 46 . 25684 1 >> 85 1 . 1 . . 8.239 . 4 1 1 13 GLY H . . . . . . 45 . 25684 1 >> 85 2 . 1 . . 8.239 . 4 1 1 13 GLY H . . . . . . 45 . 25684 1 >> 85 3 . 1 . . 108.422 . 4 1 1 13 GLY N . . . . . . 46 . 25684 1 >> 86 1 . 1 . . 8.239 . 4 1 1 13 GLY H . . . . . . 45 . 25684 1 >> 86 2 . 1 . . 8.394 . 4 1 1 12 GLY H . . . . . . 47 . 25684 1 >> 86 3 . 1 . . 108.422 . 4 1 1 13 GLY N . . . . . . 46 . 25684 1 >> 87 1 . 1 . . 8.372 . 4 1 1 14 GLY H . . . . . . 13 . 25684 1 >> 87 2 . 1 . . 4.004 . 4 1 1 14 GLY HA3 . . . . . . 223 . 25684 1 >> 87 3 . 1 . . 108.775 . 4 1 1 14 GLY N . . . . . . 14 . 25684 1 >> 88 1 . 1 . . 8.371 . 4 1 1 14 GLY H . . . . . . 13 . 25684 1 >> 88 2 . 1 . . 8.372 . 4 1 1 14 GLY H . . . . . . 13 . 25684 1 >> 88 3 . 1 . . 108.755 . 4 1 1 14 GLY N . . . . . . 14 . 25684 1 >> 89 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 1 >> 89 2 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 89 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 1 >> 90 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 1 >> 90 2 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 1 >> 90 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 1 >> 91 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 1 >> 91 2 . 1 . . 4.467 . 4 1 1 15 SER HA . . . . . . 224 . 25684 1 >> 91 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 1 >> 92 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 1 >> 92 2 . 1 . . 4.009 . 4 1 1 14 GLY HA3 . . . . . . 223 . 25684 1 >> 92 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 1 >> 93 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 1 >> 93 2 . 1 . . 3.852 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 1 >> 93 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 1 >> 94 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 94 2 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 94 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 95 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 95 2 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 95 3 . 1 . . 119.213 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 96 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 96 2 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 96 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 97 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 97 2 . 2 . . 7.413 . 4 1 1 17 TRP HD1 . . . . . . 311 . 25684 1 >> 97 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 98 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 98 2 . 2 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 98 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 99 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 99 2 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 99 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 100 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 100 2 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 100 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 101 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 101 2 . 2 . . 7.413 . 4 1 1 17 TRP HD1 . . . . . . 311 . 25684 1 >> 101 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 102 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 102 2 . 1 . . 6.781 . 4 1 1 17 TRP HE3 . . . . . . 330 . 25684 1 >> 102 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 103 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 103 2 . 1 . . 10.321 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 1 >> 103 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 104 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 104 2 . 2 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 104 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 1 >> 105 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 105 2 . 1 . . 4.469 . 4 1 1 15 SER HA . . . . . . 224 . 25684 1 >> 105 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 1 >> 106 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 106 2 . 2 . . 3.995 . 4 1 1 16 GLY HA3 . . . . . . 312 . 25684 1 >> 106 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 1 >> 107 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 107 2 . 1 . . 3.852 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 1 >> 107 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 1 >> 108 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 108 2 . 1 . . 3.247 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 1 >> 108 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 1 >> 109 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 1 >> 109 2 . 2 . . 3.339 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 1 >> 109 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 1 >> 110 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 110 2 . 1 . . 0.678 . 4 1 1 18 LEU MD1 . . . . . . 289 . 25684 1 >> 110 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 111 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 111 2 . 1 . . 0.678 . 4 1 1 18 LEU MD1 . . . . . . 289 . 25684 1 >> 111 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 112 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 112 2 . 1 . . 1.404 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 1 >> 112 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 113 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 113 2 . 1 . . 1.456 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 1 >> 113 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 114 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 114 2 . 1 . . 3.247 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 1 >> 114 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 115 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 115 2 . 1 . . 3.995 . 4 1 1 16 GLY HA3 . . . . . . 312 . 25684 1 >> 115 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 116 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 116 2 . 1 . . 4.507 . 4 1 1 17 TRP HA . . . . . . 227 . 25684 1 >> 116 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 117 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 117 2 . 1 . . 4.507 . 4 1 1 17 TRP HA . . . . . . 227 . 25684 1 >> 117 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 118 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 118 2 . 1 . . 4.029 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 1 >> 118 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 119 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 119 2 . 1 . . 3.247 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 1 >> 119 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 120 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 120 2 . 2 . . 3.339 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 1 >> 120 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 121 1 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 121 2 . 3 . . 0.531 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 1 >> 121 3 . 1 . . 119.225 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 122 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 122 2 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 122 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 123 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 123 2 . 1 . . 7.858 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 123 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 124 1 . 2 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 124 2 . 1 . . 8.285 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 124 3 . 2 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 125 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 125 2 . 2 . . 4.173 . 4 1 1 19 THR HB . . . . . . 314 . 25684 1 >> 125 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 126 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 126 2 . 1 . . 4.020 . 4 1 1 19 THR HA . . . . . . 233 . 25684 1 >> 126 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 127 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 127 2 . 1 . . 3.339 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 1 >> 127 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 128 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 128 2 . 1 . . 3.247 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 1 >> 128 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 129 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 129 2 . 2 . . 1.164 . 4 1 1 19 THR MG . . . . . . 317 . 25684 1 >> 129 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 130 1 . 1 . . 8.285 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 130 2 . 1 . . 8.285 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 130 3 . 1 . . 109.641 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 131 1 . 1 . . 8.285 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 131 2 . 1 . . 4.176 . 4 1 1 19 THR HB . . . . . . 314 . 25684 1 >> 131 3 . 1 . . 109.641 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 132 1 . 1 . . 8.285 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 132 2 . 3 . . 4.020 . 4 1 1 19 THR HA . . . . . . 233 . 25684 1 >> 132 3 . 1 . . 109.641 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 133 1 . 1 . . 8.285 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 133 2 . 1 . . 3.893 . 4 1 1 20 GLY HA3 . . . . . . 315 . 25684 1 >> 133 3 . 1 . . 109.641 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 134 1 . 1 . . 8.285 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 134 2 . 2 . . 1.164 . 4 1 1 19 THR MG . . . . . . 317 . 25684 1 >> 134 3 . 1 . . 109.641 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 135 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 135 2 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 135 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 136 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 136 2 . 1 . . 10.019 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 1 >> 136 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 137 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 137 2 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 137 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 138 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 138 2 . 1 . . 7.221 . 4 1 1 21 TRP HD1 . . . . . . 363 . 25684 1 >> 138 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 139 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 139 2 . 1 . . 4.513 . 4 1 1 17 TRP HA . . . . . . 227 . 25684 1 >> 139 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 140 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 140 2 . 3 . . 4.548 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 1 >> 140 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 141 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 141 2 . 1 . . 3.250 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 1 >> 141 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 142 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 142 2 . 1 . . 3.137 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 1 >> 142 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 143 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 143 2 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 143 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 144 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 144 2 . 2 . . 4.544 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 1 >> 144 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 145 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 145 2 . 1 . . 3.250 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 1 >> 145 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 146 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 146 2 . 1 . . 3.137 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 1 >> 146 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 147 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 147 2 . 1 . . 1.419 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 1 >> 147 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 148 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 148 2 . 1 . . 0.705 . 4 1 1 22 LEU MD1 . . . . . . 316 . 25684 1 >> 148 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 149 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 149 2 . 1 . . 4.228 . 4 1 1 24 THR HA . . . . . . 240 . 25684 1 >> 149 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 150 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 150 2 . 2 . . 1.692 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 1 >> 150 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 151 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 151 2 . 1 . . 1.419 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 1 >> 151 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 152 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 152 2 . 1 . . 1.148 . 4 1 1 24 THR MG . . . . . . 320 . 25684 1 >> 152 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 153 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 153 2 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 153 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 154 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 154 2 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 154 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 155 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 155 2 . 1 . . 4.353 . 4 1 1 28 THR HB . . . . . . 322 . 25684 1 >> 155 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 156 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 156 2 . 1 . . 4.235 . 4 1 1 28 THR HA . . . . . . 323 . 25684 1 >> 156 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 157 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 157 2 . 1 . . 2.251 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 1 >> 157 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 158 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 158 2 . 1 . . 1.945 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 1 >> 158 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 159 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 159 2 . 1 . . 1.209 . 4 1 1 28 THR MG . . . . . . 250 . 25684 1 >> 159 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 160 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 160 2 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 160 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 161 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 161 2 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 161 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 162 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 162 2 . 1 . . 4.535 . 4 1 1 29 SER HA . . . . . . 251 . 25684 1 >> 162 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 163 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 163 2 . 1 . . 4.435 . 4 1 1 27 PRO HA . . . . . . 324 . 25684 1 >> 163 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 164 1 . 1 . . 8.194 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 164 2 . 1 . . 4.535 . 4 1 1 29 SER HA . . . . . . 251 . 25684 1 >> 164 3 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 1 >> 165 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 165 2 . 1 . . 4.348 . 4 1 1 28 THR HB . . . . . . 322 . 25684 1 >> 165 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 166 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 166 2 . 1 . . 4.239 . 4 1 1 28 THR HA . . . . . . 323 . 25684 1 >> 166 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 167 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 167 2 . 1 . . 3.876 . 4 1 1 29 SER HB3 . . . . . . 253 . 25684 1 >> 167 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 168 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 168 2 . 1 . . 2.259 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 1 >> 168 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 169 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 169 2 . 1 . . 1.943 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 1 >> 169 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 170 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 170 2 . 1 . . 1.205 . 4 1 1 28 THR MG . . . . . . 250 . 25684 1 >> 170 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 171 1 . 1 . . 8.193 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 171 2 . 1 . . 1.184 . 4 1 1 30 THR MG . . . . . . 256 . 25684 1 >> 171 3 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 1 >> 172 1 . 1 . . 8.193 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 172 2 . 1 . . 1.943 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 1 >> 172 3 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 1 >> 173 1 . 1 . . 8.194 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 173 2 . 1 . . 3.876 . 4 1 1 29 SER HB3 . . . . . . 253 . 25684 1 >> 173 3 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 1 >> 174 1 . 1 . . 8.193 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 174 2 . 1 . . 4.263 . 4 1 1 30 THR HA . . . . . . 325 . 25684 1 >> 174 3 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 1 >> 175 1 . 1 . . 8.193 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 175 2 . 1 . . 4.375 . 4 1 1 31 SER HA . . . . . . 326 . 25684 1 >> 175 3 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 1 >> 176 1 . 1 . . 8.192 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 176 2 . 1 . . 8.194 . 4 1 1 30 THR H . . . . . . 129 . 25684 1 >> 176 3 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 1 >> 177 1 . 1 . . 8.214 . 4 1 1 31 SER H . . . . . . 99 . 25684 1 >> 177 2 . 1 . . 8.214 . 4 1 1 31 SER H . . . . . . 99 . 25684 1 >> 177 3 . 1 . . 117.746 . 4 1 1 31 SER N . . . . . . 98 . 25684 1 >> 178 1 . 1 . . 8.214 . 4 1 1 31 SER H . . . . . . 99 . 25684 1 >> 178 2 . 1 . . 4.375 . 4 1 1 31 SER HA . . . . . . 326 . 25684 1 >> 178 3 . 1 . . 117.746 . 4 1 1 31 SER N . . . . . . 98 . 25684 1 >> 179 1 . 1 . . 8.214 . 4 1 1 31 SER H . . . . . . 99 . 25684 1 >> 179 2 . 2 . . 4.262 . 4 1 1 30 THR HA . . . . . . 325 . 25684 1 >> 179 3 . 1 . . 117.746 . 4 1 1 31 SER N . . . . . . 98 . 25684 1 >> 180 1 . 1 . . 8.214 . 4 1 1 31 SER H . . . . . . 99 . 25684 1 >> 180 2 . 1 . . 3.819 . 4 1 1 31 SER HB2 . . . . . . 291 . 25684 1 >> 180 3 . 1 . . 117.746 . 4 1 1 31 SER N . . . . . . 98 . 25684 1 >> 181 1 . 1 . . 8.215 . 4 1 1 31 SER H . . . . . . 99 . 25684 1 >> 181 2 . 1 . . 1.184 . 4 1 1 30 THR MG . . . . . . 256 . 25684 1 >> 181 3 . 1 . . 117.746 . 4 1 1 31 SER N . . . . . . 98 . 25684 1 >> 182 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 182 2 . 2 . . 8.450 . 4 1 1 32 HIS H . . . . . . 337 . 25684 1 >> 182 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 183 1 . 1 . . 8.155 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 183 2 . 2 . . 4.303 . 4 1 1 33 LEU HA . . . . . . 327 . 25684 1 >> 183 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 184 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 184 2 . 1 . . 3.819 . 4 1 1 31 SER HB2 . . . . . . 291 . 25684 1 >> 184 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 185 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 185 2 . 1 . . 3.249 . 4 1 1 32 HIS HB2 . . . . . . 258 . 25684 1 >> 185 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 186 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 186 2 . 1 . . 3.128 . 4 1 1 32 HIS HB3 . . . . . . 259 . 25684 1 >> 186 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 187 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 187 2 . 2 . . 1.578 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 1 >> 187 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 188 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 188 2 . 1 . . 1.519 . 4 1 1 33 LEU HG . . . . . . 263 . 25684 1 >> 188 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 189 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 189 2 . 2 . . 1.629 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 1 >> 189 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 190 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 190 2 . 2 . . 0.912 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 1 >> 190 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 191 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 191 2 . 1 . . 0.849 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 1 >> 191 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 192 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 192 2 . 1 . . 0.847 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 1 >> 192 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 193 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 193 2 . 1 . . 0.913 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 1 >> 193 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 194 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 194 2 . 1 . . 1.432 . 4 1 1 34 LYS HG3 . . . . . . 269 . 25684 1 >> 194 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 195 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 195 2 . 1 . . 1.720 . 4 1 1 34 LYS HD2 . . . . . . 270 . 25684 1 >> 195 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 196 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 196 2 . 1 . . 1.748 . 4 1 1 34 LYS HD3 . . . . . . 271 . 25684 1 >> 196 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 197 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 197 2 . 1 . . 1.805 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 1 >> 197 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 198 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 198 2 . 1 . . 1.848 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 1 >> 198 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 199 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 199 2 . 1 . . 4.301 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 1 >> 199 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 200 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 200 2 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 200 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 201 1 . 1 . . 8.282 . 4 1 1 34 LYS H . . . . . . 29 . 25684 1 >> 201 2 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 201 3 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 1 >> 202 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 202 2 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 202 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 203 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 203 2 . 1 . . 4.283 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 1 >> 203 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 204 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 204 2 . 1 . . 2.297 . 4 1 1 35 GLU HG2 . . . . . . 277 . 25684 1 >> 204 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 205 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 205 2 . 1 . . 2.072 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 1 >> 205 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 206 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 206 2 . 1 . . 1.950 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 1 >> 206 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 207 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 207 2 . 1 . . 1.852 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 1 >> 207 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 208 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 208 2 . 1 . . 1.805 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 1 >> 208 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 209 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 209 2 . 1 . . 1.751 . 4 1 1 34 LYS HD3 . . . . . . 271 . 25684 1 >> 209 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 210 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 210 2 . 1 . . 1.719 . 4 1 1 34 LYS HD2 . . . . . . 270 . 25684 1 >> 210 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 211 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 211 2 . 1 . . 1.431 . 4 1 1 34 LYS HG3 . . . . . . 269 . 25684 1 >> 211 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 212 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 212 2 . 1 . . 0.910 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 1 >> 212 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 213 1 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 213 2 . 1 . . 0.849 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 1 >> 213 3 . 1 . . 122.287 . 4 1 1 35 GLU N . . . . . . 40 . 25684 1 >> 214 1 . 1 . . 8.253 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 214 2 . 1 . . 1.402 . 4 1 1 36 ALA MB . . . . . . 279 . 25684 1 >> 214 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 215 1 . 1 . . 8.253 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 215 2 . 1 . . 2.283 . 4 1 1 37 GLU HG3 . . . . . . 282 . 25684 1 >> 215 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 216 1 . 1 . . 8.253 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 216 2 . 1 . . 2.302 . 4 1 1 35 GLU HG2 . . . . . . 277 . 25684 1 >> 216 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 217 1 . 1 . . 8.252 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 217 2 . 2 . . 4.259 . 4 1 1 36 ALA HA . . . . . . 328 . 25684 1 >> 217 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 218 1 . 1 . . 8.252 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 218 2 . 1 . . 8.450 . 4 1 1 35 GLU H . . . . . . 39 . 25684 1 >> 218 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 219 1 . 1 . . 8.252 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 219 2 . 2 . . 8.253 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 219 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 220 1 . 1 . . 8.250 . 4 1 1 37 GLU H . . . . . . 43 . 25684 1 >> 220 2 . 1 . . 1.402 . 4 1 1 36 ALA MB . . . . . . 279 . 25684 1 >> 220 3 . 1 . . 119.567 . 4 1 1 37 GLU N . . . . . . 44 . 25684 1 >> 221 1 . 1 . . 8.251 . 4 1 1 37 GLU H . . . . . . 43 . 25684 1 >> 221 2 . 1 . . 1.945 . 4 1 1 37 GLU HB3 . . . . . . 284 . 25684 1 >> 221 3 . 1 . . 119.567 . 4 1 1 37 GLU N . . . . . . 44 . 25684 1 >> 222 1 . 1 . . 8.251 . 4 1 1 37 GLU H . . . . . . 43 . 25684 1 >> 222 2 . 1 . . 2.066 . 4 1 1 37 GLU HB2 . . . . . . 283 . 25684 1 >> 222 3 . 1 . . 119.567 . 4 1 1 37 GLU N . . . . . . 44 . 25684 1 >> 223 1 . 1 . . 8.252 . 4 1 1 37 GLU H . . . . . . 43 . 25684 1 >> 223 2 . 1 . . 2.283 . 4 1 1 37 GLU HG3 . . . . . . 282 . 25684 1 >> 223 3 . 1 . . 119.567 . 4 1 1 37 GLU N . . . . . . 44 . 25684 1 >> 224 1 . 1 . . 8.252 . 4 1 1 37 GLU H . . . . . . 43 . 25684 1 >> 224 2 . 1 . . 4.291 . 4 1 1 37 GLU HA . . . . . . 280 . 25684 1 >> 224 3 . 1 . . 119.567 . 4 1 1 37 GLU N . . . . . . 44 . 25684 1 >> 225 1 . 1 . . 8.251 . 4 1 1 37 GLU H . . . . . . 43 . 25684 1 >> 225 2 . 1 . . 8.251 . 4 1 1 37 GLU H . . . . . . 43 . 25684 1 >> 225 3 . 1 . . 119.567 . 4 1 1 37 GLU N . . . . . . 44 . 25684 1 >> 226 1 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 226 2 . 2 . . 1.948 . 4 1 1 38 GLU HB3 . . . . . . 288 . 25684 1 >> 226 3 . 1 . . 122.510 . 4 1 1 38 GLU N . . . . . . 42 . 25684 1 >> 227 1 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 227 2 . 1 . . 2.065 . 4 1 1 38 GLU HB2 . . . . . . 287 . 25684 1 >> 227 3 . 1 . . 122.510 . 4 1 1 38 GLU N . . . . . . 42 . 25684 1 >> 228 1 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 228 2 . 1 . . 2.283 . 4 1 1 38 GLU HG2 . . . . . . 286 . 25684 1 >> 228 3 . 1 . . 122.510 . 4 1 1 38 GLU N . . . . . . 42 . 25684 1 >> 229 1 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 229 2 . 1 . . 4.289 . 4 1 1 38 GLU HA . . . . . . 329 . 25684 1 >> 229 3 . 1 . . 122.510 . 4 1 1 38 GLU N . . . . . . 42 . 25684 1 >> 230 1 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 230 2 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 230 3 . 1 . . 122.510 . 4 1 1 38 GLU N . . . . . . 42 . 25684 1 >> 231 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 231 2 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 231 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 232 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 232 2 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 232 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 233 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 233 2 . 1 . . 4.305 . 4 1 1 39 LYS HA . . . . . . 292 . 25684 1 >> 233 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 234 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 234 2 . 2 . . 2.072 . 4 1 1 37 GLU HB2 . . . . . . 283 . 25684 1 >> 234 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 235 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 235 2 . 2 . . 1.946 . 4 1 1 37 GLU HB3 . . . . . . 284 . 25684 1 >> 235 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 236 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 236 2 . 1 . . 1.832 . 4 1 1 39 LYS HB2 . . . . . . 300 . 25684 1 >> 236 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 237 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 237 2 . 1 . . 1.710 . 4 1 1 39 LYS HB3 . . . . . . 303 . 25684 1 >> 237 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 238 1 . 1 . . 8.254 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 238 2 . 1 . . 1.950 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 1 >> 238 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 239 1 . 1 . . 8.252 . 4 1 1 36 ALA H . . . . . . 19 . 25684 1 >> 239 2 . 1 . . 2.068 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 1 >> 239 3 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 1 >> 240 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 240 2 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 240 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 241 1 . 1 . . 8.560 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 241 2 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 241 3 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 1 >> 242 1 . 1 . . 8.413 . 4 1 1 4 GLY H . . . . . . 25 . 25684 1 >> 242 2 . 1 . . 8.555 . 4 1 1 3 MET H . . . . . . 7 . 25684 1 >> 242 3 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 1 >> 243 1 . 1 . . 8.190 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 243 2 . 1 . . 3.917 . 4 1 1 8 SER HB2 . . . . . . 209 . 25684 1 >> 243 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 244 1 . 1 . . 8.218 . 4 1 1 6 VAL H . . . . . . 11 . 25684 1 >> 244 2 . 1 . . 0.921 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 244 3 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 1 >> 245 1 . 1 . . 8.190 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 245 2 . 1 . . 0.921 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 245 3 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 246 1 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 246 2 . 1 . . 0.921 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 1 >> 246 3 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 1 >> 247 1 . 1 . . 8.379 . 4 1 1 9 ALA H . . . . . . 15 . 25684 1 >> 247 2 . 1 . . 8.191 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 247 3 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 1 >> 248 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 248 2 . 2 . . 3.339 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 1 >> 248 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 249 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 249 2 . 3 . . 6.781 . 4 1 1 17 TRP HE3 . . . . . . 330 . 25684 1 >> 249 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 250 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 250 2 . 4 . . 4.229 . 4 1 1 24 THR HA . . . . . . 240 . 25684 1 >> 250 3 . 1 . . 119.083 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 251 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 251 2 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 251 3 . 1 . . 119.083 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 252 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 252 2 . 1 . . 7.741 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 252 3 . 1 . . 119.083 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 253 1 . 1 . . 7.741 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 253 2 . 1 . . 7.741 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 253 3 . 1 . . 121.065 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 254 1 . 1 . . 7.741 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 254 2 . 2 . . 4.691 . 4 1 1 25 TRP HA . . . . . . 241 . 25684 1 >> 254 3 . 1 . . 121.065 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 255 1 . 1 . . 7.741 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 255 2 . 1 . . 1.148 . 4 1 1 24 THR MG . . . . . . 320 . 25684 1 >> 255 3 . 1 . . 121.065 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 256 1 . 1 . . 7.741 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 256 2 . 1 . . 4.228 . 4 1 1 24 THR HA . . . . . . 240 . 25684 1 >> 256 3 . 1 . . 121.065 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 257 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 257 2 . 3 . . 4.692 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 1 >> 257 3 . 1 . . 119.083 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 258 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 258 2 . 1 . . 3.299 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 1 >> 258 3 . 1 . . 119.083 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 259 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 259 2 . 1 . . 3.214 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 1 >> 259 3 . 1 . . 119.083 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 260 1 . 1 . . 8.281 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 260 2 . 1 . . 4.440 . 4 1 1 27 PRO HA . . . . . . 324 . 25684 1 >> 260 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 261 1 . 1 . . 8.443 . 4 1 1 32 HIS H . . . . . . 337 . 25684 1 >> 261 2 . 1 . . 8.442 . 4 1 1 32 HIS H . . . . . . 337 . 25684 1 >> 261 3 . 1 . . 120.624 . 4 1 1 32 HIS N . . . . . . 338 . 25684 1 >> 262 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 262 2 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 262 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 263 1 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 263 2 . 1 . . 8.312 . 4 1 1 38 GLU H . . . . . . 41 . 25684 1 >> 263 3 . 1 . . 122.510 . 4 1 1 38 GLU N . . . . . . 42 . 25684 1 >> 264 1 . 1 . . 7.932 . 4 1 1 39 LYS H . . . . . . 31 . 25684 1 >> 264 2 . 2 . . 2.589 . 4 1 1 39 LYS HE2 . . . . . . 340 . 25684 1 >> 264 3 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 1 >> 265 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 265 2 . 1 . . 3.299 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 1 >> 265 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 266 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 266 2 . 1 . . 0.657 . 4 1 1 22 LEU MD2 . . . . . . 378 . 25684 1 >> 266 3 . 1 . . 120.411 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 267 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 267 2 . 1 . . 0.657 . 4 1 1 22 LEU MD2 . . . . . . 378 . 25684 1 >> 267 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 268 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 268 2 . 1 . . 1.935 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 1 >> 268 3 . 1 . . 119.060 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 269 1 . 1 . . 7.954 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 269 2 . 1 . . 1.148 . 4 1 1 24 THR MG . . . . . . 320 . 25684 1 >> 269 3 . 1 . . 119.060 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 270 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 270 2 . 1 . . 3.215 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 1 >> 270 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 271 1 . 1 . . 7.797 . 4 1 1 24 THR H . . . . . . 318 . 25684 1 >> 271 2 . 1 . . 0.705 . 4 1 1 22 LEU MD1 . . . . . . 316 . 25684 1 >> 271 3 . 1 . . 111.214 . 4 1 1 24 THR N . . . . . . 319 . 25684 1 >> 272 1 . 1 . . 8.243 . 4 1 1 17 TRP H . . . . . . 21 . 25684 1 >> 272 2 . 1 . . 0.527 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 1 >> 272 3 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 1 >> 273 1 . 1 . . 7.743 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 273 2 . 1 . . 0.534 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 1 >> 273 3 . 1 . . 119.314 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 274 1 . 1 . . 7.747 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 274 2 . 1 . . 3.295 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 1 >> 274 3 . 1 . . 121.024 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 275 1 . 1 . . 7.437 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 275 2 . 1 . . 7.222 . 4 1 1 21 TRP HD1 . . . . . . 363 . 25684 1 >> 275 3 . 1 . . 120.432 . 4 1 1 22 LEU N . . . . . . 6 . 25684 1 >> 276 1 . 1 . . 7.743 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 276 2 . 1 . . 7.484 . 4 1 1 25 TRP HE3 . . . . . . 336 . 25684 1 >> 276 3 . 1 . . 121.041 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 277 1 . 1 . . 8.153 . 4 1 1 33 LEU H . . . . . . 27 . 25684 1 >> 277 2 . 1 . . 1.195 . 4 1 1 30 THR MG . . . . . . 256 . 25684 1 >> 277 3 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 1 >> 278 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 278 2 . 1 . . 7.413 . 4 1 1 17 TRP HD1 . . . . . . 311 . 25684 1 >> 278 3 . 1 . . 111.184 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 279 1 . 1 . . 8.192 . 4 1 1 8 SER H . . . . . . 51 . 25684 1 >> 279 2 . 1 . . 8.376 . 4 1 1 7 ASP H . . . . . . 35 . 25684 1 >> 279 3 . 1 . . 116.316 . 4 1 1 8 SER N . . . . . . 52 . 25684 1 >> 280 1 . 1 . . 7.741 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 280 2 . 1 . . 7.288 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 1 >> 280 3 . 1 . . 121.041 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 281 1 . 1 . . 7.742 . 4 1 1 25 TRP H . . . . . . 335 . 25684 1 >> 281 2 . 1 . . 3.215 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 1 >> 281 3 . 1 . . 121.041 . 4 1 1 25 TRP N . . . . . . 334 . 25684 1 >> 282 1 . 1 . . 8.280 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 282 2 . 2 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 282 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 283 1 . 1 . . 8.187 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 283 2 . 1 . . 3.619 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 1 >> 283 3 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> 284 1 . 1 . . 7.956 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 284 2 . 1 . . 3.619 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 1 >> 284 3 . 1 . . 119.055 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 285 1 . 1 . . 8.283 . 4 1 1 29 SER H . . . . . . 119 . 25684 1 >> 285 2 . 1 . . 3.619 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 1 >> 285 3 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 1 >> 286 1 . 1 . . 7.742 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 286 2 . 1 . . 3.895 . 4 1 1 20 GLY HA3 . . . . . . 315 . 25684 1 >> 286 3 . 1 . . 119.251 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 287 1 . 1 . . 7.742 . 4 1 1 21 TRP H . . . . . . 3 . 25684 1 >> 287 2 . 1 . . 8.286 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 287 3 . 1 . . 119.251 . 4 1 1 21 TRP N . . . . . . 4 . 25684 1 >> 288 1 . 1 . . 7.857 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 288 2 . 1 . . 0.672 . 4 1 1 18 LEU MD1 . . . . . . 289 . 25684 1 >> 288 3 . 1 . . 119.215 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 289 1 . 1 . . 7.857 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 289 2 . 1 . . 1.289 . 4 1 1 18 LEU HG . . . . . . 231 . 25684 1 >> 289 3 . 1 . . 119.215 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 290 1 . 1 . . 7.857 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 290 2 . 2 . . 1.412 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 1 >> 290 3 . 1 . . 119.215 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 291 1 . 1 . . 7.857 . 4 1 1 18 LEU H . . . . . . 17 . 25684 1 >> 291 2 . 1 . . 1.460 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 1 >> 291 3 . 1 . . 119.215 . 4 1 1 18 LEU N . . . . . . 18 . 25684 1 >> 292 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 292 2 . 1 . . 7.220 . 4 1 1 21 TRP HD1 . . . . . . 363 . 25684 1 >> 292 3 . 1 . . 111.194 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 293 1 . 1 . . 7.695 . 4 1 1 19 THR H . . . . . . 1 . 25684 1 >> 293 2 . 1 . . 0.532 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 1 >> 293 3 . 1 . . 111.194 . 4 1 1 19 THR N . . . . . . 2 . 25684 1 >> 294 1 . 1 . . 8.279 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 294 2 . 1 . . 10.031 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 1 >> 294 3 . 1 . . 109.691 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 295 1 . 1 . . 8.279 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 295 2 . 1 . . 7.436 . 4 1 1 22 LEU H . . . . . . 5 . 25684 1 >> 295 3 . 1 . . 109.691 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 296 1 . 1 . . 8.279 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 296 2 . 1 . . 7.223 . 4 1 1 21 TRP HD1 . . . . . . 363 . 25684 1 >> 296 3 . 1 . . 109.691 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 297 1 . 1 . . 8.279 . 4 1 1 20 GLY H . . . . . . 313 . 25684 1 >> 297 2 . 1 . . 0.523 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 1 >> 297 3 . 1 . . 109.691 . 4 1 1 20 GLY N . . . . . . 107 . 25684 1 >> 298 1 . 1 . . 7.953 . 4 1 1 26 CYS H . . . . . . 332 . 25684 1 >> 298 2 . 1 . . 2.804 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 1 >> 298 3 . 1 . . 119.044 . 4 1 1 26 CYS N . . . . . . 333 . 25684 1 >> 299 1 . 1 . . 8.189 . 4 1 1 28 THR H . . . . . . 124 . 25684 1 >> 299 2 . 1 . . 2.804 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 1 >> 299 3 . 1 . . 113.645 . 4 1 1 28 THR N . . . . . . 123 . 25684 1 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2 _Saveframe_category spectral_peak_list _Details 'New list' _Experiment_label '3D 1H-15N NOESY' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H 3 N 15N stop_ _Sample_label $wr10_43_1 _Sample_conditions_label $1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 2 >> _Spectral_peak_list.Sample_ID 1 >> _Spectral_peak_list.Sample_label $wr10_43_1 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $1 >> _Spectral_peak_list.Experiment_ID 4 >> _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _Spectral_peak_list.Details 'New list' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 5580.35693359 Hz . . . 25684 2 >> 2 H 1 1H . . 8396.57910156 Hz . . . 25684 2 >> 3 N 15 15N . . 1772.50000000 Hz . . . 25684 2 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 . 25684 2 >> 10 1.0 . 25684 2 >> 11 1.0 . 25684 2 >> 12 1.0 . 25684 2 >> 13 1.0 . 25684 2 >> 2 1.0 . 25684 2 >> 3 1.0 . 25684 2 >> 4 1.0 . 25684 2 >> 5 1.0 . 25684 2 >> 6 1.0 . 25684 2 >> 7 1.0 . 25684 2 >> 8 1.0 . 25684 2 >> 9 1.0 . 25684 2 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 103290.9687500 . height 25684 2 >> 1 1507414.0175800 . volume 25684 2 >> 2 105234.8671880 . height 25684 2 >> 2 1587971.0683600 . volume 25684 2 >> 3 131463.4531250 . height 25684 2 >> 3 2061118.2656200 . volume 25684 2 >> 4 101924.5937500 . height 25684 2 >> 4 1550294.8105500 . volume 25684 2 >> 5 62299.0820312 . height 25684 2 >> 5 882011.9023440 . volume 25684 2 >> 6 70974.7812500 . height 25684 2 >> 6 1181696.8222700 . volume 25684 2 >> 7 103301.7734380 . height 25684 2 >> 7 1614562.9902300 . volume 25684 2 >> 8 253286.7500000 . height 25684 2 >> 8 4089343.3125000 . volume 25684 2 >> 9 59065.6601562 . height 25684 2 >> 9 934999.9042970 . volume 25684 2 >> 10 144802.4687500 . height 25684 2 >> 10 2357905.6113300 . volume 25684 2 >> 11 300204.3750000 . height 25684 2 >> 11 4436895.3984400 . volume 25684 2 >> 12 79622.9687500 . height 25684 2 >> 12 1114676.7116100 . volume 25684 2 >> 13 37151.6054688 . height 25684 2 >> 13 509672.7441410 . volume 25684 2 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 8.293 . 19.5996828478 . . . . . . . . . . 2 25684 2 >> 1 2 7.417 . 51.9200391093 . . . . . . . . . . 2 25684 2 >> 1 3 115.064 . 20.6467478474 . . . . . . . . . . 2 25684 2 >> 2 1 8.293 . 19.0655028482 . . . . . . . . . . 2 25684 2 >> 2 2 1.399 . 62.4888223435 . . . . . . . . . . 2 25684 2 >> 2 3 115.064 . 22.8376312057 . . . . . . . . . . 2 25684 2 >> 3 1 8.293 . 20.9627399077 . . . . . . . . . . 2 25684 2 >> 3 2 1.167 . 76.3474787440 . . . . . . . . . . 2 25684 2 >> 3 3 115.064 . 22.6261918743 . . . . . . . . . . 2 25684 2 >> 4 1 8.291 . 21.2294972923 . . . . . . . . . . 2 25684 2 >> 4 2 0.673 . 58.6691962683 . . . . . . . . . . 2 25684 2 >> 4 3 115.064 . 22.2570534547 . . . . . . . . . . 2 25684 2 >> 5 1 8.293 . 18.2848549909 . . . . . . . . . . 2 25684 2 >> 5 2 0.528 . 49.0500645642 . . . . . . . . . . 2 25684 2 >> 5 3 115.064 . 19.4532636801 . . . . . . . . . . 2 25684 2 >> 6 1 8.478 . 21.2926941789 . . . . . . . . . . 2 25684 2 >> 6 2 0.524 . 58.8728896399 . . . . . . . . . . 2 25684 2 >> 6 3 110.647 . 24.8733510574 . . . . . . . . . . 2 25684 2 >> 7 1 8.478 . 22.0201236054 . . . . . . . . . . 2 25684 2 >> 7 2 0.678 . 58.5851164490 . . . . . . . . . . 2 25684 2 >> 7 3 110.647 . 22.8613670667 . . . . . . . . . . 2 25684 2 >> 8 1 8.478 . 20.7382246526 . . . . . . . . . . 2 25684 2 >> 8 2 1.168 . 65.6623350456 . . . . . . . . . . 2 25684 2 >> 8 3 110.647 . 24.1185929378 . . . . . . . . . . 2 25684 2 >> 9 1 8.292 . 18.4538235088 . . . . . . . . . . 2 25684 2 >> 9 2 1.292 . 275.9004197940 . . . . . . . . . . 2 25684 2 >> 9 3 115.064 . 22.6714097460 . . . . . . . . . . 2 25684 2 >> 10 1 8.477 . 20.3134750514 . . . . . . . . . . 2 25684 2 >> 10 2 7.866 . 71.3100715960 . . . . . . . . . . 2 25684 2 >> 10 3 110.615 . 22.4569418033 . . . . . . . . . . 2 25684 2 >> 11 1 8.477 . 21.3934765823 . . . . . . . . . . 2 25684 2 >> 11 2 7.412 . 49.8132891140 . . . . . . . . . . 2 25684 2 >> 11 3 110.647 . 22.7189519008 . . . . . . . . . . 2 25684 2 >> 12 1 8.475 . 19.5112072065 . . . . . . . . . . 2 25684 2 >> 12 2 10.324 . 50.9922520857 . . . . . . . . . . 2 25684 2 >> 12 3 110.647 . 21.0885729392 . . . . . . . . . . 2 25684 2 >> 13 1 8.293 . 15.7223875459 . . . . . . . . . . 2 25684 2 >> 13 2 10.320 . 46.5069315486 . . . . . . . . . . 2 25684 2 >> 13 3 115.090 . 22.9980771740 . . . . . . . . . . 2 25684 2 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 2 >> 1 2 . 1 . . 7.417 . 4 1 1 17 TRP HD1 . . . . . . 311 . 25684 2 >> 1 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 2 >> 2 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 2 >> 2 2 . 2 . . 1.399 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 2 >> 2 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 2 >> 3 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 2 >> 3 2 . 1 . . 1.167 . 4 1 1 19 THR MG . . . . . . 317 . 25684 2 >> 3 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 2 >> 4 1 . 1 . . 8.291 . 4 1 1 15 SER H . . . . . . 33 . 25684 2 >> 4 2 . 1 . . 0.673 . 4 1 1 18 LEU MD1 . . . . . . 289 . 25684 2 >> 4 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 2 >> 5 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 2 >> 5 2 . 1 . . 0.528 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 2 >> 5 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 2 >> 6 1 . 1 . . 8.478 . 4 1 1 16 GLY H . . . . . . 23 . 25684 2 >> 6 2 . 1 . . 0.524 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 2 >> 6 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 2 >> 7 1 . 1 . . 8.478 . 4 1 1 16 GLY H . . . . . . 23 . 25684 2 >> 7 2 . 1 . . 0.678 . 4 1 1 18 LEU MD1 . . . . . . 289 . 25684 2 >> 7 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 2 >> 8 1 . 1 . . 8.478 . 4 1 1 16 GLY H . . . . . . 23 . 25684 2 >> 8 2 . 1 . . 1.168 . 4 1 1 19 THR MG . . . . . . 317 . 25684 2 >> 8 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 2 >> 9 1 . 1 . . 8.292 . 4 1 1 15 SER H . . . . . . 33 . 25684 2 >> 9 2 . 1 . . 1.292 . 4 1 1 18 LEU HG . . . . . . 231 . 25684 2 >> 9 3 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 2 >> 10 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 2 >> 10 2 . 1 . . 7.866 . 4 1 1 18 LEU H . . . . . . 17 . 25684 2 >> 10 3 . 1 . . 110.615 . 4 1 1 16 GLY N . . . . . . 24 . 25684 2 >> 11 1 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 2 >> 11 2 . 1 . . 7.412 . 4 1 1 17 TRP HD1 . . . . . . 311 . 25684 2 >> 11 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 2 >> 12 1 . 1 . . 8.475 . 4 1 1 16 GLY H . . . . . . 23 . 25684 2 >> 12 2 . 1 . . 10.324 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 2 >> 12 3 . 1 . . 110.647 . 4 1 1 16 GLY N . . . . . . 24 . 25684 2 >> 13 1 . 1 . . 8.293 . 4 1 1 15 SER H . . . . . . 33 . 25684 2 >> 13 2 . 1 . . 10.320 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 2 >> 13 3 . 1 . . 115.090 . 4 1 1 15 SER N . . . . . . 34 . 25684 2 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3 _Saveframe_category spectral_peak_list _Details 'New list' _Experiment_label '3D 1H-15N NOESY' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H 3 N 15N stop_ _Sample_label $wr10_43_1 _Sample_conditions_label $1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 3 >> _Spectral_peak_list.Sample_ID 1 >> _Spectral_peak_list.Sample_label $wr10_43_1 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $1 >> _Spectral_peak_list.Experiment_ID 4 >> _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _Spectral_peak_list.Details 'New list' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 5580.35693359 Hz . . . 25684 3 >> 2 H 1 1H . . 8396.57910156 Hz . . . 25684 3 >> 3 N 15 15N . . 1772.50000000 Hz . . . 25684 3 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 . 25684 3 >> 10 1.0 . 25684 3 >> 11 1.0 . 25684 3 >> 12 1.0 . 25684 3 >> 13 1.0 . 25684 3 >> 14 1.0 . 25684 3 >> 15 1.0 . 25684 3 >> 16 1.0 . 25684 3 >> 17 1.0 . 25684 3 >> 18 1.0 . 25684 3 >> 2 1.0 . 25684 3 >> 3 1.0 . 25684 3 >> 4 1.0 . 25684 3 >> 5 1.0 . 25684 3 >> 6 1.0 . 25684 3 >> 7 1.0 . 25684 3 >> 8 1.0 . 25684 3 >> 9 1.0 . 25684 3 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 161681.1093750 . height 25684 3 >> 1 2589457.6367200 . volume 25684 3 >> 2 212100.0312500 . height 25684 3 >> 2 3517881.6679700 . volume 25684 3 >> 3 95746.8281250 . height 25684 3 >> 3 1561904.0488300 . volume 25684 3 >> 4 77744.8906250 . height 25684 3 >> 4 1474972.8847700 . volume 25684 3 >> 5 238630.6562500 . height 25684 3 >> 5 4231147.2421900 . volume 25684 3 >> 6 196809.4375000 . height 25684 3 >> 6 3396099.2421900 . volume 25684 3 >> 7 4110030.5000000 . height 25684 3 >> 7 55881876.6875000 . volume 25684 3 >> 8 270153.4062500 . height 25684 3 >> 8 4394962.8437500 . volume 25684 3 >> 9 118948.3203120 . height 25684 3 >> 9 2192650.1464800 . volume 25684 3 >> 10 100889.0312500 . height 25684 3 >> 10 2101170.9648400 . volume 25684 3 >> 11 132961.1718750 . height 25684 3 >> 11 2692589.1484400 . volume 25684 3 >> 12 244023.8281250 . height 25684 3 >> 12 4404936.9765600 . volume 25684 3 >> 13 1433459.6250000 . height 25684 3 >> 13 23793211.0000000 . volume 25684 3 >> 14 877232.4375000 . height 25684 3 >> 14 14351101.8359000 . volume 25684 3 >> 15 50502.0742188 . height 25684 3 >> 15 1014249.5937500 . volume 25684 3 >> 16 137716.3437500 . height 25684 3 >> 16 2600759.1132800 . volume 25684 3 >> 17 82967.0234375 . height 25684 3 >> 17 1142556.8105500 . volume 25684 3 >> 18 332980.7500000 . height 25684 3 >> 18 5366901.1406200 . volume 25684 3 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 10.314 . 21.2213482200 . . . . . . . . . . 2 25684 3 >> 1 2 0.531 . 55.4916797652 . . . . . . . . . . 2 25684 3 >> 1 3 129.832 . 23.8928161251 . . . . . . . . . . 2 25684 3 >> 2 1 10.313 . 22.3567301805 . . . . . . . . . . 2 25684 3 >> 2 2 0.678 . 64.0362913980 . . . . . . . . . . 2 25684 3 >> 2 3 129.832 . 23.8202218960 . . . . . . . . . . 2 25684 3 >> 3 1 10.313 . 20.7018032890 . . . . . . . . . . 2 25684 3 >> 3 2 1.408 . 86.8684666047 . . . . . . . . . . 2 25684 3 >> 3 3 129.832 . 22.2451987304 . . . . . . . . . . 2 25684 3 >> 4 1 10.313 . 21.4816196084 . . . . . . . . . . 2 25684 3 >> 4 2 1.462 . 109.3438030550 . . . . . . . . . . 2 25684 3 >> 4 3 129.832 . 24.3680880032 . . . . . . . . . . 2 25684 3 >> 5 1 10.313 . 21.7212688547 . . . . . . . . . . 2 25684 3 >> 5 2 3.250 . 117.7442778550 . . . . . . . . . . 2 25684 3 >> 5 3 129.832 . 23.1404351133 . . . . . . . . . . 2 25684 3 >> 6 1 10.313 . 20.8644521182 . . . . . . . . . . 2 25684 3 >> 6 2 3.338 . 127.6697003290 . . . . . . . . . . 2 25684 3 >> 6 3 129.832 . 23.3427181778 . . . . . . . . . . 2 25684 3 >> 7 1 10.313 . 21.1609785625 . . . . . . . . . . 2 25684 3 >> 7 2 7.413 . 40.5149619585 . . . . . . . . . . 2 25684 3 >> 7 3 129.832 . 23.0641563671 . . . . . . . . . . 2 25684 3 >> 8 1 10.314 . 22.5291911579 . . . . . . . . . . 2 25684 3 >> 8 2 8.246 . 60.1742500569 . . . . . . . . . . 2 25684 3 >> 8 3 129.832 . 23.4842045108 . . . . . . . . . . 2 25684 3 >> 9 1 10.020 . 27.4884836818 . . . . . . . . . . 2 25684 3 >> 9 2 0.532 . 55.2639635880 . . . . . . . . . . 2 25684 3 >> 9 3 129.169 . 29.4100347658 . . . . . . . . . . 2 25684 3 >> 10 1 10.019 . 28.8355752124 . . . . . . . . . . 2 25684 3 >> 10 2 3.138 . 190.0148863140 . . . . . . . . . . 2 25684 3 >> 10 3 129.169 . 28.4610229234 . . . . . . . . . . 2 25684 3 >> 11 1 10.019 . 28.6641120805 . . . . . . . . . . 2 25684 3 >> 11 2 3.253 . 157.2968261670 . . . . . . . . . . 2 25684 3 >> 11 3 129.169 . 28.2605799163 . . . . . . . . . . 2 25684 3 >> 12 1 10.019 . 27.7096727849 . . . . . . . . . . 2 25684 3 >> 12 2 6.966 . 56.3617557520 . . . . . . . . . . 2 25684 3 >> 12 3 129.169 . 27.8105229884 . . . . . . . . . . 2 25684 3 >> 13 1 10.019 . 27.2628042735 . . . . . . . . . . 2 25684 3 >> 13 2 7.221 . 44.9319050830 . . . . . . . . . . 2 25684 3 >> 13 3 129.169 . 27.5915473451 . . . . . . . . . . 2 25684 3 >> 14 1 10.020 . 26.7123261295 . . . . . . . . . . 2 25684 3 >> 14 2 7.328 . 44.2872931353 . . . . . . . . . . 2 25684 3 >> 14 3 129.169 . 27.5031629577 . . . . . . . . . . 2 25684 3 >> 15 1 10.016 . 31.4875161442 . . . . . . . . . . 2 25684 3 >> 15 2 8.279 . 79.5004719665 . . . . . . . . . . 2 25684 3 >> 15 3 129.169 . 27.1952658768 . . . . . . . . . . 2 25684 3 >> 16 1 10.015 . 27.4630386195 . . . . . . . . . . 2 25684 3 >> 16 2 7.741 . 68.4139472261 . . . . . . . . . . 2 25684 3 >> 16 3 129.169 . 26.9455991313 . . . . . . . . . . 2 25684 3 >> 17 1 10.314 . 18.7787885521 . . . . . . . . . . 2 25684 3 >> 17 2 8.477 . 47.8130151995 . . . . . . . . . . 2 25684 3 >> 17 3 129.869 . 20.8365599004 . . . . . . . . . . 2 25684 3 >> 18 1 10.314 . 22.3442571107 . . . . . . . . . . 2 25684 3 >> 18 2 3.998 . 63.9271878231 . . . . . . . . . . 2 25684 3 >> 18 3 129.879 . 23.8099827245 . . . . . . . . . . 2 25684 3 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 10.314 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 1 2 . 1 . . 0.531 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 3 >> 1 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 2 1 . 1 . . 10.313 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 2 2 . 1 . . 0.678 . 4 1 1 18 LEU MD1 . . . . . . 289 . 25684 3 >> 2 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 3 1 . 1 . . 10.313 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 3 2 . 1 . . 1.408 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 3 >> 3 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 4 1 . 1 . . 10.313 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 4 2 . 1 . . 1.462 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 3 >> 4 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 5 1 . 1 . . 10.313 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 5 2 . 1 . . 3.250 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 3 >> 5 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 6 1 . 1 . . 10.313 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 6 2 . 1 . . 3.338 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 3 >> 6 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 7 1 . 1 . . 10.313 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 7 2 . 1 . . 7.413 . 4 1 1 17 TRP HD1 . . . . . . 311 . 25684 3 >> 7 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 8 1 . 1 . . 10.314 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 8 2 . 1 . . 8.246 . 4 1 1 17 TRP H . . . . . . 21 . 25684 3 >> 8 3 . 1 . . 129.832 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 9 1 . 1 . . 10.020 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 9 2 . 1 . . 0.532 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 3 >> 9 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 10 1 . 1 . . 10.019 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 10 2 . 1 . . 3.138 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 3 >> 10 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 11 1 . 1 . . 10.019 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 11 2 . 1 . . 3.253 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 3 >> 11 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 12 1 . 1 . . 10.019 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 12 2 . 1 . . 6.966 . 4 1 1 21 TRP HH2 . . . . . . 382 . 25684 3 >> 12 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 13 1 . 1 . . 10.019 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 13 2 . 1 . . 7.221 . 4 1 1 21 TRP HD1 . . . . . . 363 . 25684 3 >> 13 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 14 1 . 1 . . 10.020 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 14 2 . 1 . . 7.328 . 4 1 1 21 TRP HZ2 . . . . . . 391 . 25684 3 >> 14 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 15 1 . 1 . . 10.016 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 15 2 . 1 . . 8.279 . 4 1 1 20 GLY H . . . . . . 313 . 25684 3 >> 15 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 16 1 . 1 . . 10.015 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 3 >> 16 2 . 1 . . 7.741 . 4 1 1 21 TRP H . . . . . . 3 . 25684 3 >> 16 3 . 1 . . 129.169 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 3 >> 17 1 . 1 . . 10.314 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 17 2 . 1 . . 8.477 . 4 1 1 16 GLY H . . . . . . 23 . 25684 3 >> 17 3 . 1 . . 129.869 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> 18 1 . 1 . . 10.314 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 3 >> 18 2 . 1 . . 3.998 . 4 1 1 16 GLY HA3 . . . . . . 312 . 25684 3 >> 18 3 . 1 . . 129.879 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 3 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3_4 _Saveframe_category spectral_peak_list _Details 'Default list' _Experiment_label '3D 1H-13C NOESY' _Number_of_spectral_dimensions 3 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 C 13C 3 H 1H stop_ _Sample_label $wr10_43_D2O _Sample_conditions_label $1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3_4 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 4 >> _Spectral_peak_list.Sample_ID 2 >> _Spectral_peak_list.Sample_label $wr10_43_D2O >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $1 >> _Spectral_peak_list.Experiment_ID 10 >> _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 3 >> _Spectral_peak_list.Details 'Default list' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 12626.26269530 Hz . . . 25684 4 >> 2 C 13 13C . . 13586.95703120 Hz . . . 25684 4 >> 3 H 1 1H . . 9000.90039062 Hz . . . 25684 4 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 . 25684 4 >> 10 1.0 . 25684 4 >> 100 1.0 . 25684 4 >> 101 1.0 . 25684 4 >> 102 1.0 . 25684 4 >> 103 1.0 . 25684 4 >> 104 1.0 . 25684 4 >> 105 1.0 . 25684 4 >> 106 1.0 . 25684 4 >> 107 1.0 . 25684 4 >> 108 1.0 . 25684 4 >> 109 1.0 . 25684 4 >> 11 1.0 . 25684 4 >> 110 1.0 . 25684 4 >> 111 1.0 . 25684 4 >> 112 1.0 . 25684 4 >> 113 1.0 . 25684 4 >> 114 1.0 . 25684 4 >> 115 1.0 . 25684 4 >> 116 1.0 . 25684 4 >> 117 1.0 . 25684 4 >> 118 1.0 . 25684 4 >> 119 1.0 . 25684 4 >> 12 1.0 . 25684 4 >> 120 1.0 . 25684 4 >> 121 1.0 . 25684 4 >> 122 1.0 . 25684 4 >> 123 1.0 . 25684 4 >> 124 1.0 . 25684 4 >> 125 1.0 . 25684 4 >> 126 1.0 . 25684 4 >> 127 1.0 . 25684 4 >> 128 1.0 . 25684 4 >> 129 1.0 . 25684 4 >> 13 1.0 . 25684 4 >> 130 1.0 . 25684 4 >> 131 1.0 . 25684 4 >> 132 1.0 . 25684 4 >> 133 1.0 . 25684 4 >> 134 1.0 . 25684 4 >> 135 1.0 . 25684 4 >> 136 1.0 . 25684 4 >> 137 1.0 . 25684 4 >> 138 1.0 . 25684 4 >> 139 1.0 . 25684 4 >> 14 1.0 . 25684 4 >> 140 1.0 . 25684 4 >> 141 1.0 . 25684 4 >> 142 1.0 . 25684 4 >> 143 1.0 . 25684 4 >> 144 1.0 . 25684 4 >> 145 1.0 . 25684 4 >> 146 1.0 . 25684 4 >> 147 1.0 . 25684 4 >> 148 1.0 . 25684 4 >> 149 1.0 . 25684 4 >> 15 1.0 . 25684 4 >> 150 1.0 . 25684 4 >> 151 1.0 . 25684 4 >> 152 1.0 . 25684 4 >> 153 1.0 . 25684 4 >> 154 1.0 . 25684 4 >> 155 1.0 . 25684 4 >> 156 1.0 . 25684 4 >> 157 1.0 . 25684 4 >> 158 1.0 . 25684 4 >> 159 1.0 . 25684 4 >> 16 1.0 . 25684 4 >> 160 1.0 . 25684 4 >> 161 1.0 . 25684 4 >> 162 1.0 . 25684 4 >> 163 1.0 . 25684 4 >> 164 1.0 . 25684 4 >> 165 1.0 . 25684 4 >> 166 1.0 . 25684 4 >> 167 1.0 . 25684 4 >> 168 1.0 . 25684 4 >> 169 1.0 . 25684 4 >> 17 1.0 . 25684 4 >> 170 1.0 . 25684 4 >> 171 1.0 . 25684 4 >> 172 1.0 . 25684 4 >> 173 1.0 . 25684 4 >> 174 1.0 . 25684 4 >> 175 1.0 . 25684 4 >> 176 1.0 . 25684 4 >> 177 1.0 . 25684 4 >> 178 1.0 . 25684 4 >> 179 1.0 . 25684 4 >> 18 1.0 . 25684 4 >> 180 1.0 . 25684 4 >> 181 1.0 . 25684 4 >> 182 1.0 . 25684 4 >> 183 1.0 . 25684 4 >> 184 1.0 . 25684 4 >> 185 1.0 . 25684 4 >> 186 1.0 . 25684 4 >> 187 1.0 . 25684 4 >> 188 1.0 . 25684 4 >> 189 1.0 . 25684 4 >> 19 1.0 . 25684 4 >> 190 1.0 . 25684 4 >> 191 1.0 . 25684 4 >> 192 1.0 . 25684 4 >> 193 1.0 . 25684 4 >> 194 1.0 . 25684 4 >> 195 1.0 . 25684 4 >> 196 1.0 . 25684 4 >> 197 1.0 . 25684 4 >> 198 1.0 . 25684 4 >> 199 1.0 . 25684 4 >> 2 1.0 . 25684 4 >> 20 1.0 . 25684 4 >> 200 1.0 . 25684 4 >> 201 1.0 . 25684 4 >> 202 1.0 . 25684 4 >> 203 1.0 . 25684 4 >> 204 1.0 . 25684 4 >> 205 1.0 . 25684 4 >> 206 1.0 . 25684 4 >> 207 1.0 . 25684 4 >> 208 1.0 . 25684 4 >> 209 1.0 . 25684 4 >> 21 1.0 . 25684 4 >> 210 1.0 . 25684 4 >> 211 1.0 . 25684 4 >> 212 1.0 . 25684 4 >> 213 1.0 . 25684 4 >> 214 1.0 . 25684 4 >> 215 1.0 . 25684 4 >> 216 1.0 . 25684 4 >> 217 1.0 . 25684 4 >> 218 1.0 . 25684 4 >> 219 1.0 . 25684 4 >> 22 1.0 . 25684 4 >> 220 1.0 . 25684 4 >> 221 1.0 . 25684 4 >> 222 1.0 . 25684 4 >> 223 1.0 . 25684 4 >> 224 1.0 . 25684 4 >> 225 1.0 . 25684 4 >> 226 1.0 . 25684 4 >> 227 1.0 . 25684 4 >> 228 1.0 . 25684 4 >> 229 1.0 . 25684 4 >> 23 1.0 . 25684 4 >> 230 1.0 . 25684 4 >> 231 1.0 . 25684 4 >> 232 1.0 . 25684 4 >> 233 1.0 . 25684 4 >> 234 1.0 . 25684 4 >> 235 1.0 . 25684 4 >> 236 1.0 . 25684 4 >> 237 1.0 . 25684 4 >> 238 1.0 . 25684 4 >> 239 1.0 . 25684 4 >> 24 1.0 . 25684 4 >> 240 1.0 . 25684 4 >> 241 1.0 . 25684 4 >> 242 1.0 . 25684 4 >> 243 1.0 . 25684 4 >> 244 1.0 . 25684 4 >> 245 1.0 . 25684 4 >> 246 1.0 . 25684 4 >> 247 1.0 . 25684 4 >> 248 1.0 . 25684 4 >> 249 1.0 . 25684 4 >> 25 1.0 . 25684 4 >> 250 1.0 . 25684 4 >> 251 1.0 . 25684 4 >> 252 1.0 . 25684 4 >> 253 1.0 . 25684 4 >> 254 1.0 . 25684 4 >> 255 1.0 . 25684 4 >> 256 1.0 . 25684 4 >> 257 1.0 . 25684 4 >> 258 1.0 . 25684 4 >> 259 1.0 . 25684 4 >> 26 1.0 . 25684 4 >> 260 1.0 . 25684 4 >> 261 1.0 . 25684 4 >> 262 1.0 . 25684 4 >> 263 1.0 . 25684 4 >> 264 1.0 . 25684 4 >> 265 1.0 . 25684 4 >> 266 1.0 . 25684 4 >> 267 1.0 . 25684 4 >> 268 1.0 . 25684 4 >> 269 1.0 . 25684 4 >> 27 1.0 . 25684 4 >> 270 1.0 . 25684 4 >> 271 1.0 . 25684 4 >> 272 1.0 . 25684 4 >> 273 1.0 . 25684 4 >> 274 1.0 . 25684 4 >> 275 1.0 . 25684 4 >> 28 1.0 . 25684 4 >> 29 1.0 . 25684 4 >> 3 1.0 . 25684 4 >> 30 1.0 . 25684 4 >> 31 1.0 . 25684 4 >> 32 1.0 . 25684 4 >> 33 1.0 . 25684 4 >> 34 1.0 . 25684 4 >> 35 1.0 . 25684 4 >> 36 1.0 . 25684 4 >> 37 1.0 . 25684 4 >> 38 1.0 . 25684 4 >> 39 1.0 . 25684 4 >> 4 1.0 . 25684 4 >> 40 1.0 . 25684 4 >> 41 1.0 . 25684 4 >> 42 1.0 . 25684 4 >> 43 1.0 . 25684 4 >> 44 1.0 . 25684 4 >> 45 1.0 . 25684 4 >> 46 1.0 . 25684 4 >> 47 1.0 . 25684 4 >> 48 1.0 . 25684 4 >> 49 1.0 . 25684 4 >> 5 1.0 . 25684 4 >> 50 1.0 . 25684 4 >> 51 1.0 . 25684 4 >> 52 1.0 . 25684 4 >> 53 1.0 . 25684 4 >> 54 1.0 . 25684 4 >> 55 1.0 . 25684 4 >> 56 1.0 . 25684 4 >> 57 1.0 . 25684 4 >> 58 1.0 . 25684 4 >> 59 1.0 . 25684 4 >> 6 1.0 . 25684 4 >> 60 1.0 . 25684 4 >> 61 1.0 . 25684 4 >> 62 1.0 . 25684 4 >> 63 1.0 . 25684 4 >> 64 1.0 . 25684 4 >> 65 1.0 . 25684 4 >> 66 1.0 . 25684 4 >> 67 1.0 . 25684 4 >> 68 1.0 . 25684 4 >> 69 1.0 . 25684 4 >> 7 1.0 . 25684 4 >> 70 1.0 . 25684 4 >> 71 1.0 . 25684 4 >> 72 1.0 . 25684 4 >> 73 1.0 . 25684 4 >> 74 1.0 . 25684 4 >> 75 1.0 . 25684 4 >> 76 1.0 . 25684 4 >> 77 1.0 . 25684 4 >> 78 1.0 . 25684 4 >> 79 1.0 . 25684 4 >> 8 1.0 . 25684 4 >> 80 1.0 . 25684 4 >> 81 1.0 . 25684 4 >> 82 1.0 . 25684 4 >> 83 1.0 . 25684 4 >> 84 1.0 . 25684 4 >> 85 1.0 . 25684 4 >> 86 1.0 . 25684 4 >> 87 1.0 . 25684 4 >> 88 1.0 . 25684 4 >> 89 1.0 . 25684 4 >> 9 1.0 . 25684 4 >> 90 1.0 . 25684 4 >> 91 1.0 . 25684 4 >> 92 1.0 . 25684 4 >> 93 1.0 . 25684 4 >> 94 1.0 . 25684 4 >> 95 1.0 . 25684 4 >> 96 1.0 . 25684 4 >> 97 1.0 . 25684 4 >> 98 1.0 . 25684 4 >> 99 1.0 . 25684 4 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 30204630.0 . height 25684 4 >> 1 556212903.0 . volume 25684 4 >> 2 32106420.0 . height 25684 4 >> 2 572532819.0 . volume 25684 4 >> 3 63301984.0 . height 25684 4 >> 3 1267860204.0 . volume 25684 4 >> 4 622906304.0 . height 25684 4 >> 4 12112835440.0 . volume 25684 4 >> 5 74780128.0 . height 25684 4 >> 5 1501443928.0 . volume 25684 4 >> 6 78595160.0 . height 25684 4 >> 6 1546246176.0 . volume 25684 4 >> 7 1050426880.0 . height 25684 4 >> 7 19725494240.0 . volume 25684 4 >> 8 5437576.5 . height 25684 4 >> 8 86472952.8125 . volume 25684 4 >> 9 5195087.5 . height 25684 4 >> 9 108646390.5 . volume 25684 4 >> 10 672259328.0 . height 25684 4 >> 10 12509964288.0 . volume 25684 4 >> 11 38996572.0 . height 25684 4 >> 11 743321132.0 . volume 25684 4 >> 12 34527752.0 . height 25684 4 >> 12 677260182.0 . volume 25684 4 >> 13 4147951.75 . height 25684 4 >> 13 78640881.0 . volume 25684 4 >> 14 371098752.0 . height 25684 4 >> 14 6984790640.0 . volume 25684 4 >> 15 129662688.0 . height 25684 4 >> 15 2406386348.0 . volume 25684 4 >> 16 515675904.0 . height 25684 4 >> 16 9578580208.0 . volume 25684 4 >> 17 144531680.0 . height 25684 4 >> 17 2627290768.0 . volume 25684 4 >> 18 8078425.0 . height 25684 4 >> 18 160775689.25 . volume 25684 4 >> 19 8833249.0 . height 25684 4 >> 19 167163439.0 . volume 25684 4 >> 20 8544610.0 . height 25684 4 >> 20 146064261.75 . volume 25684 4 >> 21 10011136.0 . height 25684 4 >> 21 192819562.25 . volume 25684 4 >> 22 46882880.0 . height 25684 4 >> 22 912916330.0 . volume 25684 4 >> 23 38760672.0 . height 25684 4 >> 23 767509780.0 . volume 25684 4 >> 24 9390402.0 . height 25684 4 >> 24 187433096.0 . volume 25684 4 >> 25 6473758.5 . height 25684 4 >> 25 129796296.0 . volume 25684 4 >> 26 48918088.0 . height 25684 4 >> 26 908470012.0 . volume 25684 4 >> 27 49370560.0 . height 25684 4 >> 27 913318824.0 . volume 25684 4 >> 28 136346448.0 . height 25684 4 >> 28 2835611144.0 . volume 25684 4 >> 29 10135610.0 . height 25684 4 >> 29 235644226.5 . volume 25684 4 >> 30 61978880.0 . height 25684 4 >> 30 1323770256.0 . volume 25684 4 >> 31 501039232.0 . height 25684 4 >> 31 10931851888.0 . volume 25684 4 >> 32 12700172.0 . height 25684 4 >> 32 265759179.5 . volume 25684 4 >> 33 13106219.0 . height 25684 4 >> 33 260999914.0 . volume 25684 4 >> 34 5008503.0 . height 25684 4 >> 34 105490912.5 . volume 25684 4 >> 35 317486464.0 . height 25684 4 >> 35 6261280040.0 . volume 25684 4 >> 36 11631066.0 . height 25684 4 >> 36 231826058.0 . volume 25684 4 >> 37 50106696.0 . height 25684 4 >> 37 980997300.0 . volume 25684 4 >> 38 19911744.0 . height 25684 4 >> 38 369710378.0 . volume 25684 4 >> 39 2175979264.0 . height 25684 4 >> 39 42118422848.0 . volume 25684 4 >> 40 1770526976.0 . height 25684 4 >> 40 35254199520.0 . volume 25684 4 >> 41 1013137088.0 . height 25684 4 >> 41 20188638656.0 . volume 25684 4 >> 42 718737472.0 . height 25684 4 >> 42 15431399328.0 . volume 25684 4 >> 43 53419476.0 . height 25684 4 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_Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 4.627 . 21.9799654650 . . . . . . . . . . 2 25684 4 >> 1 2 53.932 . 99.1469853201 . . . . . . . . . . 2 25684 4 >> 1 3 2.683 . 132.0084659710 . . . . . . . . . . 2 25684 4 >> 2 1 4.627 . 19.4317163702 . . . . . . . . . . 2 25684 4 >> 2 2 53.944 . 105.3868468040 . . . . . . . . . . 2 25684 4 >> 2 3 2.763 . 129.5175175010 . . . . . . . . . . 2 25684 4 >> 3 1 4.274 . 29.1904718377 . . . . . . . . . . 2 25684 4 >> 3 2 69.189 . 116.4413551410 . . . . . . . . . . 2 25684 4 >> 3 3 1.240 . 70.0233888021 . . . . . . . . . . 2 25684 4 >> 4 1 4.274 . 24.7637733215 . . . . . . . . . . 2 25684 4 >> 4 2 69.189 . 121.0871997710 . . . . . . . . . . 2 25684 4 >> 4 3 4.274 . 68.8109090389 . . . . . . . . . . 2 25684 4 >> 5 1 4.345 . 37.2333360069 . . . . . . . . . . 2 25684 4 >> 5 2 69.306 . 102.2674348700 . . . . . . . . . . 2 25684 4 >> 5 3 1.257 . 68.9509343567 . . . . . . . . . . 2 25684 4 >> 6 1 4.211 . 31.8741860351 . . . . . . . . . . 2 25684 4 >> 6 2 69.219 . 98.0523269464 . . . . . . . . . . 2 25684 4 >> 6 3 1.229 . 68.5609021496 . . . . . . . . . . 2 25684 4 >> 7 1 4.212 . 27.4557659418 . . . . . . . . . . 2 25684 4 >> 7 2 69.219 . 98.5365134727 . . . . . . . . . . 2 25684 4 >> 7 3 4.211 . 63.4878009812 . . . . . . . . . . 2 25684 4 >> 8 1 4.321 . 17.2966358379 . . . . . . . . . . 2 25684 4 >> 8 2 63.155 . 72.4295667282 . . . . . . . . . . 2 25684 4 >> 8 3 3.689 . 102.1777083280 . . . . . . . . . . 2 25684 4 >> 9 1 4.320 . 22.8386636981 . . . . . . . . . . 2 25684 4 >> 9 2 63.155 . 113.0486961900 . . . . . . . . . . 2 25684 4 >> 9 3 3.440 . 107.6199183800 . . . . . . . . . . 2 25684 4 >> 10 1 4.322 . 23.3240803154 . . . . . . . . . . 2 25684 4 >> 10 2 63.155 . 105.0748537300 . . . . . . . . . . 2 25684 4 >> 10 3 4.321 . 66.7212591815 . . . . . . . . . . 2 25684 4 >> 11 1 4.320 . 23.7560634756 . . . . . . . . . . 2 25684 4 >> 11 2 63.155 . 99.9064181698 . . . . . . . . . . 2 25684 4 >> 11 3 2.315 . 80.1186240694 . . . . . . . . . . 2 25684 4 >> 12 1 4.320 . 23.8742191484 . . . . . . . . . . 2 25684 4 >> 12 2 63.155 . 97.8614564268 . . . . . . . . . . 2 25684 4 >> 12 3 1.992 . 95.2005847344 . . . . . . . . . . 2 25684 4 >> 13 1 4.320 . 18.6399981044 . . . . . . . . . . 2 25684 4 >> 13 2 63.148 . 84.6996408782 . . . . . . . . . . 2 25684 4 >> 13 3 1.275 . 74.9344683385 . . . . . . . . . . 2 25684 4 >> 14 1 3.440 . 32.8254520882 . . . . . . . . . . 2 25684 4 >> 14 2 50.372 . 86.2805610079 . . . . . . . . . . 2 25684 4 >> 14 3 3.440 . 65.7577133166 . . . . . . . . . . 2 25684 4 >> 15 1 3.440 . 30.8092798126 . . . . . . . . . . 2 25684 4 >> 15 2 50.372 . 77.1058185353 . . . . . . . . . . 2 25684 4 >> 15 3 3.689 . 76.9972934223 . . . . . . . . . . 2 25684 4 >> 16 1 3.689 . 32.0472803327 . . . . . . . . . . 2 25684 4 >> 16 2 50.372 . 87.2292953010 . . . . . . . . . . 2 25684 4 >> 16 3 3.689 . 65.4851736176 . . . . . . . . . . 2 25684 4 >> 17 1 3.689 . 28.6681786092 . . . . . . . . . . 2 25684 4 >> 17 2 50.372 . 76.8256119067 . . . . . . . . . . 2 25684 4 >> 17 3 3.440 . 76.5772174690 . . . . . . . . . . 2 25684 4 >> 18 1 3.440 . 30.8709916926 . . . . . . . . . . 2 25684 4 >> 18 2 50.372 . 83.4627027297 . . . . . . . . . . 2 25684 4 >> 18 3 2.722 . 129.8415607650 . . . . . . . . . . 2 25684 4 >> 19 1 3.440 . 27.5806948696 . . . . . . . . . . 2 25684 4 >> 19 2 50.372 . 82.6893000409 . . . . . . . . . . 2 25684 4 >> 19 3 2.309 . 82.8048568899 . . . . . . . . . . 2 25684 4 >> 20 1 3.689 . 24.5681015067 . . . . . . . . . . 2 25684 4 >> 20 2 50.372 . 69.9382787477 . . . . . . . . . . 2 25684 4 >> 20 3 2.312 . 74.7853225977 . . . . . . . . . . 2 25684 4 >> 21 1 3.689 . 26.9071322766 . . . . . . . . . . 2 25684 4 >> 21 2 50.372 . 70.2889419564 . . . . . . . . . . 2 25684 4 >> 21 3 2.722 . 144.7132152060 . . . . . . . . . . 2 25684 4 >> 22 1 3.689 . 28.8390151551 . . . . . . . . . . 2 25684 4 >> 22 2 50.372 . 82.1458935444 . . . . . . . . . . 2 25684 4 >> 22 3 1.999 . 99.3434027572 . . . . . . . . . . 2 25684 4 >> 23 1 3.440 . 30.2252747040 . . . . . . . . . . 2 25684 4 >> 23 2 50.372 . 81.4972071007 . . . . . . . . . . 2 25684 4 >> 23 3 1.999 . 102.9132436180 . . . . . . . . . . 2 25684 4 >> 24 1 3.689 . 38.1070859180 . . . . . . . . . . 2 25684 4 >> 24 2 50.372 . 83.5525956077 . . . . . . . . . . 2 25684 4 >> 24 3 2.808 . 165.3972615730 . . . . . . . . . . 2 25684 4 >> 25 1 3.440 . 29.0730687489 . . . . . . . . . . 2 25684 4 >> 25 2 50.372 . 90.3978167878 . . . . . . . . . . 2 25684 4 >> 25 3 2.808 . 142.0967267970 . . . . . . . . . . 2 25684 4 >> 26 1 3.443 . 29.3703393905 . . . . . . . . . . 2 25684 4 >> 26 2 50.373 . 81.8426063120 . . . . . . . . . . 2 25684 4 >> 26 3 4.664 . 72.4386914100 . . . . . . . . . . 2 25684 4 >> 27 1 3.689 . 28.3987535720 . . . . . . . . . . 2 25684 4 >> 27 2 50.372 . 81.7891564927 . . . . . . . . . . 2 25684 4 >> 27 3 4.664 . 73.0765845244 . . . . . . . . . . 2 25684 4 >> 28 1 4.703 . 32.0585690913 . . . . . . . . . . 2 25684 4 >> 28 2 57.041 . 106.4548308830 . . . . . . . . . . 2 25684 4 >> 28 3 3.297 . 88.7379602975 . . . . . . . . . . 2 25684 4 >> 29 1 4.703 . 35.6890338383 . . . . . . . . . . 2 25684 4 >> 29 2 57.041 . 111.4446954560 . . . . . . . . . . 2 25684 4 >> 29 3 7.573 . 179.6087583380 . . . . . . . . . . 2 25684 4 >> 30 1 4.567 . 27.2247226836 . . . . . . . . . . 2 25684 4 >> 30 2 57.300 . 127.7104472930 . . . . . . . . . . 2 25684 4 >> 30 3 3.266 . 95.3658253393 . . . . . . . . . . 2 25684 4 >> 31 1 4.567 . 26.4789120359 . . . . . . . . . . 2 25684 4 >> 31 2 57.311 . 297.1502213370 . . . . . . . . . . 2 25684 4 >> 31 3 4.567 . 67.9213995489 . . . . . . . . . . 2 25684 4 >> 32 1 4.567 . 27.6461696692 . . . . . . . . . . 2 25684 4 >> 32 2 57.311 . 130.4060188640 . . . . . . . . . . 2 25684 4 >> 32 3 7.209 . 73.7292312642 . . . . . . . . . . 2 25684 4 >> 33 1 4.567 . 24.9225685250 . . . . . . . . . . 2 25684 4 >> 33 2 57.311 . 126.8250834300 . . . . . . . . . . 2 25684 4 >> 33 3 7.545 . 75.5910046705 . . . . . . . . . . 2 25684 4 >> 34 1 4.567 . 30.8566925985 . . . . . . . . . . 2 25684 4 >> 34 2 57.311 . 103.3871351920 . . . . . . . . . . 2 25684 4 >> 34 3 0.884 . 71.7965063319 . . . . . . . . . . 2 25684 4 >> 35 1 4.511 . 28.2678039729 . . . . . . . . . . 2 25684 4 >> 35 2 52.218 . 114.3587229170 . . . . . . . . . . 2 25684 4 >> 35 3 4.511 . 65.2110244322 . . . . . . . . . . 2 25684 4 >> 36 1 4.510 . 26.5007369691 . . . . . . . . . . 2 25684 4 >> 36 2 52.218 . 103.8457103470 . . . . . . . . . . 2 25684 4 >> 36 3 1.933 . 81.3509541650 . . . . . . . . . . 2 25684 4 >> 37 1 4.511 . 28.9029847868 . . . . . . . . . . 2 25684 4 >> 37 2 52.218 . 103.8380168120 . . . . . . . . . . 2 25684 4 >> 37 3 0.884 . 70.3710378669 . . . . . . . . . . 2 25684 4 >> 38 1 4.424 . 25.4230368203 . . . . . . . . . . 2 25684 4 >> 38 2 52.208 . 88.2096135783 . . . . . . . . . . 2 25684 4 >> 38 3 1.439 . 69.9488159317 . . . . . . . . . . 2 25684 4 >> 39 1 4.423 . 28.6260339106 . . . . . . . . . . 2 25684 4 >> 39 2 52.208 . 101.5060659820 . . . . . . . . . . 2 25684 4 >> 39 3 4.422 . 63.2383305874 . . . . . . . . . . 2 25684 4 >> 40 1 4.527 . 27.1825779850 . . . . . . . . . . 2 25684 4 >> 40 2 55.311 . 98.6813240154 . . . . . . . . . . 2 25684 4 >> 40 3 4.526 . 70.1226404641 . . . . . . . . . . 2 25684 4 >> 41 1 2.681 . 32.2120962074 . . . . . . . . . . 2 25684 4 >> 41 2 31.735 . 89.6280584049 . . . . . . . . . . 2 25684 4 >> 41 3 2.680 . 116.1072767220 . . . . . . . . . . 2 25684 4 >> 42 1 2.615 . 38.7181840471 . . . . . . . . . . 2 25684 4 >> 42 2 31.749 . 99.3235316931 . . . . . . . . . . 2 25684 4 >> 42 3 2.614 . 130.0116298300 . . . . . . . . . . 2 25684 4 >> 43 1 4.577 . 21.8452529464 . . . . . . . . . . 2 25684 4 >> 43 2 57.743 . 148.0138875660 . . . . . . . . . . 2 25684 4 >> 43 3 3.923 . 85.0286306149 . . . . . . . . . . 2 25684 4 >> 44 1 4.577 . 20.9353790079 . . . . . . . . . . 2 25684 4 >> 44 2 57.743 . 112.6242357870 . . . . . . . . . . 2 25684 4 >> 44 3 4.577 . 60.0161387919 . . . . . . . . . . 2 25684 4 >> 45 1 3.923 . 78.9520720744 . . . . . . . . . . 2 25684 4 >> 45 2 63.556 . 97.6471509959 . . . . . . . . . . 2 25684 4 >> 45 3 3.923 . 64.0543401979 . . . . . . . . . . 2 25684 4 >> 46 1 3.923 . 34.1695669386 . . . . . . . . . . 2 25684 4 >> 46 2 63.556 . 95.4307044159 . . . . . . . . . . 2 25684 4 >> 46 3 4.577 . 72.0867503814 . . . . . . . . . . 2 25684 4 >> 47 1 4.239 . 19.7794101333 . . . . . . . . . . 2 25684 4 >> 47 2 61.968 . 107.3086107630 . . . . . . . . . . 2 25684 4 >> 47 3 2.178 . 63.3375822494 . . . . . . . . . . 2 25684 4 >> 48 1 4.239 . 20.8142129996 . . . . . . . . . . 2 25684 4 >> 48 2 61.968 . 92.1191439240 . . . . . . . . . . 2 25684 4 >> 48 3 0.989 . 64.6487771792 . . . . . . . . . . 2 25684 4 >> 49 1 4.239 . 21.5487348887 . . . . . . . . . . 2 25684 4 >> 49 2 61.968 . 97.6017996341 . . . . . . . . . . 2 25684 4 >> 49 3 4.239 . 60.9485679195 . . . . . . . . . . 2 25684 4 >> 50 1 2.178 . 32.5944088300 . . . . . . . . . . 2 25684 4 >> 50 2 32.414 . 87.8115743934 . . . . . . . . . . 2 25684 4 >> 50 3 4.239 . 64.2421136126 . . . . . . . . . . 2 25684 4 >> 51 1 2.179 . 35.0229970844 . . . . . . . . . . 2 25684 4 >> 51 2 32.414 . 115.0685527150 . . . . . . . . . . 2 25684 4 >> 51 3 2.178 . 66.2609460679 . . . . . . . . . . 2 25684 4 >> 52 1 2.178 . 35.4715370904 . . . . . . . . . . 2 25684 4 >> 52 2 32.414 . 102.1409850480 . . . . . . . . . . 2 25684 4 >> 52 3 0.997 . 65.1149917430 . . . . . . . . . . 2 25684 4 >> 53 1 0.990 . 19.7033991591 . . . . . . . . . . 2 25684 4 >> 53 2 19.967 . 91.0541967661 . . . . . . . . . . 2 25684 4 >> 53 3 0.990 . 59.0053813256 . . . . . . . . . . 2 25684 4 >> 54 1 1.000 . 20.0194843982 . . . . . . . . . . 2 25684 4 >> 54 2 20.870 . 81.5206926274 . . . . . . . . . . 2 25684 4 >> 54 3 0.996 . 59.9136681571 . . . . . . . . . . 2 25684 4 >> 55 1 4.704 . 21.4719713306 . . . . . . . . . . 2 25684 4 >> 55 2 53.989 . 100.7950214160 . . . . . . . . . . 2 25684 4 >> 55 3 4.704 . 60.3214047146 . . . . . . . . . . 2 25684 4 >> 56 1 4.704 . 27.2442898651 . . . . . . . . . . 2 25684 4 >> 56 2 53.989 . 98.0273735743 . . . . . . . . . . 2 25684 4 >> 56 3 2.786 . 64.0398548202 . . . . . . . . . . 2 25684 4 >> 57 1 4.704 . 20.2467647369 . . . . . . . . . . 2 25684 4 >> 57 2 53.989 . 100.2803644440 . . . . . . . . . . 2 25684 4 >> 57 3 2.678 . 69.4970867456 . . . . . . . . . . 2 25684 4 >> 58 1 2.678 . 38.5902447836 . . . . . . . . . . 2 25684 4 >> 58 2 41.056 . 100.9808810150 . . . . . . . . . . 2 25684 4 >> 58 3 2.678 . 65.2056594775 . . . . . . . . . . 2 25684 4 >> 59 1 2.678 . 22.8672618864 . . . . . . . . . . 2 25684 4 >> 59 2 41.056 . 100.5314166250 . . . . . . . . . . 2 25684 4 >> 59 3 4.704 . 130.9751756940 . . . . . . . . . . 2 25684 4 >> 60 1 2.679 . 39.4165819089 . . . . . . . . . . 2 25684 4 >> 60 2 41.019 . 84.3915958020 . . . . . . . . . . 2 25684 4 >> 60 3 4.627 . 137.7071208580 . . . . . . . . . . 2 25684 4 >> 61 1 2.786 . 36.1074704883 . . . . . . . . . . 2 25684 4 >> 61 2 41.061 . 130.6568685840 . . . . . . . . . . 2 25684 4 >> 61 3 4.704 . 109.0105146390 . . . . . . . . . . 2 25684 4 >> 62 1 2.772 . 46.7580378806 . . . . . . . . . . 2 25684 4 >> 62 2 41.020 . 76.8304709812 . . . . . . . . . . 2 25684 4 >> 62 3 4.627 . 127.9809944740 . . . . . . . . . . 2 25684 4 >> 63 1 2.787 . 46.5849435830 . . . . . . . . . . 2 25684 4 >> 63 2 41.061 . 104.6709431630 . . . . . . . . . . 2 25684 4 >> 63 3 2.786 . 57.9881859137 . . . . . . . . . . 2 25684 4 >> 64 1 4.457 . 31.3518928065 . . . . . . . . . . 2 25684 4 >> 64 2 58.121 . 102.0988730700 . . . . . . . . . . 2 25684 4 >> 64 3 4.457 . 58.8465786664 . . . . . . . . . . 2 25684 4 >> 65 1 4.457 . 34.3087949606 . . . . . . . . . . 2 25684 4 >> 65 2 58.121 . 108.1872933990 . . . . . . . . . . 2 25684 4 >> 65 3 3.874 . 97.1883004524 . . . . . . . . . . 2 25684 4 >> 66 1 3.874 . 80.3007024282 . . . . . . . . . . 2 25684 4 >> 66 2 63.338 . 86.9752061978 . . . . . . . . . . 2 25684 4 >> 66 3 4.457 . 71.8217216190 . . . . . . . . . . 2 25684 4 >> 67 1 3.873 . 60.5220448789 . . . . . . . . . . 2 25684 4 >> 67 2 63.338 . 93.2667965788 . . . . . . . . . . 2 25684 4 >> 67 3 3.874 . 75.0417674326 . . . . . . . . . . 2 25684 4 >> 68 1 3.972 . 29.0647903259 . . . . . . . . . . 2 25684 4 >> 68 2 63.366 . 107.2761157020 . . . . . . . . . . 2 25684 4 >> 68 3 4.460 . 63.4228850292 . . . . . . . . . . 2 25684 4 >> 69 1 3.973 . 34.0566793532 . . . . . . . . . . 2 25684 4 >> 69 2 63.366 . 96.3500818007 . . . . . . . . . . 2 25684 4 >> 69 3 3.972 . 87.2845940681 . . . . . . . . . . 2 25684 4 >> 70 1 3.973 . 22.4834440960 . . . . . . . . . . 2 25684 4 >> 70 2 63.366 . 80.4141396443 . . . . . . . . . . 2 25684 4 >> 70 3 3.874 . 146.9466458500 . . . . . . . . . . 2 25684 4 >> 71 1 3.873 . 140.5345076720 . . . . . . . . . . 2 25684 4 >> 71 2 63.366 . 72.6987392085 . . . . . . . . . . 2 25684 4 >> 71 3 3.972 . 204.2497270470 . . . . . . . . . . 2 25684 4 >> 72 1 4.355 . 31.7492571072 . . . . . . . . . . 2 25684 4 >> 72 2 52.639 . 114.0076547850 . . . . . . . . . . 2 25684 4 >> 72 3 1.453 . 61.6256252032 . . . . . . . . . . 2 25684 4 >> 73 1 4.355 . 26.9274520420 . . . . . . . . . . 2 25684 4 >> 73 2 52.639 . 129.4757085610 . . . . . . . . . . 2 25684 4 >> 73 3 4.355 . 61.4072715468 . . . . . . . . . . 2 25684 4 >> 74 1 1.453 . 27.7951812819 . . . . . . . . . . 2 25684 4 >> 74 2 18.975 . 155.4361238410 . . . . . . . . . . 2 25684 4 >> 74 3 1.453 . 62.0215588604 . . . . . . . . . . 2 25684 4 >> 75 1 4.627 . 20.3197653755 . . . . . . . . . . 2 25684 4 >> 75 2 53.943 . 103.1346657800 . . . . . . . . . . 2 25684 4 >> 75 3 4.626 . 60.4329957725 . . . . . . . . . . 2 25684 4 >> 76 1 4.374 . 43.7063101548 . . . . . . . . . . 2 25684 4 >> 76 2 52.535 . 119.8960432150 . . . . . . . . . . 2 25684 4 >> 76 3 4.373 . 56.8712023442 . . . . . . . . . . 2 25684 4 >> 77 1 4.374 . 48.7064776050 . . . . . . . . . . 2 25684 4 >> 77 2 52.535 . 135.3033585600 . . . . . . . . . . 2 25684 4 >> 77 3 1.465 . 58.4881996921 . . . . . . . . . . 2 25684 4 >> 78 1 3.900 . 51.1297977720 . . . . . . . . . . 2 25684 4 >> 78 2 63.480 . 101.7652166220 . . . . . . . . . . 2 25684 4 >> 78 3 4.464 . 73.0948253704 . . . . . . . . . . 2 25684 4 >> 79 1 3.900 . 44.7448759407 . . . . . . . . . . 2 25684 4 >> 79 2 63.480 . 100.4252256020 . . . . . . . . . . 2 25684 4 >> 79 3 3.900 . 70.0861587721 . . . . . . . . . . 2 25684 4 >> 80 1 4.464 . 40.3257032635 . . . . . . . . . . 2 25684 4 >> 80 2 58.159 . 108.1717038680 . . . . . . . . . . 2 25684 4 >> 80 3 3.898 . 134.1168931690 . . . . . . . . . . 2 25684 4 >> 81 1 4.464 . 31.0275291444 . . . . . . . . . . 2 25684 4 >> 81 2 58.159 . 104.6583905540 . . . . . . . . . . 2 25684 4 >> 81 3 4.464 . 55.7053976869 . . . . . . . . . . 2 25684 4 >> 82 1 4.511 . 29.1483271391 . . . . . . . . . . 2 25684 4 >> 82 2 52.218 . 109.1007994020 . . . . . . . . . . 2 25684 4 >> 82 3 1.428 . 111.9338784580 . . . . . . . . . . 2 25684 4 >> 83 1 4.511 . 26.8943383503 . . . . . . . . . . 2 25684 4 >> 83 2 52.218 . 105.5496257990 . . . . . . . . . . 2 25684 4 >> 83 3 1.383 . 156.2253350110 . . . . . . . . . . 2 25684 4 >> 84 1 1.428 . 68.8870149584 . . . . . . . . . . 2 25684 4 >> 84 2 42.426 . 102.6876309280 . . . . . . . . . . 2 25684 4 >> 84 3 1.428 . 92.8657564471 . . . . . . . . . . 2 25684 4 >> 85 1 1.384 . 72.8696889720 . . . . . . . . . . 2 25684 4 >> 85 2 42.426 . 110.9691135410 . . . . . . . . . . 2 25684 4 >> 85 3 1.384 . 111.6087622020 . . . . . . . . . . 2 25684 4 >> 86 1 1.384 . 78.6992038831 . . . . . . . . . . 2 25684 4 >> 86 2 42.426 . 106.9478244820 . . . . . . . . . . 2 25684 4 >> 86 3 0.884 . 75.9489812731 . . . . . . . . . . 2 25684 4 >> 87 1 1.429 . 70.0286847390 . . . . . . . . . . 2 25684 4 >> 87 2 42.426 . 98.9404746545 . . . . . . . . . . 2 25684 4 >> 87 3 0.884 . 69.2358134515 . . . . . . . . . . 2 25684 4 >> 88 1 1.390 . 65.9835462614 . . . . . . . . . . 2 25684 4 >> 88 2 42.426 . 99.1992203709 . . . . . . . . . . 2 25684 4 >> 88 3 3.514 . 78.7661189884 . . . . . . . . . . 2 25684 4 >> 89 1 1.423 . 66.9408329858 . . . . . . . . . . 2 25684 4 >> 89 2 42.426 . 109.0785286440 . . . . . . . . . . 2 25684 4 >> 89 3 3.514 . 88.8688651923 . . . . . . . . . . 2 25684 4 >> 90 1 1.390 . 71.8950928179 . . . . . . . . . . 2 25684 4 >> 90 2 42.426 . 107.3292618290 . . . . . . . . . . 2 25684 4 >> 90 3 4.511 . 82.9164479477 . . . . . . . . . . 2 25684 4 >> 91 1 1.425 . 69.2708327489 . . . . . . . . . . 2 25684 4 >> 91 2 42.426 . 93.5327296761 . . . . . . . . . . 2 25684 4 >> 91 3 4.511 . 74.3008671879 . . . . . . . . . . 2 25684 4 >> 92 1 0.793 . 21.2431858242 . . . . . . . . . . 2 25684 4 >> 92 2 23.197 . 92.4722366699 . . . . . . . . . . 2 25684 4 >> 92 3 1.514 . 75.3980004250 . . . . . . . . . . 2 25684 4 >> 93 1 0.793 . 21.7022620049 . . . . . . . . . . 2 25684 4 >> 93 2 23.197 . 82.2746590183 . . . . . . . . . . 2 25684 4 >> 93 3 1.541 . 78.3728678086 . . . . . . . . . . 2 25684 4 >> 94 1 0.792 . 21.0572976002 . . . . . . . . . . 2 25684 4 >> 94 2 23.197 . 91.9482664713 . . . . . . . . . . 2 25684 4 >> 94 3 1.384 . 78.4157874462 . . . . . . . . . . 2 25684 4 >> 95 1 0.790 . 27.0885049972 . . . . . . . . . . 2 25684 4 >> 95 2 23.197 . 83.5307297725 . . . . . . . . . . 2 25684 4 >> 95 3 0.792 . 63.6632350000 . . . . . . . . . . 2 25684 4 >> 96 1 0.792 . 24.0578496206 . . . . . . . . . . 2 25684 4 >> 96 2 23.197 . 86.7093743312 . . . . . . . . . . 2 25684 4 >> 96 3 4.321 . 72.1130386594 . . . . . . . . . . 2 25684 4 >> 97 1 4.318 . 40.2639913834 . . . . . . . . . . 2 25684 4 >> 97 2 55.083 . 119.0286984190 . . . . . . . . . . 2 25684 4 >> 97 3 4.322 . 63.4373704069 . . . . . . . . . . 2 25684 4 >> 98 1 4.320 . 25.6465542394 . . . . . . . . . . 2 25684 4 >> 98 2 55.083 . 99.0040475457 . . . . . . . . . . 2 25684 4 >> 98 3 3.304 . 195.4656867100 . . . . . . . . . . 2 25684 4 >> 99 1 4.321 . 24.3799555310 . . . . . . . . . . 2 25684 4 >> 99 2 55.083 . 89.8114884667 . . . . . . . . . . 2 25684 4 >> 99 3 3.241 . 165.6585348680 . . . . . . . . . . 2 25684 4 >> 100 1 4.320 . 33.2860334367 . . . . . . . . . . 2 25684 4 >> 100 2 55.083 . 102.4616839640 . . . . . . . . . . 2 25684 4 >> 100 3 1.541 . 99.0386733300 . . . . . . . . . . 2 25684 4 >> 101 1 4.320 . 24.9112797664 . . . . . . . . . . 2 25684 4 >> 101 2 55.083 . 111.1177202360 . . . . . . . . . . 2 25684 4 >> 101 3 1.516 . 97.0032095151 . . . . . . . . . . 2 25684 4 >> 102 1 4.320 . 31.8199999941 . . . . . . . . . . 2 25684 4 >> 102 2 55.083 . 117.7535962900 . . . . . . . . . . 2 25684 4 >> 102 3 1.387 . 254.8643192150 . . . . . . . . . . 2 25684 4 >> 103 1 4.319 . 24.2429852607 . . . . . . . . . . 2 25684 4 >> 103 2 55.083 . 98.2334793170 . . . . . . . . . . 2 25684 4 >> 103 3 0.875 . 152.6007716120 . . . . . . . . . . 2 25684 4 >> 104 1 4.319 . 28.7900972014 . . . . . . . . . . 2 25684 4 >> 104 2 55.083 . 115.4009943940 . . . . . . . . . . 2 25684 4 >> 104 3 0.795 . 115.3749604050 . . . . . . . . . . 2 25684 4 >> 105 1 1.388 . 35.2796281952 . . . . . . . . . . 2 25684 4 >> 105 2 26.481 . 107.4041725610 . . . . . . . . . . 2 25684 4 >> 105 3 1.388 . 62.1814345106 . . . . . . . . . . 2 25684 4 >> 106 1 1.388 . 34.9499964458 . . . . . . . . . . 2 25684 4 >> 106 2 26.481 . 81.8745952190 . . . . . . . . . . 2 25684 4 >> 106 3 0.876 . 143.1219696410 . . . . . . . . . . 2 25684 4 >> 107 1 1.388 . 38.1228901800 . . . . . . . . . . 2 25684 4 >> 107 2 26.481 . 95.5982412549 . . . . . . . . . . 2 25684 4 >> 107 3 0.796 . 136.4173857470 . . . . . . . . . . 2 25684 4 >> 108 1 1.389 . 35.2051223888 . . . . . . . . . . 2 25684 4 >> 108 2 26.481 . 125.2215888500 . . . . . . . . . . 2 25684 4 >> 108 3 4.322 . 64.5441605625 . . . . . . . . . . 2 25684 4 >> 109 1 3.224 . 72.3556741664 . . . . . . . . . . 2 25684 4 >> 109 2 29.550 . 140.3284514230 . . . . . . . . . . 2 25684 4 >> 109 3 4.567 . 75.6329854410 . . . . . . . . . . 2 25684 4 >> 110 1 3.265 . 75.8845400866 . . . . . . . . . . 2 25684 4 >> 110 2 29.550 . 144.0229677220 . . . . . . . . . . 2 25684 4 >> 110 3 4.567 . 75.7923245957 . . . . . . . . . . 2 25684 4 >> 111 1 3.224 . 76.8139812066 . . . . . . . . . . 2 25684 4 >> 111 2 29.550 . 142.5830619830 . . . . . . . . . . 2 25684 4 >> 111 3 3.224 . 85.6541843334 . . . . . . . . . . 2 25684 4 >> 112 1 3.266 . 65.5575837725 . . . . . . . . . . 2 25684 4 >> 112 2 29.550 . 142.9264365800 . . . . . . . . . . 2 25684 4 >> 112 3 3.265 . 112.2831370090 . . . . . . . . . . 2 25684 4 >> 113 1 3.265 . 40.0615463136 . . . . . . . . . . 2 25684 4 >> 113 2 29.550 . 157.9425964290 . . . . . . . . . . 2 25684 4 >> 113 3 0.884 . 70.7884313429 . . . . . . . . . . 2 25684 4 >> 114 1 0.876 . 27.8839861825 . . . . . . . . . . 2 25684 4 >> 114 2 24.614 . 91.9344990936 . . . . . . . . . . 2 25684 4 >> 114 3 1.387 . 74.5691149231 . . . . . . . . . . 2 25684 4 >> 115 1 0.876 . 22.2373491598 . . . . . . . . . . 2 25684 4 >> 115 2 24.614 . 86.4332169313 . . . . . . . . . . 2 25684 4 >> 115 3 1.503 . 97.1078261319 . . . . . . . . . . 2 25684 4 >> 116 1 0.876 . 22.7701785630 . . . . . . . . . . 2 25684 4 >> 116 2 24.614 . 82.4787401466 . . . . . . . . . . 2 25684 4 >> 116 3 1.541 . 91.2637809723 . . . . . . . . . . 2 25684 4 >> 117 1 0.875 . 27.4474875188 . . . . . . . . . . 2 25684 4 >> 117 2 24.614 . 106.8802023620 . . . . . . . . . . 2 25684 4 >> 117 3 0.877 . 66.0694171849 . . . . . . . . . . 2 25684 4 >> 118 1 0.876 . 20.6185411849 . . . . . . . . . . 2 25684 4 >> 118 2 24.614 . 83.4764701074 . . . . . . . . . . 2 25684 4 >> 118 3 4.316 . 71.3351202273 . . . . . . . . . . 2 25684 4 >> 119 1 1.933 . 32.4506653046 . . . . . . . . . . 2 25684 4 >> 119 2 26.906 . 96.0226004266 . . . . . . . . . . 2 25684 4 >> 119 3 3.514 . 89.0298138334 . . . . . . . . . . 2 25684 4 >> 120 1 1.933 . 32.4687273183 . . . . . . . . . . 2 25684 4 >> 120 2 26.906 . 89.2822542707 . . . . . . . . . . 2 25684 4 >> 120 3 4.235 . 82.0086976117 . . . . . . . . . . 2 25684 4 >> 121 1 1.933 . 36.4867727753 . . . . . . . . . . 2 25684 4 >> 121 2 26.906 . 108.7282703580 . . . . . . . . . . 2 25684 4 >> 121 3 1.933 . 73.1951500233 . . . . . . . . . . 2 25684 4 >> 122 1 1.933 . 27.2247226836 . . . . . . . . . . 2 25684 4 >> 122 2 26.906 . 103.8295134320 . . . . . . . . . . 2 25684 4 >> 122 3 0.884 . 67.5168819642 . . . . . . . . . . 2 25684 4 >> 123 1 1.933 . 31.2472836440 . . . . . . . . . . 2 25684 4 >> 123 2 26.906 . 104.6239721100 . . . . . . . . . . 2 25684 4 >> 123 3 4.511 . 73.3754125014 . . . . . . . . . . 2 25684 4 >> 124 1 4.235 . 26.5014895530 . . . . . . . . . . 2 25684 4 >> 124 2 62.850 . 122.3852053500 . . . . . . . . . . 2 25684 4 >> 124 3 1.933 . 75.8443646564 . . . . . . . . . . 2 25684 4 >> 125 1 4.235 . 26.6663054277 . . . . . . . . . . 2 25684 4 >> 125 2 62.850 . 123.7344083660 . . . . . . . . . . 2 25684 4 >> 125 3 2.155 . 75.5707519664 . . . . . . . . . . 2 25684 4 >> 126 1 1.933 . 32.7419152750 . . . . . . . . . . 2 25684 4 >> 126 2 26.906 . 90.3787854128 . . . . . . . . . . 2 25684 4 >> 126 3 2.155 . 108.6575006200 . . . . . . . . . . 2 25684 4 >> 127 1 4.235 . 26.7167285492 . . . . . . . . . . 2 25684 4 >> 127 2 62.850 . 124.4947522920 . . . . . . . . . . 2 25684 4 >> 127 3 1.717 . 77.9206021270 . . . . . . . . . . 2 25684 4 >> 128 1 1.933 . 31.6070187496 . . . . . . . . . . 2 25684 4 >> 128 2 26.906 . 89.4158788191 . . . . . . . . . . 2 25684 4 >> 128 3 1.717 . 84.2786099472 . . . . . . . . . . 2 25684 4 >> 129 1 4.235 . 31.2698611611 . . . . . . . . . . 2 25684 4 >> 129 2 62.850 . 125.6623473980 . . . . . . . . . . 2 25684 4 >> 129 3 3.514 . 93.0985954812 . . . . . . . . . . 2 25684 4 >> 130 1 4.235 . 27.0448551308 . . . . . . . . . . 2 25684 4 >> 130 2 62.850 . 389.6552567600 . . . . . . . . . . 2 25684 4 >> 130 3 4.235 . 66.9573171885 . . . . . . . . . . 2 25684 4 >> 131 1 2.155 . 33.3266729675 . . . . . . . . . . 2 25684 4 >> 131 2 31.533 . 117.4535484410 . . . . . . . . . . 2 25684 4 >> 131 3 1.719 . 77.3186542091 . . . . . . . . . . 2 25684 4 >> 132 1 2.155 . 37.7804645042 . . . . . . . . . . 2 25684 4 >> 132 2 31.533 . 125.1608504190 . . . . . . . . . . 2 25684 4 >> 132 3 1.933 . 77.0584539060 . . . . . . . . . . 2 25684 4 >> 133 1 2.155 . 39.0884553273 . . . . . . . . . . 2 25684 4 >> 133 2 31.533 . 126.9627572070 . . . . . . . . . . 2 25684 4 >> 133 3 2.155 . 67.3033567669 . . . . . . . . . . 2 25684 4 >> 134 1 2.155 . 33.2468990738 . . . . . . . . . . 2 25684 4 >> 134 2 31.533 . 105.6103642300 . . . . . . . . . . 2 25684 4 >> 134 3 3.514 . 83.9035996133 . . . . . . . . . . 2 25684 4 >> 135 1 2.155 . 34.3464241558 . . . . . . . . . . 2 25684 4 >> 135 2 31.533 . 116.0630432920 . . . . . . . . . . 2 25684 4 >> 135 3 4.235 . 72.4451293556 . . . . . . . . . . 2 25684 4 >> 136 1 1.715 . 36.3490499211 . . . . . . . . . . 2 25684 4 >> 136 2 31.533 . 100.0070415040 . . . . . . . . . . 2 25684 4 >> 136 3 4.235 . 78.7757759069 . . . . . . . . . . 2 25684 4 >> 137 1 1.715 . 36.2203580737 . . . . . . . . . . 2 25684 4 >> 137 2 31.533 . 86.7919785974 . . . . . . . . . . 2 25684 4 >> 137 3 3.514 . 107.7062941500 . . . . . . . . . . 2 25684 4 >> 138 1 1.714 . 32.7840599736 . . . . . . . . . . 2 25684 4 >> 138 2 31.533 . 97.1158921856 . . . . . . . . . . 2 25684 4 >> 138 3 2.155 . 75.8212953511 . . . . . . . . . . 2 25684 4 >> 139 1 1.714 . 35.0004195673 . . . . . . . . . . 2 25684 4 >> 139 2 31.533 . 92.5556507818 . . . . . . . . . . 2 25684 4 >> 139 3 1.933 . 80.6980391775 . . . . . . . . . . 2 25684 4 >> 140 1 1.714 . 34.3419086523 . . . . . . . . . . 2 25684 4 >> 140 2 31.533 . 103.1743482220 . . . . . . . . . . 2 25684 4 >> 140 3 1.714 . 72.1629327382 . . . . . . . . . . 2 25684 4 >> 141 1 4.235 . 29.1964925089 . . . . . . . . . . 2 25684 4 >> 141 2 62.850 . 99.0850321205 . . . . . . . . . . 2 25684 4 >> 141 3 1.240 . 70.7074205269 . . . . . . . . . . 2 25684 4 >> 142 1 3.545 . 60.4768898447 . . . . . . . . . . 2 25684 4 >> 142 2 49.991 . 85.1577098791 . . . . . . . . . . 2 25684 4 >> 142 3 4.511 . 74.0240355252 . . . . . . . . . . 2 25684 4 >> 143 1 3.514 . 62.9333237034 . . . . . . . . . . 2 25684 4 >> 143 2 49.991 . 82.9035042411 . . . . . . . . . . 2 25684 4 >> 143 3 4.511 . 76.3647652627 . . . . . . . . . . 2 25684 4 >> 144 1 3.545 . 59.5700262418 . . . . . . . . . . 2 25684 4 >> 144 2 49.990 . 94.3680855646 . . . . . . . . . . 2 25684 4 >> 144 3 4.244 . 77.9517188643 . . . . . . . . . . 2 25684 4 >> 145 1 3.545 . 62.7707655804 . . . . . . . . . . 2 25684 4 >> 145 2 49.991 . 111.7850331320 . . . . . . . . . . 2 25684 4 >> 145 3 3.545 . 70.6923986537 . . . . . . . . . . 2 25684 4 >> 146 1 3.514 . 54.2703303983 . . . . . . . . . . 2 25684 4 >> 146 2 49.990 . 70.6335313219 . . . . . . . . . . 2 25684 4 >> 146 3 4.242 . 93.5057955433 . . . . . . . . . . 2 25684 4 >> 147 1 3.514 . 61.7735919092 . . . . . . . . . . 2 25684 4 >> 147 2 49.991 . 85.6330893328 . . . . . . . . . . 2 25684 4 >> 147 3 3.514 . 77.9742516740 . . . . . . . . . . 2 25684 4 >> 148 1 2.155 . 33.7293053555 . . . . . . . . . . 2 25684 4 >> 148 2 31.533 . 110.3439126240 . . . . . . . . . . 2 25684 4 >> 148 3 3.545 . 87.5067031928 . . . . . . . . . . 2 25684 4 >> 149 1 1.933 . 32.6403164481 . . . . . . . . . . 2 25684 4 >> 149 2 26.906 . 95.9902065967 . . . . . . . . . . 2 25684 4 >> 149 3 3.545 . 91.8099333612 . . . . . . . . . . 2 25684 4 >> 150 1 4.235 . 31.2698611611 . . . . . . . . . . 2 25684 4 >> 150 2 62.850 . 125.6623473980 . . . . . . . . . . 2 25684 4 >> 150 3 3.545 . 93.0985954812 . . . . . . . . . . 2 25684 4 >> 151 1 3.544 . 56.8230949966 . . . . . . . . . . 2 25684 4 >> 151 2 49.991 . 79.7965310311 . . . . . . . . . . 2 25684 4 >> 151 3 2.155 . 74.3609546806 . . . . . . . . . . 2 25684 4 >> 152 1 3.544 . 61.6900550960 . . . . . . . . . . 2 25684 4 >> 152 2 49.991 . 90.6735692648 . . . . . . . . . . 2 25684 4 >> 152 3 1.933 . 76.9994394042 . . . . . . . . . . 2 25684 4 >> 153 1 3.544 . 61.7186532843 . . . . . . . . . . 2 25684 4 >> 153 2 49.991 . 82.8512691904 . . . . . . . . . . 2 25684 4 >> 153 3 1.722 . 76.7826952342 . . . . . . . . . . 2 25684 4 >> 154 1 3.546 . 64.3286142592 . . . . . . . . . . 2 25684 4 >> 154 2 49.991 . 86.0975358690 . . . . . . . . . . 2 25684 4 >> 154 3 1.423 . 101.0306810120 . . . . . . . . . . 2 25684 4 >> 155 1 3.546 . 61.8616442258 . . . . . . . . . . 2 25684 4 >> 155 2 49.991 . 84.4770345284 . . . . . . . . . . 2 25684 4 >> 155 3 0.884 . 68.6086502465 . . . . . . . . . . 2 25684 4 >> 156 1 3.514 . 61.7269317072 . . . . . . . . . . 2 25684 4 >> 156 2 49.991 . 79.8560546936 . . . . . . . . . . 2 25684 4 >> 156 3 0.884 . 75.3717121469 . . . . . . . . . . 2 25684 4 >> 157 1 3.514 . 61.4499808310 . . . . . . . . . . 2 25684 4 >> 157 2 49.991 . 80.5889650950 . . . . . . . . . . 2 25684 4 >> 157 3 1.421 . 100.9829329150 . . . . . . . . . . 2 25684 4 >> 158 1 3.514 . 61.6223225447 . . . . . . . . . . 2 25684 4 >> 158 2 49.991 . 83.9729055506 . . . . . . . . . . 2 25684 4 >> 158 3 1.724 . 65.6305638901 . . . . . . . . . . 2 25684 4 >> 159 1 3.514 . 62.1295640952 . . . . . . . . . . 2 25684 4 >> 159 2 49.991 . 83.6335801824 . . . . . . . . . . 2 25684 4 >> 159 3 1.933 . 77.3814241792 . . . . . . . . . . 2 25684 4 >> 160 1 3.514 . 56.3534826413 . . . . . . . . . . 2 25684 4 >> 160 2 49.991 . 75.0010294378 . . . . . . . . . . 2 25684 4 >> 160 3 2.155 . 71.8249405918 . . . . . . . . . . 2 25684 4 >> 161 1 4.281 . 24.6764735887 . . . . . . . . . . 2 25684 4 >> 161 2 61.974 . 153.6619542700 . . . . . . . . . . 2 25684 4 >> 161 3 1.240 . 67.9240820262 . . . . . . . . . . 2 25684 4 >> 162 1 4.282 . 23.5581339092 . . . . . . . . . . 2 25684 4 >> 162 2 61.974 . 110.8024877790 . . . . . . . . . . 2 25684 4 >> 162 3 0.884 . 71.8179661507 . . . . . . . . . . 2 25684 4 >> 163 1 4.280 . 34.1816082810 . . . . . . . . . . 2 25684 4 >> 163 2 61.974 . 171.5067028530 . . . . . . . . . . 2 25684 4 >> 163 3 4.279 . 63.3021735484 . . . . . . . . . . 2 25684 4 >> 164 1 4.703 . 28.7998807922 . . . . . . . . . . 2 25684 4 >> 164 2 57.041 . 106.6574947820 . . . . . . . . . . 2 25684 4 >> 164 3 4.703 . 61.9174787392 . . . . . . . . . . 2 25684 4 >> 165 1 2.312 . 33.0271445742 . . . . . . . . . . 2 25684 4 >> 165 2 31.879 . 91.9442172425 . . . . . . . . . . 2 25684 4 >> 165 3 4.321 . 73.7370104485 . . . . . . . . . . 2 25684 4 >> 166 1 1.994 . 40.7110262217 . . . . . . . . . . 2 25684 4 >> 166 2 31.879 . 124.2141407400 . . . . . . . . . . 2 25684 4 >> 166 3 4.321 . 77.1099574711 . . . . . . . . . . 2 25684 4 >> 167 1 2.311 . 29.6653522804 . . . . . . . . . . 2 25684 4 >> 167 2 31.879 . 72.4463710275 . . . . . . . . . . 2 25684 4 >> 167 3 3.689 . 95.4747339198 . . . . . . . . . . 2 25684 4 >> 168 1 2.311 . 37.8421763842 . . . . . . . . . . 2 25684 4 >> 168 2 31.879 . 99.1769496128 . . . . . . . . . . 2 25684 4 >> 168 3 3.440 . 82.6567841400 . . . . . . . . . . 2 25684 4 >> 169 1 2.312 . 34.3968472772 . . . . . . . . . . 2 25684 4 >> 169 2 31.879 . 100.7010793090 . . . . . . . . . . 2 25684 4 >> 169 3 2.313 . 66.9787770073 . . . . . . . . . . 2 25684 4 >> 170 1 2.311 . 33.3936529348 . . . . . . . . . . 2 25684 4 >> 170 2 31.879 . 90.8128627334 . . . . . . . . . . 2 25684 4 >> 170 3 1.998 . 81.3037425636 . . . . . . . . . . 2 25684 4 >> 171 1 1.991 . 42.4306804396 . . . . . . . . . . 2 25684 4 >> 171 2 31.879 . 118.4350814870 . . . . . . . . . . 2 25684 4 >> 171 3 1.991 . 68.8371973169 . . . . . . . . . . 2 25684 4 >> 172 1 1.991 . 34.7761495642 . . . . . . . . . . 2 25684 4 >> 172 2 31.879 . 105.3860369580 . . . . . . . . . . 2 25684 4 >> 172 3 2.313 . 76.5761444781 . . . . . . . . . . 2 25684 4 >> 173 1 1.992 . 37.2416144298 . . . . . . . . . . 2 25684 4 >> 173 2 31.879 . 100.9075899750 . . . . . . . . . . 2 25684 4 >> 173 3 3.440 . 73.9194189084 . . . . . . . . . . 2 25684 4 >> 174 1 1.992 . 36.9782100638 . . . . . . . . . . 2 25684 4 >> 174 2 31.879 . 96.8777975359 . . . . . . . . . . 2 25684 4 >> 174 3 3.689 . 84.9889299501 . . . . . . . . . . 2 25684 4 >> 175 1 2.722 . 30.6497320252 . . . . . . . . . . 2 25684 4 >> 175 2 27.389 . 89.4984830853 . . . . . . . . . . 2 25684 4 >> 175 3 4.664 . 70.0341187115 . . . . . . . . . . 2 25684 4 >> 176 1 4.664 . 28.5793737086 . . . . . . . . . . 2 25684 4 >> 176 2 55.616 . 131.1387268040 . . . . . . . . . . 2 25684 4 >> 176 3 4.664 . 64.9368752468 . . . . . . . . . . 2 25684 4 >> 177 1 2.808 . 30.1597999045 . . . . . . . . . . 2 25684 4 >> 177 2 27.389 . 89.8953075015 . . . . . . . . . . 2 25684 4 >> 177 3 4.664 . 72.0749474810 . . . . . . . . . . 2 25684 4 >> 178 1 4.664 . 22.6941675888 . . . . . . . . . . 2 25684 4 >> 178 2 55.616 . 110.6678509230 . . . . . . . . . . 2 25684 4 >> 178 3 3.689 . 80.0445876945 . . . . . . . . . . 2 25684 4 >> 179 1 4.664 . 22.2576689252 . . . . . . . . . . 2 25684 4 >> 179 2 55.616 . 106.9919610750 . . . . . . . . . . 2 25684 4 >> 179 3 3.440 . 82.8354371317 . . . . . . . . . . 2 25684 4 >> 180 1 4.664 . 24.1684794544 . . . . . . . . . . 2 25684 4 >> 180 2 55.616 . 119.0718227060 . . . . . . . . . . 2 25684 4 >> 180 3 2.808 . 154.5262538560 . . . . . . . . . . 2 25684 4 >> 181 1 4.664 . 24.6538960717 . . . . . . . . . . 2 25684 4 >> 181 2 55.616 . 122.8205986700 . . . . . . . . . . 2 25684 4 >> 181 3 2.722 . 148.8951973980 . . . . . . . . . . 2 25684 4 >> 182 1 4.664 . 22.1440287558 . . . . . . . . . . 2 25684 4 >> 182 2 55.616 . 102.7943281050 . . . . . . . . . . 2 25684 4 >> 182 3 1.993 . 105.8580672550 . . . . . . . . . . 2 25684 4 >> 183 1 2.722 . 32.3069217792 . . . . . . . . . . 2 25684 4 >> 183 2 27.389 . 87.1726060987 . . . . . . . . . . 2 25684 4 >> 183 3 3.689 . 74.0197435614 . . . . . . . . . . 2 25684 4 >> 184 1 4.664 . 16.9271171417 . . . . . . . . . . 2 25684 4 >> 184 2 55.616 . 78.0237786900 . . . . . . . . . . 2 25684 4 >> 184 3 4.324 . 203.3489511530 . . . . . . . . . . 2 25684 4 >> 185 1 2.808 . 28.4672387071 . . . . . . . . . . 2 25684 4 >> 185 2 27.389 . 85.8476984559 . . . . . . . . . . 2 25684 4 >> 185 3 3.691 . 74.8432641085 . . . . . . . . . . 2 25684 4 >> 186 1 4.343 . 35.3706908475 . . . . . . . . . . 2 25684 4 >> 186 2 69.340 . 113.5968605300 . . . . . . . . . . 2 25684 4 >> 186 3 4.342 . 63.1498088348 . . . . . . . . . . 2 25684 4 >> 187 1 4.448 . 19.7538222806 . . . . . . . . . . 2 25684 4 >> 187 2 61.583 . 110.4678190230 . . . . . . . . . . 2 25684 4 >> 187 3 1.257 . 66.7915400881 . . . . . . . . . . 2 25684 4 >> 188 1 4.511 . 32.4137886934 . . . . . . . . . . 2 25684 4 >> 188 2 52.218 . 97.8617601190 . . . . . . . . . . 2 25684 4 >> 188 3 1.519 . 188.6430738120 . . . . . . . . . . 2 25684 4 >> 189 1 4.447 . 18.5203372639 . . . . . . . . . . 2 25684 4 >> 189 2 61.583 . 109.6099899150 . . . . . . . . . . 2 25684 4 >> 189 3 4.447 . 64.5119708342 . . . . . . . . . . 2 25684 4 >> 190 1 4.511 . 28.3039280002 . . . . . . . . . . 2 25684 4 >> 190 2 52.218 . 96.8312314054 . . . . . . . . . . 2 25684 4 >> 190 3 0.850 . 95.2896429825 . . . . . . . . . . 2 25684 4 >> 191 1 4.584 . 29.8933852029 . . . . . . . . . . 2 25684 4 >> 191 2 58.031 . 94.3921784756 . . . . . . . . . . 2 25684 4 >> 191 3 3.943 . 113.9076452930 . . . . . . . . . . 2 25684 4 >> 192 1 4.584 . 31.9012790556 . . . . . . . . . . 2 25684 4 >> 192 2 58.031 . 136.8598820860 . . . . . . . . . . 2 25684 4 >> 192 3 4.584 . 58.8471151618 . . . . . . . . . . 2 25684 4 >> 193 1 4.348 . 34.5112400305 . . . . . . . . . . 2 25684 4 >> 193 2 69.128 . 123.5385775410 . . . . . . . . . . 2 25684 4 >> 193 3 1.257 . 68.3924425719 . . . . . . . . . . 2 25684 4 >> 194 1 4.347 . 30.8371254170 . . . . . . . . . . 2 25684 4 >> 194 2 69.128 . 130.3624010780 . . . . . . . . . . 2 25684 4 >> 194 3 4.346 . 65.8634029243 . . . . . . . . . . 2 25684 4 >> 195 1 1.255 . 49.9602823870 . . . . . . . . . . 2 25684 4 >> 195 2 21.121 . 125.3916564570 . . . . . . . . . . 2 25684 4 >> 195 3 1.255 . 59.9061572205 . . . . . . . . . . 2 25684 4 >> 196 1 4.732 . 21.9566353640 . . . . . . . . . . 2 25684 4 >> 196 2 55.490 . 85.4638315716 . . . . . . . . . . 2 25684 4 >> 196 3 3.171 . 149.5786926270 . . . . . . . . . . 2 25684 4 >> 197 1 4.732 . 21.3673621682 . . . . . . . . . . 2 25684 4 >> 197 2 55.490 . 90.9853598776 . . . . . . . . . . 2 25684 4 >> 197 3 3.250 . 140.7039845550 . . . . . . . . . . 2 25684 4 >> 198 1 4.733 . 24.3475944232 . . . . . . . . . . 2 25684 4 >> 198 2 55.490 . 105.8205192020 . . . . . . . . . . 2 25684 4 >> 198 3 4.732 . 64.0291249108 . . . . . . . . . . 2 25684 4 >> 199 1 4.375 . 30.6143605818 . . . . . . . . . . 2 25684 4 >> 199 2 54.804 . 123.8128621720 . . . . . . . . . . 2 25684 4 >> 199 3 4.375 . 61.9528874402 . . . . . . . . . . 2 25684 4 >> 200 1 4.375 . 27.9547290693 . . . . . . . . . . 2 25684 4 >> 200 2 54.804 . 120.0041576220 . . . . . . . . . . 2 25684 4 >> 200 3 1.617 . 119.7747597580 . . . . . . . . . . 2 25684 4 >> 201 1 4.374 . 29.5855783867 . . . . . . . . . . 2 25684 4 >> 201 2 54.804 . 105.6549057460 . . . . . . . . . . 2 25684 4 >> 201 3 0.905 . 71.6119518901 . . . . . . . . . . 2 25684 4 >> 202 1 4.374 . 29.1265022060 . . . . . . . . . . 2 25684 4 >> 202 2 54.804 . 104.4615980380 . . . . . . . . . . 2 25684 4 >> 202 3 0.958 . 77.3358220642 . . . . . . . . . . 2 25684 4 >> 203 1 4.375 . 27.3564248666 . . . . . . . . . . 2 25684 4 >> 203 2 54.804 . 117.6013452900 . . . . . . . . . . 2 25684 4 >> 203 3 1.676 . 119.9974053780 . . . . . . . . . . 2 25684 4 >> 204 1 4.375 . 93.5853134803 . . . . . . . . . . 2 25684 4 >> 204 2 54.804 . 113.2658360810 . . . . . . . . . . 2 25684 4 >> 204 3 1.542 . 215.4871611710 . . . . . . . . . . 2 25684 4 >> 205 1 1.617 . 40.1985165839 . . . . . . . . . . 2 25684 4 >> 205 2 42.013 . 102.8690363750 . . . . . . . . . . 2 25684 4 >> 205 3 0.957 . 103.3156152200 . . . . . . . . . . 2 25684 4 >> 206 1 1.617 . 130.8096184800 . . . . . . . . . . 2 25684 4 >> 206 2 42.013 . 90.3974118649 . . . . . . . . . . 2 25684 4 >> 206 3 0.884 . 125.1960464870 . . . . . . . . . . 2 25684 4 >> 207 1 1.617 . 41.9693465072 . . . . . . . . . . 2 25684 4 >> 207 2 42.013 . 103.6452735240 . . . . . . . . . . 2 25684 4 >> 207 3 1.617 . 102.1412266360 . . . . . . . . . . 2 25684 4 >> 208 1 1.617 . 38.5721827699 . . . . . . . . . . 2 25684 4 >> 208 2 42.013 . 98.5614668448 . . . . . . . . . . 2 25684 4 >> 208 3 4.375 . 69.8136190731 . . . . . . . . . . 2 25684 4 >> 209 1 1.676 . 31.0636531718 . . . . . . . . . . 2 25684 4 >> 209 2 42.013 . 93.6242422456 . . . . . . . . . . 2 25684 4 >> 209 3 4.375 . 65.3161775444 . . . . . . . . . . 2 25684 4 >> 210 1 1.676 . 34.7708814769 . . . . . . . . . . 2 25684 4 >> 210 2 42.013 . 101.7963956830 . . . . . . . . . . 2 25684 4 >> 210 3 1.676 . 103.5570381820 . . . . . . . . . . 2 25684 4 >> 211 1 1.676 . 34.8310881892 . . . . . . . . . . 2 25684 4 >> 211 2 42.013 . 100.4277563700 . . . . . . . . . . 2 25684 4 >> 211 3 0.957 . 102.8858823490 . . . . . . . . . . 2 25684 4 >> 212 1 1.676 . 33.6871606569 . . . . . . . . . . 2 25684 4 >> 212 2 42.013 . 89.9248668713 . . . . . . . . . . 2 25684 4 >> 212 3 0.884 . 114.1624806420 . . . . . . . . . . 2 25684 4 >> 213 1 1.518 . 54.3990222457 . . . . . . . . . . 2 25684 4 >> 213 2 26.595 . 131.2687070460 . . . . . . . . . . 2 25684 4 >> 213 3 0.884 . 83.9942673479 . . . . . . . . . . 2 25684 4 >> 214 1 1.517 . 36.9149930160 . . . . . . . . . . 2 25684 4 >> 214 2 26.595 . 81.2016134029 . . . . . . . . . . 2 25684 4 >> 214 3 0.957 . 146.9144561210 . . . . . . . . . . 2 25684 4 >> 215 1 1.518 . 41.7480868397 . . . . . . . . . . 2 25684 4 >> 215 2 26.595 . 114.6166587870 . . . . . . . . . . 2 25684 4 >> 215 3 1.518 . 71.7895318908 . . . . . . . . . . 2 25684 4 >> 216 1 4.350 . 34.7151902681 . . . . . . . . . . 2 25684 4 >> 216 2 56.073 . 107.5390118780 . . . . . . . . . . 2 25684 4 >> 216 3 4.350 . 57.4989020446 . . . . . . . . . . 2 25684 4 >> 217 1 4.349 . 50.3147494053 . . . . . . . . . . 2 25684 4 >> 217 2 56.073 . 81.4042773012 . . . . . . . . . . 2 25684 4 >> 217 3 2.140 . 69.7170498885 . . . . . . . . . . 2 25684 4 >> 218 1 4.349 . 34.6685300661 . . . . . . . . . . 2 25684 4 >> 218 2 56.073 . 76.0483624506 . . . . . . . . . . 2 25684 4 >> 218 3 2.012 . 59.2924064023 . . . . . . . . . . 2 25684 4 >> 219 1 4.350 . 22.6836314141 . . . . . . . . . . 2 25684 4 >> 219 2 56.073 . 106.0335086330 . . . . . . . . . . 2 25684 4 >> 219 3 1.897 . 144.1515044480 . . . . . . . . . . 2 25684 4 >> 220 1 4.350 . 25.2582209456 . . . . . . . . . . 2 25684 4 >> 220 2 56.073 . 110.7263622780 . . . . . . . . . . 2 25684 4 >> 220 3 1.816 . 147.7277832540 . . . . . . . . . . 2 25684 4 >> 221 1 4.350 . 23.5724330033 . . . . . . . . . . 2 25684 4 >> 221 2 56.073 . 86.0568411202 . . . . . . . . . . 2 25684 4 >> 221 3 1.493 . 69.1746529678 . . . . . . . . . . 2 25684 4 >> 222 1 4.350 . 20.4672718204 . . . . . . . . . . 2 25684 4 >> 222 2 56.073 . 90.8835217748 . . . . . . . . . . 2 25684 4 >> 222 3 1.477 . 64.8698133130 . . . . . . . . . . 2 25684 4 >> 223 1 4.303 . 19.6198623459 . . . . . . . . . . 2 25684 4 >> 223 2 56.436 . 87.5925111187 . . . . . . . . . . 2 25684 4 >> 223 3 2.140 . 61.5709026653 . . . . . . . . . . 2 25684 4 >> 224 1 4.303 . 20.6877789039 . . . . . . . . . . 2 25684 4 >> 224 2 56.436 . 99.9544015303 . . . . . . . . . . 2 25684 4 >> 224 3 2.013 . 56.0911379302 . . . . . . . . . . 2 25684 4 >> 225 1 2.140 . 32.8277098399 . . . . . . . . . . 2 25684 4 >> 225 2 29.862 . 153.3345741260 . . . . . . . . . . 2 25684 4 >> 225 3 2.140 . 57.9302444028 . . . . . . . . . . 2 25684 4 >> 226 1 2.140 . 37.1648508717 . . . . . . . . . . 2 25684 4 >> 226 2 29.862 . 142.6494693350 . . . . . . . . . . 2 25684 4 >> 226 3 4.303 . 72.6956727403 . . . . . . . . . . 2 25684 4 >> 227 1 2.015 . 33.7917698194 . . . . . . . . . . 2 25684 4 >> 227 2 29.862 . 162.3441080660 . . . . . . . . . . 2 25684 4 >> 227 3 2.015 . 61.0531845363 . . . . . . . . . . 2 25684 4 >> 228 1 1.896 . 31.3105006919 . . . . . . . . . . 2 25684 4 >> 228 2 32.724 . 81.2421056903 . . . . . . . . . . 2 25684 4 >> 228 3 4.351 . 62.8273750570 . . . . . . . . . . 2 25684 4 >> 229 1 1.813 . 30.3915957466 . . . . . . . . . . 2 25684 4 >> 229 2 32.724 . 78.4368000212 . . . . . . . . . . 2 25684 4 >> 229 3 4.351 . 75.2633400619 . . . . . . . . . . 2 25684 4 >> 230 1 1.895 . 49.2904827135 . . . . . . . . . . 2 25684 4 >> 230 2 32.724 . 111.5870258460 . . . . . . . . . . 2 25684 4 >> 230 3 1.895 . 119.3466363730 . . . . . . . . . . 2 25684 4 >> 231 1 1.895 . 30.6422061862 . . . . . . . . . . 2 25684 4 >> 231 2 32.724 . 100.4751323460 . . . . . . . . . . 2 25684 4 >> 231 3 1.811 . 146.0893260880 . . . . . . . . . . 2 25684 4 >> 232 1 1.895 . 31.5340181110 . . . . . . . . . . 2 25684 4 >> 232 2 32.724 . 78.7340134105 . . . . . . . . . . 2 25684 4 >> 232 3 1.494 . 70.8807085638 . . . . . . . . . . 2 25684 4 >> 233 1 1.813 . 28.3250003495 . . . . . . . . . . 2 25684 4 >> 233 2 32.724 . 92.2884016852 . . . . . . . . . . 2 25684 4 >> 233 3 1.894 . 157.0826547730 . . . . . . . . . . 2 25684 4 >> 234 1 1.813 . 36.0367276014 . . . . . . . . . . 2 25684 4 >> 234 2 32.724 . 98.0998547687 . . . . . . . . . . 2 25684 4 >> 234 3 1.813 . 91.6935138442 . . . . . . . . . . 2 25684 4 >> 235 1 1.814 . 39.1403836166 . . . . . . . . . . 2 25684 4 >> 235 2 32.724 . 115.2224234070 . . . . . . . . . . 2 25684 4 >> 235 3 1.494 . 83.9170120001 . . . . . . . . . . 2 25684 4 >> 236 1 4.303 . 23.3978335379 . . . . . . . . . . 2 25684 4 >> 236 2 56.436 . 103.3498822880 . . . . . . . . . . 2 25684 4 >> 236 3 4.303 . 55.0127820346 . . . . . . . . . . 2 25684 4 >> 237 1 2.358 . 48.1668749467 . . . . . . . . . . 2 25684 4 >> 237 2 35.916 . 108.1087383610 . . . . . . . . . . 2 25684 4 >> 237 3 4.303 . 119.8112414500 . . . . . . . . . . 2 25684 4 >> 238 1 2.358 . 37.2641919469 . . . . . . . . . . 2 25684 4 >> 238 2 35.916 . 112.1668754020 . . . . . . . . . . 2 25684 4 >> 238 3 2.358 . 76.3679842355 . . . . . . . . . . 2 25684 4 >> 239 1 4.237 . 23.2315124954 . . . . . . . . . . 2 25684 4 >> 239 2 57.186 . 97.5874248720 . . . . . . . . . . 2 25684 4 >> 239 3 4.237 . 56.5707648807 . . . . . . . . . . 2 25684 4 >> 240 1 4.567 . 25.3598197725 . . . . . . . . . . 2 25684 4 >> 240 2 57.311 . 79.5424419279 . . . . . . . . . . 2 25684 4 >> 240 3 0.850 . 120.4630834470 . . . . . . . . . . 2 25684 4 >> 241 1 4.355 . 29.3011016714 . . . . . . . . . . 2 25684 4 >> 241 2 52.290 . 169.2326559940 . . . . . . . . . . 2 25684 4 >> 241 3 1.465 . 60.4083169808 . . . . . . . . . . 2 25684 4 >> 242 1 4.356 . 26.3464572690 . . . . . . . . . . 2 25684 4 >> 242 2 52.290 . 169.4747998720 . . . . . . . . . . 2 25684 4 >> 242 3 4.356 . 59.8240734135 . . . . . . . . . . 2 25684 4 >> 243 1 4.303 . 15.7613646762 . . . . . . . . . . 2 25684 4 >> 243 2 56.436 . 90.3860740245 . . . . . . . . . . 2 25684 4 >> 243 3 2.358 . 82.2216863135 . . . . . . . . . . 2 25684 4 >> 244 1 0.884 . 19.3346330467 . . . . . . . . . . 2 25684 4 >> 244 2 23.577 . 141.6509295280 . . . . . . . . . . 2 25684 4 >> 244 3 4.511 . 92.2235713690 . . . . . . . . . . 2 25684 4 >> 245 1 4.511 . 27.9246257132 . . . . . . . . . . 2 25684 4 >> 245 2 52.218 . 105.8982643940 . . . . . . . . . . 2 25684 4 >> 245 3 3.529 . 83.7941545374 . . . . . . . . . . 2 25684 4 >> 246 1 0.966 . 13.7143364606 . . . . . . . . . . 2 25684 4 >> 246 2 24.638 . 65.8072555901 . . . . . . . . . . 2 25684 4 >> 246 3 1.671 . 77.5010626691 . . . . . . . . . . 2 25684 4 >> 247 1 0.965 . 16.9654989207 . . . . . . . . . . 2 25684 4 >> 247 2 24.638 . 49.0782719855 . . . . . . . . . . 2 25684 4 >> 247 3 1.530 . 70.4590231241 . . . . . . . . . . 2 25684 4 >> 248 1 0.965 . 20.9203273299 . . . . . . . . . . 2 25684 4 >> 248 2 24.638 . 86.0695961907 . . . . . . . . . . 2 25684 4 >> 248 3 0.965 . 62.7742620055 . . . . . . . . . . 2 25684 4 >> 249 1 1.744 . 34.3991050289 . . . . . . . . . . 2 25684 4 >> 249 2 28.715 . 95.2678241900 . . . . . . . . . . 2 25684 4 >> 249 3 1.745 . 61.8885079838 . . . . . . . . . . 2 25684 4 >> 250 1 1.744 . 36.9006939218 . . . . . . . . . . 2 25684 4 >> 250 2 28.715 . 96.4704451249 . . . . . . . . . . 2 25684 4 >> 250 3 3.049 . 62.4384158410 . . . . . . . . . . 2 25684 4 >> 251 1 4.457 . 20.3190127916 . . . . . . . . . . 2 25684 4 >> 251 2 58.159 . 61.4405673200 . . . . . . . . . . 2 25684 4 >> 251 3 2.769 . 171.2563286060 . . . . . . . . . . 2 25684 4 >> 252 1 4.457 . 18.3630472282 . . . . . . . . . . 2 25684 4 >> 252 2 58.159 . 56.2575545365 . . . . . . . . . . 2 25684 4 >> 252 3 2.787 . 159.5280011270 . . . . . . . . . . 2 25684 4 >> 253 1 1.541 . 44.3196660356 . . . . . . . . . . 2 25684 4 >> 253 2 41.901 . 103.1666546870 . . . . . . . . . . 2 25684 4 >> 253 3 4.322 . 73.4526678491 . . . . . . . . . . 2 25684 4 >> 254 1 4.567 . 27.1133402660 . . . . . . . . . . 2 25684 4 >> 254 2 57.300 . 133.4020432060 . . . . . . . . . . 2 25684 4 >> 254 3 3.225 . 96.0772183331 . . . . . . . . . . 2 25684 4 >> 255 1 1.717 . 36.2203580737 . . . . . . . . . . 2 25684 4 >> 255 2 31.531 . 86.7919785974 . . . . . . . . . . 2 25684 4 >> 255 3 3.546 . 107.7062941500 . . . . . . . . . . 2 25684 4 >> 256 1 0.904 . 27.8102329600 . . . . . . . . . . 2 25684 4 >> 256 2 23.205 . 90.4460026098 . . . . . . . . . . 2 25684 4 >> 256 3 0.904 . 59.8331938365 . . . . . . . . . . 2 25684 4 >> 257 1 4.703 . 32.7584721209 . . . . . . . . . . 2 25684 4 >> 257 2 57.036 . 108.1459912660 . . . . . . . . . . 2 25684 4 >> 257 3 7.266 . 71.6618459688 . . . . . . . . . . 2 25684 4 >> 258 1 1.541 . 47.2208769809 . . . . . . . . . . 2 25684 4 >> 258 2 41.901 . 104.3607722420 . . . . . . . . . . 2 25684 4 >> 258 3 1.390 . 68.7175588270 . . . . . . . . . . 2 25684 4 >> 259 1 1.541 . 43.2336874639 . . . . . . . . . . 2 25684 4 >> 259 2 41.901 . 102.7714499630 . . . . . . . . . . 2 25684 4 >> 259 3 0.876 . 136.5026885260 . . . . . . . . . . 2 25684 4 >> 260 1 1.541 . 44.4792138230 . . . . . . . . . . 2 25684 4 >> 260 2 41.901 . 97.5677861127 . . . . . . . . . . 2 25684 4 >> 260 3 0.794 . 144.1472124850 . . . . . . . . . . 2 25684 4 >> 261 1 1.541 . 46.5292523742 . . . . . . . . . . 2 25684 4 >> 261 2 41.901 . 104.7247979060 . . . . . . . . . . 2 25684 4 >> 261 3 1.541 . 68.1290232959 . . . . . . . . . . 2 25684 4 >> 262 1 2.017 . 30.8393831687 . . . . . . . . . . 2 25684 4 >> 262 2 26.874 . 98.8011811860 . . . . . . . . . . 2 25684 4 >> 262 3 2.308 . 72.7337639187 . . . . . . . . . . 2 25684 4 >> 263 1 2.017 . 41.9309647281 . . . . . . . . . . 2 25684 4 >> 263 2 26.874 . 102.9143877370 . . . . . . . . . . 2 25684 4 >> 263 3 2.017 . 81.4593262500 . . . . . . . . . . 2 25684 4 >> 264 1 2.017 . 117.1697878260 . . . . . . . . . . 2 25684 4 >> 264 2 26.874 . 125.3414460210 . . . . . . . . . . 2 25684 4 >> 264 3 3.444 . 72.4488848239 . . . . . . . . . . 2 25684 4 >> 265 1 2.017 . 37.4056777206 . . . . . . . . . . 2 25684 4 >> 265 2 26.874 . 96.5635773859 . . . . . . . . . . 2 25684 4 >> 265 3 3.688 . 77.8320803744 . . . . . . . . . . 2 25684 4 >> 266 1 2.017 . 35.0365435946 . . . . . . . . . . 2 25684 4 >> 266 2 26.874 . 92.3896324036 . . . . . . . . . . 2 25684 4 >> 266 3 4.312 . 76.2365428453 . . . . . . . . . . 2 25684 4 >> 267 1 2.805 . 31.8109689872 . . . . . . . . . . 2 25684 4 >> 267 2 27.388 . 89.9309407144 . . . . . . . . . . 2 25684 4 >> 267 3 2.807 . 128.6972159270 . . . . . . . . . . 2 25684 4 >> 268 1 2.805 . 27.1434436221 . . . . . . . . . . 2 25684 4 >> 268 2 27.388 . 81.8592081498 . . . . . . . . . . 2 25684 4 >> 268 3 2.723 . 150.2477024790 . . . . . . . . . . 2 25684 4 >> 269 1 2.718 . 36.0713464610 . . . . . . . . . . 2 25684 4 >> 269 2 27.388 . 87.7929479412 . . . . . . . . . . 2 25684 4 >> 269 3 2.717 . 130.6564973850 . . . . . . . . . . 2 25684 4 >> 270 1 2.718 . 29.3462567056 . . . . . . . . . . 2 25684 4 >> 270 2 27.388 . 82.6925394239 . . . . . . . . . . 2 25684 4 >> 270 3 2.806 . 161.4379250020 . . . . . . . . . . 2 25684 4 >> 271 1 2.717 . 27.0425973791 . . . . . . . . . . 2 25684 4 >> 271 2 27.388 . 66.2551002884 . . . . . . . . . . 2 25684 4 >> 271 3 3.441 . 138.8047905900 . . . . . . . . . . 2 25684 4 >> 272 1 2.806 . 28.6117348165 . . . . . . . . . . 2 25684 4 >> 272 2 27.388 . 91.8680917423 . . . . . . . . . . 2 25684 4 >> 272 3 3.445 . 108.6333583230 . . . . . . . . . . 2 25684 4 >> 273 1 2.805 . 39.7559972490 . . . . . . . . . . 2 25684 4 >> 273 2 27.388 . 60.2500940713 . . . . . . . . . . 2 25684 4 >> 273 3 0.894 . 82.1685732619 . . . . . . . . . . 2 25684 4 >> 274 1 2.718 . 34.4261980494 . . . . . . . . . . 2 25684 4 >> 274 2 27.388 . 60.9336038821 . . . . . . . . . . 2 25684 4 >> 274 3 0.895 . 101.4126657870 . . . . . . . . . . 2 25684 4 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 4.627 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 4 >> 1 2 . 1 . . 53.932 . 4 1 1 10 ASP CA . . . . . . 74 . 25684 4 >> 1 3 . 1 . . 2.683 . 4 1 1 10 ASP HB3 . . . . . . 215 . 25684 4 >> 2 1 . 1 . . 4.627 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 4 >> 2 2 . 1 . . 53.944 . 4 1 1 10 ASP CA . . . . . . 74 . 25684 4 >> 2 3 . 1 . . 2.763 . 4 1 1 10 ASP HB2 . . . . . . 214 . 25684 4 >> 3 1 . 1 . . 4.274 . 4 1 1 24 THR HB . . . . . . 296 . 25684 4 >> 3 2 . 1 . . 69.189 . 4 1 1 24 THR CB . . . . . . 116 . 25684 4 >> 3 3 . 1 . . 1.240 . 4 1 1 24 THR MG . . . . . . 239 . 25684 4 >> 4 1 . 1 . . 4.274 . 4 1 1 24 THR HB . . . . . . 296 . 25684 4 >> 4 2 . 1 . . 69.189 . 4 1 1 24 THR CB . . . . . . 116 . 25684 4 >> 4 3 . 1 . . 4.274 . 4 1 1 24 THR HB . . . . . . 296 . 25684 4 >> 5 1 . 3 . . 4.345 . 4 1 1 28 THR HB . . . . . . 353 . 25684 4 >> 5 2 . 4 . . 69.306 . 4 1 1 28 THR CB . . . . . . 125 . 25684 4 >> 5 3 . 3 . . 1.257 . 4 1 1 28 THR MG . . . . . . 250 . 25684 4 >> 6 1 . 1 . . 4.211 . 4 1 1 19 THR HB . . . . . . 234 . 25684 4 >> 6 2 . 1 . . 69.219 . 4 1 1 19 THR CB . . . . . . 352 . 25684 4 >> 6 3 . 1 . . 1.229 . 4 1 1 19 THR MG . . . . . . 232 . 25684 4 >> 7 1 . 1 . . 4.212 . 4 1 1 19 THR HB . . . . . . 234 . 25684 4 >> 7 2 . 1 . . 69.219 . 4 1 1 19 THR CB . . . . . . 352 . 25684 4 >> 7 3 . 1 . . 4.211 . 4 1 1 19 THR HB . . . . . . 234 . 25684 4 >> 8 1 . 1 . . 4.321 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 8 2 . 1 . . 63.155 . 4 1 1 27 PRO CA . . . . . . 127 . 25684 4 >> 8 3 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 9 1 . 1 . . 4.320 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 9 2 . 1 . . 63.155 . 4 1 1 27 PRO CA . . . . . . 127 . 25684 4 >> 9 3 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 10 1 . 1 . . 4.322 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 10 2 . 1 . . 63.155 . 4 1 1 27 PRO CA . . . . . . 127 . 25684 4 >> 10 3 . 1 . . 4.321 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 11 1 . 1 . . 4.320 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 11 2 . 1 . . 63.155 . 4 1 1 27 PRO CA . . . . . . 127 . 25684 4 >> 11 3 . 1 . . 2.315 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 12 1 . 1 . . 4.320 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 12 2 . 1 . . 63.155 . 4 1 1 27 PRO CA . . . . . . 127 . 25684 4 >> 12 3 . 1 . . 1.992 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 13 1 . 1 . . 4.320 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 13 2 . 1 . . 63.148 . 4 1 1 27 PRO CA . . . . . . 127 . 25684 4 >> 13 3 . 1 . . 1.275 . 4 1 1 28 THR MG . . . . . . 250 . 25684 4 >> 14 1 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 14 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 14 3 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 15 1 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 15 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 15 3 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 16 1 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 16 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 16 3 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 17 1 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 17 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 17 3 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 18 1 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 18 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 19 1 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 19 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 19 3 . 1 . . 2.309 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 20 1 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 20 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 20 3 . 1 . . 2.312 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 21 1 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 21 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 22 1 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 22 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 22 3 . 1 . . 1.999 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 23 1 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 23 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 23 3 . 1 . . 1.999 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 24 1 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 24 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 25 1 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 25 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 26 1 . 1 . . 3.443 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 26 2 . 1 . . 50.373 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 26 3 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 27 1 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 27 2 . 1 . . 50.372 . 4 1 1 27 PRO CD . . . . . . 358 . 25684 4 >> 27 3 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 28 1 . 1 . . 4.703 . 4 1 1 25 TRP HA . . . . . . 241 . 25684 4 >> 28 2 . 1 . . 57.041 . 4 1 1 25 TRP CA . . . . . . 117 . 25684 4 >> 28 3 . 1 . . 3.297 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 4 >> 29 1 . 1 . . 4.703 . 4 1 1 25 TRP HA . . . . . . 241 . 25684 4 >> 29 2 . 1 . . 57.041 . 4 1 1 25 TRP CA . . . . . . 117 . 25684 4 >> 29 3 . 1 . . 7.573 . 4 1 1 25 TRP HE3 . . . . . . 336 . 25684 4 >> 30 1 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 30 2 . 1 . . 57.300 . 4 1 1 21 TRP CA . . . . . . 70 . 25684 4 >> 30 3 . 1 . . 3.266 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 31 1 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 31 2 . 1 . . 57.311 . 4 1 1 21 TRP CA . . . . . . 70 . 25684 4 >> 31 3 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 32 1 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 32 2 . 1 . . 57.311 . 4 1 1 21 TRP CA . . . . . . 70 . 25684 4 >> 32 3 . 1 . . 7.209 . 4 1 1 21 TRP HD1 . . . . . . 363 . 25684 4 >> 33 1 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 33 2 . 1 . . 57.311 . 4 1 1 21 TRP CA . . . . . . 70 . 25684 4 >> 33 3 . 6 . . 7.545 . 4 1 1 21 TRP HE3 . . . . . . 389 . 25684 4 >> 34 1 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 34 2 . 1 . . 57.311 . 4 1 1 21 TRP CA . . . . . . 70 . 25684 4 >> 34 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 35 1 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 35 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 35 3 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 36 1 . 1 . . 4.510 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 36 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 36 3 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 37 1 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 37 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 37 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 38 1 . 1 . . 4.424 . 4 1 1 2 ALA HA . . . . . . 193 . 25684 4 >> 38 2 . 1 . . 52.208 . 4 1 1 2 ALA CA . . . . . . 73 . 25684 4 >> 38 3 . 1 . . 1.439 . 4 1 1 2 ALA MB . . . . . . 194 . 25684 4 >> 39 1 . 1 . . 4.423 . 4 1 1 2 ALA HA . . . . . . 193 . 25684 4 >> 39 2 . 1 . . 52.208 . 4 1 1 2 ALA CA . . . . . . 73 . 25684 4 >> 39 3 . 1 . . 4.422 . 4 1 1 2 ALA HA . . . . . . 193 . 25684 4 >> 40 1 . 1 . . 4.527 . 4 1 1 3 MET HA . . . . . . 195 . 25684 4 >> 40 2 . 1 . . 55.311 . 4 1 1 3 MET CA . . . . . . 72 . 25684 4 >> 40 3 . 1 . . 4.526 . 4 1 1 3 MET HA . . . . . . 195 . 25684 4 >> 41 1 . 1 . . 2.681 . 4 1 1 3 MET HB2 . . . . . . 198 . 25684 4 >> 41 2 . 1 . . 31.735 . 4 1 1 3 MET CB . . . . . . 56 . 25684 4 >> 41 3 . 1 . . 2.680 . 4 1 1 3 MET HB2 . . . . . . 198 . 25684 4 >> 42 1 . 2 . . 2.615 . 4 1 1 3 MET HB3 . . . . . . 361 . 25684 4 >> 42 2 . 1 . . 31.749 . 4 1 1 3 MET CB . . . . . . 56 . 25684 4 >> 42 3 . 1 . . 2.614 . 4 1 1 3 MET HB2 . . . . . . 198 . 25684 4 >> 43 1 . 1 . . 4.577 . 4 1 1 5 SER HA . . . . . . 200 . 25684 4 >> 43 2 . 1 . . 57.743 . 4 1 1 5 SER CA . . . . . . 76 . 25684 4 >> 43 3 . 1 . . 3.923 . 4 1 1 5 SER HB2 . . . . . . 201 . 25684 4 >> 44 1 . 1 . . 4.577 . 4 1 1 5 SER HA . . . . . . 200 . 25684 4 >> 44 2 . 1 . . 57.743 . 4 1 1 5 SER CA . . . . . . 76 . 25684 4 >> 44 3 . 2 . . 4.577 . 4 1 1 5 SER HA . . . . . . 200 . 25684 4 >> 45 1 . 1 . . 3.923 . 4 1 1 5 SER HB2 . . . . . . 201 . 25684 4 >> 45 2 . 1 . . 63.556 . 4 1 1 5 SER CB . . . . . . 106 . 25684 4 >> 45 3 . 1 . . 3.923 . 4 1 1 5 SER HB2 . . . . . . 201 . 25684 4 >> 46 1 . 1 . . 3.923 . 4 1 1 5 SER HB2 . . . . . . 201 . 25684 4 >> 46 2 . 1 . . 63.556 . 4 1 1 5 SER CB . . . . . . 106 . 25684 4 >> 46 3 . 1 . . 4.577 . 4 1 1 5 SER HA . . . . . . 200 . 25684 4 >> 47 1 . 1 . . 4.239 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 4 >> 47 2 . 1 . . 61.968 . 4 1 1 6 VAL CA . . . . . . 75 . 25684 4 >> 47 3 . 1 . . 2.178 . 4 1 1 6 VAL HB . . . . . . 203 . 25684 4 >> 48 1 . 1 . . 4.239 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 4 >> 48 2 . 1 . . 61.968 . 4 1 1 6 VAL CA . . . . . . 75 . 25684 4 >> 48 3 . 1 . . 0.989 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 4 >> 49 1 . 1 . . 4.239 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 4 >> 49 2 . 1 . . 61.968 . 4 1 1 6 VAL CA . . . . . . 75 . 25684 4 >> 49 3 . 1 . . 4.239 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 4 >> 50 1 . 1 . . 2.178 . 4 1 1 6 VAL HB . . . . . . 203 . 25684 4 >> 50 2 . 1 . . 32.414 . 4 1 1 6 VAL CB . . . . . . 59 . 25684 4 >> 50 3 . 1 . . 4.239 . 4 1 1 6 VAL HA . . . . . . 202 . 25684 4 >> 51 1 . 1 . . 2.179 . 4 1 1 6 VAL HB . . . . . . 203 . 25684 4 >> 51 2 . 1 . . 32.414 . 4 1 1 6 VAL CB . . . . . . 59 . 25684 4 >> 51 3 . 1 . . 2.178 . 4 1 1 6 VAL HB . . . . . . 203 . 25684 4 >> 52 1 . 1 . . 2.178 . 4 1 1 6 VAL HB . . . . . . 203 . 25684 4 >> 52 2 . 1 . . 32.414 . 4 1 1 6 VAL CB . . . . . . 59 . 25684 4 >> 52 3 . 1 . . 0.997 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 4 >> 53 1 . 1 . . 0.990 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 4 >> 53 2 . 1 . . 19.967 . 4 1 1 6 VAL CG2 . . . . . . 161 . 25684 4 >> 53 3 . 1 . . 0.990 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 4 >> 54 1 . 1 . . 1.000 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 4 >> 54 2 . 1 . . 20.870 . 4 1 1 6 VAL CG1 . . . . . . 162 . 25684 4 >> 54 3 . 1 . . 0.996 . 4 1 1 6 VAL MG1 . . . . . . 204 . 25684 4 >> 55 1 . 1 . . 4.704 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 4 >> 55 2 . 1 . . 53.989 . 4 1 1 7 ASP CA . . . . . . 87 . 25684 4 >> 55 3 . 1 . . 4.704 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 4 >> 56 1 . 1 . . 4.704 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 4 >> 56 2 . 1 . . 53.989 . 4 1 1 7 ASP CA . . . . . . 87 . 25684 4 >> 56 3 . 1 . . 2.786 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 4 >> 57 1 . 1 . . 4.704 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 4 >> 57 2 . 1 . . 53.989 . 4 1 1 7 ASP CA . . . . . . 87 . 25684 4 >> 57 3 . 1 . . 2.678 . 4 1 1 7 ASP HB3 . . . . . . 206 . 25684 4 >> 58 1 . 1 . . 2.678 . 4 1 1 7 ASP HB3 . . . . . . 206 . 25684 4 >> 58 2 . 1 . . 41.056 . 4 1 1 7 ASP CB . . . . . . 163 . 25684 4 >> 58 3 . 1 . . 2.678 . 4 1 1 7 ASP HB3 . . . . . . 206 . 25684 4 >> 59 1 . 1 . . 2.678 . 4 1 1 7 ASP HB3 . . . . . . 206 . 25684 4 >> 59 2 . 1 . . 41.056 . 4 1 1 7 ASP CB . . . . . . 163 . 25684 4 >> 59 3 . 1 . . 4.704 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 4 >> 60 1 . 2 . . 2.679 . 4 1 1 10 ASP HB3 . . . . . . 215 . 25684 4 >> 60 2 . 2 . . 41.019 . 4 1 1 10 ASP CB . . . . . . 57 . 25684 4 >> 60 3 . 1 . . 4.627 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 4 >> 61 1 . 1 . . 2.786 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 4 >> 61 2 . 1 . . 41.061 . 4 1 1 7 ASP CB . . . . . . 163 . 25684 4 >> 61 3 . 1 . . 4.704 . 4 1 1 7 ASP HA . . . . . . 207 . 25684 4 >> 62 1 . 2 . . 2.772 . 4 1 1 10 ASP HB2 . . . . . . 214 . 25684 4 >> 62 2 . 2 . . 41.020 . 4 1 1 10 ASP CB . . . . . . 57 . 25684 4 >> 62 3 . 1 . . 4.627 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 4 >> 63 1 . 1 . . 2.787 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 4 >> 63 2 . 1 . . 41.061 . 4 1 1 7 ASP CB . . . . . . 163 . 25684 4 >> 63 3 . 1 . . 2.786 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 4 >> 64 1 . 1 . . 4.457 . 4 1 1 8 SER HA . . . . . . 208 . 25684 4 >> 64 2 . 1 . . 58.121 . 4 1 1 8 SER CA . . . . . . 94 . 25684 4 >> 64 3 . 1 . . 4.457 . 4 1 1 8 SER HA . . . . . . 208 . 25684 4 >> 65 1 . 1 . . 4.457 . 4 1 1 8 SER HA . . . . . . 208 . 25684 4 >> 65 2 . 1 . . 58.121 . 4 1 1 8 SER CA . . . . . . 94 . 25684 4 >> 65 3 . 1 . . 3.874 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 4 >> 66 1 . 1 . . 3.874 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 4 >> 66 2 . 1 . . 63.338 . 4 1 1 8 SER CB . . . . . . 93 . 25684 4 >> 66 3 . 1 . . 4.457 . 4 1 1 8 SER HA . . . . . . 208 . 25684 4 >> 67 1 . 1 . . 3.873 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 4 >> 67 2 . 1 . . 63.338 . 4 1 1 8 SER CB . . . . . . 93 . 25684 4 >> 67 3 . 1 . . 3.874 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 4 >> 68 1 . 1 . . 3.972 . 4 1 1 8 SER HB2 . . . . . . 209 . 25684 4 >> 68 2 . 1 . . 63.366 . 4 1 1 8 SER CB . . . . . . 93 . 25684 4 >> 68 3 . 1 . . 4.460 . 4 1 1 8 SER HA . . . . . . 208 . 25684 4 >> 69 1 . 1 . . 3.973 . 4 1 1 8 SER HB2 . . . . . . 209 . 25684 4 >> 69 2 . 1 . . 63.366 . 4 1 1 8 SER CB . . . . . . 93 . 25684 4 >> 69 3 . 1 . . 3.972 . 4 1 1 8 SER HB2 . . . . . . 209 . 25684 4 >> 70 1 . 1 . . 3.973 . 4 1 1 8 SER HB2 . . . . . . 209 . 25684 4 >> 70 2 . 1 . . 63.366 . 4 1 1 8 SER CB . . . . . . 93 . 25684 4 >> 70 3 . 1 . . 3.874 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 4 >> 71 1 . 1 . . 3.873 . 4 1 1 8 SER HB3 . . . . . . 210 . 25684 4 >> 71 2 . 1 . . 63.366 . 4 1 1 8 SER CB . . . . . . 93 . 25684 4 >> 71 3 . 1 . . 3.972 . 4 1 1 8 SER HB2 . . . . . . 209 . 25684 4 >> 72 1 . 1 . . 4.355 . 4 1 1 9 ALA HA . . . . . . 211 . 25684 4 >> 72 2 . 1 . . 52.639 . 4 1 1 9 ALA CA . . . . . . 77 . 25684 4 >> 72 3 . 1 . . 1.453 . 4 1 1 9 ALA MB . . . . . . 212 . 25684 4 >> 73 1 . 1 . . 4.355 . 4 1 1 9 ALA HA . . . . . . 211 . 25684 4 >> 73 2 . 1 . . 52.639 . 4 1 1 9 ALA CA . . . . . . 77 . 25684 4 >> 73 3 . 1 . . 4.355 . 4 1 1 9 ALA HA . . . . . . 211 . 25684 4 >> 74 1 . 1 . . 1.453 . 4 1 1 9 ALA MB . . . . . . 212 . 25684 4 >> 74 2 . 1 . . 18.975 . 4 1 1 9 ALA CB . . . . . . 60 . 25684 4 >> 74 3 . 1 . . 1.453 . 4 1 1 9 ALA MB . . . . . . 212 . 25684 4 >> 75 1 . 1 . . 4.627 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 4 >> 75 2 . 1 . . 53.943 . 4 1 1 10 ASP CA . . . . . . 74 . 25684 4 >> 75 3 . 1 . . 4.626 . 4 1 1 10 ASP HA . . . . . . 213 . 25684 4 >> 76 1 . 1 . . 4.374 . 4 1 1 11 ALA HA . . . . . . 217 . 25684 4 >> 76 2 . 1 . . 52.535 . 4 1 1 11 ALA CA . . . . . . 88 . 25684 4 >> 76 3 . 1 . . 4.373 . 4 1 1 11 ALA HA . . . . . . 217 . 25684 4 >> 77 1 . 1 . . 4.374 . 4 1 1 11 ALA HA . . . . . . 217 . 25684 4 >> 77 2 . 1 . . 52.535 . 4 1 1 11 ALA CA . . . . . . 88 . 25684 4 >> 77 3 . 1 . . 1.465 . 4 1 1 11 ALA MB . . . . . . 216 . 25684 4 >> 78 1 . 1 . . 3.900 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 4 >> 78 2 . 1 . . 63.480 . 4 1 1 15 SER CB . . . . . . 67 . 25684 4 >> 78 3 . 1 . . 4.464 . 4 1 1 15 SER HA . . . . . . 224 . 25684 4 >> 79 1 . 1 . . 3.900 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 4 >> 79 2 . 1 . . 63.480 . 4 1 1 15 SER CB . . . . . . 67 . 25684 4 >> 79 3 . 1 . . 3.900 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 4 >> 80 1 . 1 . . 4.464 . 4 1 1 15 SER HA . . . . . . 224 . 25684 4 >> 80 2 . 1 . . 58.159 . 4 1 1 15 SER CA . . . . . . 86 . 25684 4 >> 80 3 . 1 . . 3.898 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 4 >> 81 1 . 1 . . 4.464 . 4 1 1 15 SER HA . . . . . . 224 . 25684 4 >> 81 2 . 1 . . 58.159 . 4 1 1 15 SER CA . . . . . . 86 . 25684 4 >> 81 3 . 1 . . 4.464 . 4 1 1 15 SER HA . . . . . . 224 . 25684 4 >> 82 1 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 82 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 82 3 . 1 . . 1.428 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 83 1 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 83 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 83 3 . 2 . . 1.383 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 4 >> 84 1 . 1 . . 1.428 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 84 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 84 3 . 1 . . 1.428 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 85 1 . 1 . . 1.384 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 4 >> 85 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 85 3 . 1 . . 1.384 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 4 >> 86 1 . 1 . . 1.384 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 4 >> 86 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 86 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 87 1 . 1 . . 1.429 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 87 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 87 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 88 1 . 1 . . 1.390 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 4 >> 88 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 88 3 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 89 1 . 1 . . 1.423 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 89 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 89 3 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 90 1 . 1 . . 1.390 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 4 >> 90 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 90 3 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 91 1 . 1 . . 1.425 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 91 2 . 1 . . 42.426 . 4 1 1 22 LEU CB . . . . . . 55 . 25684 4 >> 91 3 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 92 1 . 1 . . 0.793 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 92 2 . 1 . . 23.197 . 4 1 1 18 LEU CD2 . . . . . . 364 . 25684 4 >> 92 3 . 1 . . 1.514 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 4 >> 93 1 . 1 . . 0.793 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 93 2 . 1 . . 23.197 . 4 1 1 18 LEU CD2 . . . . . . 364 . 25684 4 >> 93 3 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 94 1 . 1 . . 0.792 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 94 2 . 1 . . 23.197 . 4 1 1 18 LEU CD2 . . . . . . 364 . 25684 4 >> 94 3 . 1 . . 1.384 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 95 1 . 1 . . 0.790 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 95 2 . 1 . . 23.197 . 4 1 1 18 LEU CD2 . . . . . . 364 . 25684 4 >> 95 3 . 1 . . 0.792 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 96 1 . 1 . . 0.792 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 96 2 . 1 . . 23.197 . 4 1 1 18 LEU CD2 . . . . . . 364 . 25684 4 >> 96 3 . 1 . . 4.321 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 97 1 . 1 . . 4.318 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 97 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 97 3 . 2 . . 4.322 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 98 1 . 1 . . 4.320 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 98 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 98 3 . 1 . . 3.304 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 4 >> 99 1 . 1 . . 4.321 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 99 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 99 3 . 1 . . 3.241 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 4 >> 100 1 . 1 . . 4.320 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 100 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 100 3 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 101 1 . 1 . . 4.320 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 101 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 101 3 . 1 . . 1.516 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 4 >> 102 1 . 1 . . 4.320 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 102 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 102 3 . 1 . . 1.387 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 103 1 . 1 . . 4.319 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 103 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 103 3 . 1 . . 0.875 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 104 1 . 1 . . 4.319 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 104 2 . 1 . . 55.083 . 4 1 1 18 LEU CA . . . . . . 368 . 25684 4 >> 104 3 . 1 . . 0.795 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 105 1 . 1 . . 1.388 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 105 2 . 1 . . 26.481 . 4 1 1 18 LEU CG . . . . . . 166 . 25684 4 >> 105 3 . 1 . . 1.388 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 106 1 . 1 . . 1.388 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 106 2 . 1 . . 26.481 . 4 1 1 18 LEU CG . . . . . . 166 . 25684 4 >> 106 3 . 1 . . 0.876 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 107 1 . 1 . . 1.388 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 107 2 . 1 . . 26.481 . 4 1 1 18 LEU CG . . . . . . 166 . 25684 4 >> 107 3 . 1 . . 0.796 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 108 1 . 1 . . 1.389 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 108 2 . 1 . . 26.481 . 4 1 1 18 LEU CG . . . . . . 166 . 25684 4 >> 108 3 . 1 . . 4.322 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 109 1 . 1 . . 3.224 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 109 2 . 1 . . 29.550 . 4 1 1 21 TRP CB . . . . . . 346 . 25684 4 >> 109 3 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 110 1 . 1 . . 3.265 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 110 2 . 1 . . 29.550 . 4 1 1 21 TRP CB . . . . . . 346 . 25684 4 >> 110 3 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 111 1 . 1 . . 3.224 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 111 2 . 1 . . 29.550 . 4 1 1 21 TRP CB . . . . . . 346 . 25684 4 >> 111 3 . 1 . . 3.224 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 112 1 . 1 . . 3.266 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 112 2 . 1 . . 29.550 . 4 1 1 21 TRP CB . . . . . . 346 . 25684 4 >> 112 3 . 1 . . 3.265 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 113 1 . 1 . . 3.265 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 113 2 . 1 . . 29.550 . 4 1 1 21 TRP CB . . . . . . 346 . 25684 4 >> 113 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 114 1 . 1 . . 0.876 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 114 2 . 1 . . 24.614 . 4 1 1 18 LEU CD1 . . . . . . 366 . 25684 4 >> 114 3 . 1 . . 1.387 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 115 1 . 1 . . 0.876 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 115 2 . 1 . . 24.614 . 4 1 1 18 LEU CD1 . . . . . . 366 . 25684 4 >> 115 3 . 1 . . 1.503 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 4 >> 116 1 . 1 . . 0.876 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 116 2 . 1 . . 24.614 . 4 1 1 18 LEU CD1 . . . . . . 366 . 25684 4 >> 116 3 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 117 1 . 1 . . 0.875 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 117 2 . 1 . . 24.614 . 4 1 1 18 LEU CD1 . . . . . . 366 . 25684 4 >> 117 3 . 1 . . 0.877 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 118 1 . 1 . . 0.876 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 118 2 . 1 . . 24.614 . 4 1 1 18 LEU CD1 . . . . . . 366 . 25684 4 >> 118 3 . 1 . . 4.316 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 119 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 119 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 119 3 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 120 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 120 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 120 3 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 121 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 121 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 121 3 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 122 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 122 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 122 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 123 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 123 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 123 3 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 124 1 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 124 2 . 1 . . 62.850 . 4 1 1 23 PRO CA . . . . . . 112 . 25684 4 >> 124 3 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 125 1 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 125 2 . 1 . . 62.850 . 4 1 1 23 PRO CA . . . . . . 112 . 25684 4 >> 125 3 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 126 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 126 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 126 3 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 127 1 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 127 2 . 1 . . 62.850 . 4 1 1 23 PRO CA . . . . . . 112 . 25684 4 >> 127 3 . 2 . . 1.717 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 128 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 128 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 128 3 . 2 . . 1.717 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 129 1 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 129 2 . 1 . . 62.850 . 4 1 1 23 PRO CA . . . . . . 112 . 25684 4 >> 129 3 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 130 1 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 130 2 . 1 . . 62.850 . 4 1 1 23 PRO CA . . . . . . 112 . 25684 4 >> 130 3 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 131 1 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 131 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 131 3 . 1 . . 1.719 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 132 1 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 132 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 132 3 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 133 1 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 133 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 133 3 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 134 1 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 134 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 134 3 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 135 1 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 135 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 135 3 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 136 1 . 1 . . 1.715 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 136 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 136 3 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 137 1 . 1 . . 1.715 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 137 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 137 3 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 138 1 . 1 . . 1.714 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 138 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 138 3 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 139 1 . 1 . . 1.714 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 139 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 139 3 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 140 1 . 1 . . 1.714 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 140 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 140 3 . 1 . . 1.714 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 141 1 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 141 2 . 1 . . 62.850 . 4 1 1 23 PRO CA . . . . . . 112 . 25684 4 >> 141 3 . 1 . . 1.240 . 4 1 1 24 THR MG . . . . . . 239 . 25684 4 >> 142 1 . 1 . . 3.545 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 142 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 142 3 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 143 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 143 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 143 3 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 144 1 . 1 . . 3.545 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 144 2 . 1 . . 49.990 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 144 3 . 1 . . 4.244 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 145 1 . 1 . . 3.545 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 145 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 145 3 . 1 . . 3.545 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 146 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 146 2 . 1 . . 49.990 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 146 3 . 1 . . 4.242 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 147 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 147 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 147 3 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 148 1 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 148 2 . 1 . . 31.533 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 148 3 . 1 . . 3.545 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 149 1 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 149 2 . 1 . . 26.906 . 4 1 1 23 PRO CG . . . . . . 295 . 25684 4 >> 149 3 . 1 . . 3.545 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 150 1 . 1 . . 4.235 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 4 >> 150 2 . 1 . . 62.850 . 4 1 1 23 PRO CA . . . . . . 112 . 25684 4 >> 150 3 . 1 . . 3.545 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 151 1 . 1 . . 3.544 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 151 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 151 3 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 152 1 . 1 . . 3.544 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 152 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 152 3 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 153 1 . 1 . . 3.544 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 153 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 153 3 . 1 . . 1.722 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 154 1 . 1 . . 3.546 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 154 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 154 3 . 1 . . 1.423 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 155 1 . 1 . . 3.546 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 155 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 155 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 156 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 156 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 156 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 157 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 157 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 157 3 . 1 . . 1.421 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 4 >> 158 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 158 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 158 3 . 1 . . 1.724 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 159 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 159 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 159 3 . 1 . . 1.933 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 4 >> 160 1 . 1 . . 3.514 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 160 2 . 1 . . 49.991 . 4 1 1 23 PRO CD . . . . . . 374 . 25684 4 >> 160 3 . 1 . . 2.155 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 4 >> 161 1 . 1 . . 4.281 . 4 1 1 24 THR HA . . . . . . 240 . 25684 4 >> 161 2 . 1 . . 61.974 . 4 1 1 24 THR CA . . . . . . 167 . 25684 4 >> 161 3 . 1 . . 1.240 . 4 1 1 24 THR MG . . . . . . 239 . 25684 4 >> 162 1 . 1 . . 4.282 . 4 1 1 24 THR HA . . . . . . 240 . 25684 4 >> 162 2 . 1 . . 61.974 . 4 1 1 24 THR CA . . . . . . 167 . 25684 4 >> 162 3 . 1 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 163 1 . 1 . . 4.280 . 4 1 1 24 THR HA . . . . . . 240 . 25684 4 >> 163 2 . 1 . . 61.974 . 4 1 1 24 THR CA . . . . . . 167 . 25684 4 >> 163 3 . 1 . . 4.279 . 4 1 1 24 THR HA . . . . . . 240 . 25684 4 >> 164 1 . 1 . . 4.703 . 4 1 1 25 TRP HA . . . . . . 241 . 25684 4 >> 164 2 . 1 . . 57.041 . 4 1 1 25 TRP CA . . . . . . 117 . 25684 4 >> 164 3 . 1 . . 4.703 . 4 1 1 25 TRP HA . . . . . . 241 . 25684 4 >> 165 1 . 1 . . 2.312 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 165 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 165 3 . 1 . . 4.321 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 166 1 . 1 . . 1.994 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 166 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 166 3 . 1 . . 4.321 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 167 1 . 1 . . 2.311 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 167 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 167 3 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 168 1 . 1 . . 2.311 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 168 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 168 3 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 169 1 . 1 . . 2.312 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 169 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 169 3 . 1 . . 2.313 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 170 1 . 1 . . 2.311 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 170 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 170 3 . 1 . . 1.998 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 171 1 . 1 . . 1.991 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 171 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 171 3 . 1 . . 1.991 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 172 1 . 1 . . 1.991 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 172 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 172 3 . 1 . . 2.313 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 173 1 . 1 . . 1.992 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 173 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 173 3 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 174 1 . 1 . . 1.992 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 174 2 . 1 . . 31.879 . 4 1 1 27 PRO CB . . . . . . 126 . 25684 4 >> 174 3 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 175 1 . 2 . . 2.722 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 175 2 . 2 . . 27.389 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 175 3 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 176 1 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 176 2 . 1 . . 55.616 . 4 1 1 26 CYS CA . . . . . . 377 . 25684 4 >> 176 3 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 177 1 . 2 . . 2.808 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 177 2 . 2 . . 27.389 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 177 3 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 178 1 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 178 2 . 1 . . 55.616 . 4 1 1 26 CYS CA . . . . . . 377 . 25684 4 >> 178 3 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 179 1 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 179 2 . 1 . . 55.616 . 4 1 1 26 CYS CA . . . . . . 377 . 25684 4 >> 179 3 . 1 . . 3.440 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 180 1 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 180 2 . 1 . . 55.616 . 4 1 1 26 CYS CA . . . . . . 377 . 25684 4 >> 180 3 . 2 . . 2.808 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 181 1 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 181 2 . 1 . . 55.616 . 4 1 1 26 CYS CA . . . . . . 377 . 25684 4 >> 181 3 . 2 . . 2.722 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 182 1 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 182 2 . 1 . . 55.616 . 4 1 1 26 CYS CA . . . . . . 377 . 25684 4 >> 182 3 . 1 . . 1.993 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 4 >> 183 1 . 2 . . 2.722 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 183 2 . 2 . . 27.389 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 183 3 . 1 . . 3.689 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 184 1 . 1 . . 4.664 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 4 >> 184 2 . 1 . . 55.616 . 4 1 1 26 CYS CA . . . . . . 377 . 25684 4 >> 184 3 . 1 . . 4.324 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 185 1 . 2 . . 2.808 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 185 2 . 2 . . 27.389 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 185 3 . 1 . . 3.691 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 186 1 . 1 . . 4.343 . 4 1 1 28 THR HB . . . . . . 353 . 25684 4 >> 186 2 . 1 . . 69.340 . 4 1 1 28 THR CB . . . . . . 125 . 25684 4 >> 186 3 . 1 . . 4.342 . 4 1 1 28 THR HB . . . . . . 353 . 25684 4 >> 187 1 . 1 . . 4.448 . 4 1 1 28 THR HA . . . . . . 248 . 25684 4 >> 187 2 . 1 . . 61.583 . 4 1 1 28 THR CA . . . . . . 121 . 25684 4 >> 187 3 . 1 . . 1.257 . 4 1 1 28 THR MG . . . . . . 250 . 25684 4 >> 188 1 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 188 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 188 3 . 1 . . 1.519 . 4 1 1 22 LEU HG . . . . . . 370 . 25684 4 >> 189 1 . 1 . . 4.447 . 4 1 1 28 THR HA . . . . . . 248 . 25684 4 >> 189 2 . 1 . . 61.583 . 4 1 1 28 THR CA . . . . . . 121 . 25684 4 >> 189 3 . 1 . . 4.447 . 4 1 1 28 THR HA . . . . . . 248 . 25684 4 >> 190 1 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 190 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 190 3 . 1 . . 0.850 . 4 1 1 22 LEU MD2 . . . . . . 383 . 25684 4 >> 191 1 . 1 . . 4.584 . 4 1 1 29 SER HA . . . . . . 251 . 25684 4 >> 191 2 . 1 . . 58.031 . 4 1 1 29 SER CA . . . . . . 122 . 25684 4 >> 191 3 . 1 . . 3.943 . 4 1 1 29 SER HB2 . . . . . . 252 . 25684 4 >> 192 1 . 1 . . 4.584 . 4 1 1 29 SER HA . . . . . . 251 . 25684 4 >> 192 2 . 1 . . 58.031 . 4 1 1 29 SER CA . . . . . . 122 . 25684 4 >> 192 3 . 1 . . 4.584 . 4 1 1 29 SER HA . . . . . . 251 . 25684 4 >> 193 1 . 1 . . 4.348 . 4 1 1 30 THR HB . . . . . . 254 . 25684 4 >> 193 2 . 1 . . 69.128 . 4 1 1 30 THR CB . . . . . . 130 . 25684 4 >> 193 3 . 1 . . 1.257 . 4 1 1 30 THR MG . . . . . . 256 . 25684 4 >> 194 1 . 1 . . 4.347 . 4 1 1 30 THR HB . . . . . . 254 . 25684 4 >> 194 2 . 1 . . 69.128 . 4 1 1 30 THR CB . . . . . . 130 . 25684 4 >> 194 3 . 1 . . 4.346 . 4 1 1 30 THR HB . . . . . . 254 . 25684 4 >> 195 1 . 1 . . 1.255 . 4 1 1 30 THR MG . . . . . . 256 . 25684 4 >> 195 2 . 1 . . 21.121 . 4 1 1 30 THR CG2 . . . . . . 169 . 25684 4 >> 195 3 . 1 . . 1.255 . 4 1 1 30 THR MG . . . . . . 256 . 25684 4 >> 196 1 . 1 . . 4.732 . 4 1 1 32 HIS HA . . . . . . 257 . 25684 4 >> 196 2 . 1 . . 55.490 . 4 1 1 32 HIS CA . . . . . . 83 . 25684 4 >> 196 3 . 1 . . 3.171 . 4 1 1 32 HIS HB3 . . . . . . 259 . 25684 4 >> 197 1 . 1 . . 4.732 . 4 1 1 32 HIS HA . . . . . . 257 . 25684 4 >> 197 2 . 1 . . 55.490 . 4 1 1 32 HIS CA . . . . . . 83 . 25684 4 >> 197 3 . 1 . . 3.250 . 4 1 1 32 HIS HB2 . . . . . . 258 . 25684 4 >> 198 1 . 1 . . 4.733 . 4 1 1 32 HIS HA . . . . . . 257 . 25684 4 >> 198 2 . 1 . . 55.490 . 4 1 1 32 HIS CA . . . . . . 83 . 25684 4 >> 198 3 . 1 . . 4.732 . 4 1 1 32 HIS HA . . . . . . 257 . 25684 4 >> 199 1 . 1 . . 4.375 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 199 2 . 1 . . 54.804 . 4 1 1 33 LEU CA . . . . . . 82 . 25684 4 >> 199 3 . 2 . . 4.375 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 200 1 . 1 . . 4.375 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 200 2 . 1 . . 54.804 . 4 1 1 33 LEU CA . . . . . . 82 . 25684 4 >> 200 3 . 1 . . 1.617 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 4 >> 201 1 . 1 . . 4.374 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 201 2 . 1 . . 54.804 . 4 1 1 33 LEU CA . . . . . . 82 . 25684 4 >> 201 3 . 1 . . 0.905 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 4 >> 202 1 . 1 . . 4.374 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 202 2 . 1 . . 54.804 . 4 1 1 33 LEU CA . . . . . . 82 . 25684 4 >> 202 3 . 1 . . 0.958 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 203 1 . 1 . . 4.375 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 203 2 . 1 . . 54.804 . 4 1 1 33 LEU CA . . . . . . 82 . 25684 4 >> 203 3 . 1 . . 1.676 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 4 >> 204 1 . 1 . . 4.375 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 204 2 . 1 . . 54.804 . 4 1 1 33 LEU CA . . . . . . 82 . 25684 4 >> 204 3 . 1 . . 1.542 . 4 1 1 33 LEU HG . . . . . . 263 . 25684 4 >> 205 1 . 1 . . 1.617 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 4 >> 205 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 205 3 . 1 . . 0.957 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 206 1 . 1 . . 1.617 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 4 >> 206 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 206 3 . 1 . . 0.884 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 4 >> 207 1 . 1 . . 1.617 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 4 >> 207 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 207 3 . 1 . . 1.617 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 4 >> 208 1 . 1 . . 1.617 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 4 >> 208 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 208 3 . 1 . . 4.375 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 209 1 . 1 . . 1.676 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 4 >> 209 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 209 3 . 2 . . 4.375 . 4 1 1 33 LEU HA . . . . . . 260 . 25684 4 >> 210 1 . 1 . . 1.676 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 4 >> 210 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 210 3 . 1 . . 1.676 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 4 >> 211 1 . 1 . . 1.676 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 4 >> 211 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 211 3 . 1 . . 0.957 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 212 1 . 1 . . 1.676 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 4 >> 212 2 . 1 . . 42.013 . 4 1 1 33 LEU CB . . . . . . 64 . 25684 4 >> 212 3 . 1 . . 0.884 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 4 >> 213 1 . 1 . . 1.518 . 4 1 1 33 LEU HG . . . . . . 263 . 25684 4 >> 213 2 . 1 . . 26.595 . 4 1 1 33 LEU CG . . . . . . 173 . 25684 4 >> 213 3 . 1 . . 0.884 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 4 >> 214 1 . 1 . . 1.517 . 4 1 1 33 LEU HG . . . . . . 263 . 25684 4 >> 214 2 . 1 . . 26.595 . 4 1 1 33 LEU CG . . . . . . 173 . 25684 4 >> 214 3 . 1 . . 0.957 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 215 1 . 1 . . 1.518 . 4 1 1 33 LEU HG . . . . . . 263 . 25684 4 >> 215 2 . 1 . . 26.595 . 4 1 1 33 LEU CG . . . . . . 173 . 25684 4 >> 215 3 . 1 . . 1.518 . 4 1 1 33 LEU HG . . . . . . 263 . 25684 4 >> 216 1 . 1 . . 4.350 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 216 2 . 1 . . 56.073 . 4 1 1 34 LYS CA . . . . . . 84 . 25684 4 >> 216 3 . 1 . . 4.350 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 217 1 . 1 . . 4.349 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 217 2 . 1 . . 56.073 . 4 1 1 34 LYS CA . . . . . . 84 . 25684 4 >> 217 3 . 1 . . 2.140 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 4 >> 218 1 . 1 . . 4.349 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 218 2 . 1 . . 56.073 . 4 1 1 34 LYS CA . . . . . . 84 . 25684 4 >> 218 3 . 1 . . 2.012 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 4 >> 219 1 . 1 . . 4.350 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 219 2 . 1 . . 56.073 . 4 1 1 34 LYS CA . . . . . . 84 . 25684 4 >> 219 3 . 1 . . 1.897 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 4 >> 220 1 . 1 . . 4.350 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 220 2 . 1 . . 56.073 . 4 1 1 34 LYS CA . . . . . . 84 . 25684 4 >> 220 3 . 1 . . 1.816 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 4 >> 221 1 . 1 . . 4.350 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 221 2 . 1 . . 56.073 . 4 1 1 34 LYS CA . . . . . . 84 . 25684 4 >> 221 3 . 1 . . 1.493 . 4 1 1 34 LYS HG2 . . . . . . 268 . 25684 4 >> 222 1 . 1 . . 4.350 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 222 2 . 1 . . 56.073 . 4 1 1 34 LYS CA . . . . . . 84 . 25684 4 >> 222 3 . 1 . . 1.477 . 4 1 1 34 LYS HG3 . . . . . . 269 . 25684 4 >> 223 1 . 1 . . 4.303 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 4 >> 223 2 . 1 . . 56.436 . 4 1 1 35 GLU CA . . . . . . 89 . 25684 4 >> 223 3 . 1 . . 2.140 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 4 >> 224 1 . 1 . . 4.303 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 4 >> 224 2 . 1 . . 56.436 . 4 1 1 35 GLU CA . . . . . . 89 . 25684 4 >> 224 3 . 1 . . 2.013 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 4 >> 225 1 . 1 . . 2.140 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 4 >> 225 2 . 1 . . 29.862 . 4 1 1 35 GLU CB . . . . . . 343 . 25684 4 >> 225 3 . 1 . . 2.140 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 4 >> 226 1 . 1 . . 2.140 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 4 >> 226 2 . 1 . . 29.862 . 4 1 1 35 GLU CB . . . . . . 343 . 25684 4 >> 226 3 . 1 . . 4.303 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 4 >> 227 1 . 1 . . 2.015 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 4 >> 227 2 . 1 . . 29.862 . 4 1 1 35 GLU CB . . . . . . 343 . 25684 4 >> 227 3 . 1 . . 2.015 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 4 >> 228 1 . 1 . . 1.896 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 4 >> 228 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 228 3 . 1 . . 4.351 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 229 1 . 1 . . 1.813 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 4 >> 229 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 229 3 . 1 . . 4.351 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 4 >> 230 1 . 1 . . 1.895 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 4 >> 230 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 230 3 . 1 . . 1.895 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 4 >> 231 1 . 1 . . 1.895 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 4 >> 231 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 231 3 . 1 . . 1.811 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 4 >> 232 1 . 1 . . 1.895 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 4 >> 232 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 232 3 . 1 . . 1.494 . 4 1 1 34 LYS HG2 . . . . . . 268 . 25684 4 >> 233 1 . 1 . . 1.813 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 4 >> 233 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 233 3 . 1 . . 1.894 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 4 >> 234 1 . 1 . . 1.813 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 4 >> 234 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 234 3 . 1 . . 1.813 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 4 >> 235 1 . 1 . . 1.814 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 4 >> 235 2 . 1 . . 32.724 . 4 1 1 34 LYS CB . . . . . . 65 . 25684 4 >> 235 3 . 1 . . 1.494 . 4 1 1 34 LYS HG2 . . . . . . 268 . 25684 4 >> 236 1 . 1 . . 4.303 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 4 >> 236 2 . 1 . . 56.436 . 4 1 1 35 GLU CA . . . . . . 89 . 25684 4 >> 236 3 . 1 . . 4.303 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 4 >> 237 1 . 1 . . 2.358 . 4 1 1 35 GLU HG2 . . . . . . 277 . 25684 4 >> 237 2 . 1 . . 35.916 . 4 1 1 35 GLU CG . . . . . . 179 . 25684 4 >> 237 3 . 1 . . 4.303 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 4 >> 238 1 . 1 . . 2.358 . 4 1 1 35 GLU HG2 . . . . . . 277 . 25684 4 >> 238 2 . 1 . . 35.916 . 4 1 1 35 GLU CG . . . . . . 179 . 25684 4 >> 238 3 . 1 . . 2.358 . 4 1 1 35 GLU HG2 . . . . . . 277 . 25684 4 >> 239 1 . 1 . . 4.237 . 4 1 1 39 LYS HA . . . . . . 299 . 25684 4 >> 239 2 . 1 . . 57.186 . 4 1 1 39 LYS CA . . . . . . 85 . 25684 4 >> 239 3 . 1 . . 4.237 . 4 1 1 39 LYS HA . . . . . . 299 . 25684 4 >> 240 1 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 240 2 . 1 . . 57.311 . 4 1 1 21 TRP CA . . . . . . 70 . 25684 4 >> 240 3 . 1 . . 0.850 . 4 1 1 22 LEU MD2 . . . . . . 383 . 25684 4 >> 241 1 . 1 . . 4.355 . 4 1 1 36 ALA HA . . . . . . 278 . 25684 4 >> 241 2 . 1 . . 52.290 . 4 1 1 36 ALA CA . . . . . . 78 . 25684 4 >> 241 3 . 1 . . 1.465 . 4 1 1 36 ALA MB . . . . . . 279 . 25684 4 >> 242 1 . 1 . . 4.356 . 4 1 1 36 ALA HA . . . . . . 278 . 25684 4 >> 242 2 . 1 . . 52.290 . 4 1 1 36 ALA CA . . . . . . 78 . 25684 4 >> 242 3 . 1 . . 4.356 . 4 1 1 36 ALA HA . . . . . . 278 . 25684 4 >> 243 1 . 1 . . 4.303 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 4 >> 243 2 . 1 . . 56.436 . 4 1 1 35 GLU CA . . . . . . 89 . 25684 4 >> 243 3 . 1 . . 2.358 . 4 1 1 35 GLU HG2 . . . . . . 277 . 25684 4 >> 244 1 . 3 . . 0.884 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 244 2 . 1 . . 23.577 . 4 1 1 22 LEU CD1 . . . . . . 298 . 25684 4 >> 244 3 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 245 1 . 1 . . 4.511 . 4 1 1 22 LEU HA . . . . . . 360 . 25684 4 >> 245 2 . 1 . . 52.218 . 4 1 1 22 LEU CA . . . . . . 71 . 25684 4 >> 245 3 . 1 . . 3.529 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 4 >> 246 1 . 1 . . 0.966 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 246 2 . 1 . . 24.638 . 4 1 1 33 LEU CD1 . . . . . . 174 . 25684 4 >> 246 3 . 1 . . 1.671 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 4 >> 247 1 . 1 . . 0.965 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 247 2 . 1 . . 24.638 . 4 1 1 33 LEU CD1 . . . . . . 174 . 25684 4 >> 247 3 . 1 . . 1.530 . 4 1 1 33 LEU HG . . . . . . 263 . 25684 4 >> 248 1 . 1 . . 0.965 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 248 2 . 1 . . 24.638 . 4 1 1 33 LEU CD1 . . . . . . 174 . 25684 4 >> 248 3 . 1 . . 0.965 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 4 >> 249 1 . 1 . . 1.744 . 4 1 1 34 LYS HD3 . . . . . . 271 . 25684 4 >> 249 2 . 1 . . 28.715 . 4 1 1 34 LYS CD . . . . . . 177 . 25684 4 >> 249 3 . 1 . . 1.745 . 4 1 1 34 LYS HD3 . . . . . . 271 . 25684 4 >> 250 1 . 1 . . 1.744 . 4 1 1 34 LYS HD3 . . . . . . 271 . 25684 4 >> 250 2 . 1 . . 28.715 . 4 1 1 34 LYS CD . . . . . . 177 . 25684 4 >> 250 3 . 1 . . 3.049 . 4 1 1 34 LYS HE2 . . . . . . 267 . 25684 4 >> 251 1 . 1 . . 4.457 . 4 1 1 8 SER HA . . . . . . 208 . 25684 4 >> 251 2 . 1 . . 58.159 . 4 1 1 8 SER CA . . . . . . 94 . 25684 4 >> 251 3 . 1 . . 2.769 . 4 1 1 10 ASP HB2 . . . . . . 214 . 25684 4 >> 252 1 . 1 . . 4.457 . 4 1 1 8 SER HA . . . . . . 208 . 25684 4 >> 252 2 . 1 . . 58.159 . 4 1 1 8 SER CA . . . . . . 94 . 25684 4 >> 252 3 . 1 . . 2.787 . 4 1 1 7 ASP HB2 . . . . . . 205 . 25684 4 >> 253 1 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 253 2 . 1 . . 41.901 . 4 1 1 18 LEU CB . . . . . . 354 . 25684 4 >> 253 3 . 1 . . 4.322 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 4 >> 254 1 . 1 . . 4.567 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 4 >> 254 2 . 1 . . 57.300 . 4 1 1 21 TRP CA . . . . . . 70 . 25684 4 >> 254 3 . 2 . . 3.225 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 4 >> 255 1 . 1 . . 1.717 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 4 >> 255 2 . 1 . . 31.531 . 4 1 1 23 PRO CB . . . . . . 113 . 25684 4 >> 255 3 . 1 . . 3.546 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 4 >> 256 1 . 1 . . 0.904 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 4 >> 256 2 . 1 . . 23.205 . 4 1 1 33 LEU CD2 . . . . . . 175 . 25684 4 >> 256 3 . 1 . . 0.904 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 4 >> 257 1 . 1 . . 4.703 . 4 1 1 25 TRP HA . . . . . . 241 . 25684 4 >> 257 2 . 1 . . 57.036 . 4 1 1 25 TRP CA . . . . . . 117 . 25684 4 >> 257 3 . 1 . . 7.266 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 4 >> 258 1 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 258 2 . 1 . . 41.901 . 4 1 1 18 LEU CB . . . . . . 354 . 25684 4 >> 258 3 . 1 . . 1.390 . 4 1 1 18 LEU HG . . . . . . 367 . 25684 4 >> 259 1 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 259 2 . 1 . . 41.901 . 4 1 1 18 LEU CB . . . . . . 354 . 25684 4 >> 259 3 . 1 . . 0.876 . 4 1 1 18 LEU MD1 . . . . . . 365 . 25684 4 >> 260 1 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 260 2 . 1 . . 41.901 . 4 1 1 18 LEU CB . . . . . . 354 . 25684 4 >> 260 3 . 1 . . 0.794 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 4 >> 261 1 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 261 2 . 1 . . 41.901 . 4 1 1 18 LEU CB . . . . . . 354 . 25684 4 >> 261 3 . 1 . . 1.541 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 4 >> 262 1 . 1 . . 2.017 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 4 >> 262 2 . 1 . . 26.874 . 4 1 1 27 PRO CG . . . . . . 359 . 25684 4 >> 262 3 . 1 . . 2.308 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 4 >> 263 1 . 1 . . 2.017 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 4 >> 263 2 . 1 . . 26.874 . 4 1 1 27 PRO CG . . . . . . 359 . 25684 4 >> 263 3 . 1 . . 2.017 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 4 >> 264 1 . 1 . . 2.017 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 4 >> 264 2 . 1 . . 26.874 . 4 1 1 27 PRO CG . . . . . . 359 . 25684 4 >> 264 3 . 1 . . 3.444 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 265 1 . 1 . . 2.017 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 4 >> 265 2 . 1 . . 26.874 . 4 1 1 27 PRO CG . . . . . . 359 . 25684 4 >> 265 3 . 1 . . 3.688 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 4 >> 266 1 . 1 . . 2.017 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 4 >> 266 2 . 1 . . 26.874 . 4 1 1 27 PRO CG . . . . . . 359 . 25684 4 >> 266 3 . 1 . . 4.312 . 4 1 1 27 PRO HA . . . . . . 356 . 25684 4 >> 267 1 . 1 . . 2.805 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 267 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 267 3 . 1 . . 2.807 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 268 1 . 1 . . 2.805 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 268 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 268 3 . 1 . . 2.723 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 269 1 . 1 . . 2.718 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 269 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 269 3 . 1 . . 2.717 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 270 1 . 1 . . 2.718 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 270 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 270 3 . 1 . . 2.806 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 271 1 . 1 . . 2.717 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 271 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 271 3 . 1 . . 3.441 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 272 1 . 1 . . 2.806 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 272 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 272 3 . 1 . . 3.445 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 4 >> 273 1 . 1 . . 2.805 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 4 >> 273 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 273 3 . 1 . . 0.894 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> 274 1 . 1 . . 2.718 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 4 >> 274 2 . 1 . . 27.388 . 4 1 1 26 CYS CB . . . . . . 397 . 25684 4 >> 274 3 . 1 . . 0.895 . 4 1 1 22 LEU MD1 . . . . . . 293 . 25684 4 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3_4_5 _Saveframe_category spectral_peak_list _Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_2.peaks.' _Experiment_label '2D 1H-1H NOESY' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H stop_ _Sample_label $wr18_39 _Sample_conditions_label $2 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3_4_5 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 5 >> _Spectral_peak_list.Sample_ID 3 >> _Spectral_peak_list.Sample_label $wr18_39 >> _Spectral_peak_list.Sample_condition_list_ID 2 >> _Spectral_peak_list.Sample_condition_list_label $2 >> _Spectral_peak_list.Experiment_ID 11 >> _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_2.peaks.' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 11718.75 Hz . . . 25684 5 >> 2 H 1 1H . . 11718.75 Hz . . . 25684 5 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 'Original number 36' 25684 5 >> 10 1.0 'Original number 47' 25684 5 >> 100 1.0 'Original number 194' 25684 5 >> 101 1.0 'Original number 196' 25684 5 >> 102 1.0 'Original number 197' 25684 5 >> 103 1.0 'Original number 198' 25684 5 >> 104 1.0 'Original number 199' 25684 5 >> 105 1.0 'Original number 212' 25684 5 >> 106 1.0 'Original number 213' 25684 5 >> 107 1.0 'Original number 214' 25684 5 >> 108 1.0 'Original number 216' 25684 5 >> 109 1.0 'Original number 219' 25684 5 >> 11 1.0 'Original number 48' 25684 5 >> 110 1.0 'Original number 220' 25684 5 >> 111 1.0 'Original number 229' 25684 5 >> 112 1.0 'Original number 233' 25684 5 >> 113 1.0 'Original number 234' 25684 5 >> 114 1.0 'Original number 320' 25684 5 >> 115 1.0 'Original number 321' 25684 5 >> 116 1.0 'Original number 329' 25684 5 >> 117 1.0 'Original number 331' 25684 5 >> 118 1.0 'Original number 342' 25684 5 >> 119 1.0 'Original number 348' 25684 5 >> 12 1.0 'Original number 54' 25684 5 >> 120 1.0 'Original number 349' 25684 5 >> 121 1.0 'Original number 395' 25684 5 >> 122 1.0 'Original number 397' 25684 5 >> 123 1.0 'Original number 399' 25684 5 >> 124 1.0 'Original number 400' 25684 5 >> 125 1.0 'Original number 401' 25684 5 >> 126 1.0 'Original number 404' 25684 5 >> 127 1.0 'Original number 408' 25684 5 >> 128 1.0 'Original number 411' 25684 5 >> 129 1.0 'Original number 413' 25684 5 >> 13 1.0 'Original number 55' 25684 5 >> 130 1.0 'Original number 414' 25684 5 >> 131 1.0 'Original number 420' 25684 5 >> 132 1.0 'Original number 421' 25684 5 >> 133 1.0 'Original number 422' 25684 5 >> 134 1.0 'Original number 429' 25684 5 >> 135 1.0 'Original number 432' 25684 5 >> 136 1.0 'Original number 433' 25684 5 >> 137 1.0 'Original number 434' 25684 5 >> 138 1.0 'Original number 438' 25684 5 >> 139 1.0 'Original number 440' 25684 5 >> 14 1.0 'Original number 56' 25684 5 >> 140 1.0 'Original number 441' 25684 5 >> 141 1.0 'Original number 444' 25684 5 >> 15 1.0 'Original number 57' 25684 5 >> 16 1.0 'Original number 58' 25684 5 >> 17 1.0 'Original number 59' 25684 5 >> 18 1.0 'Original number 60' 25684 5 >> 19 1.0 'Original number 62' 25684 5 >> 2 1.0 'Original number 37' 25684 5 >> 20 1.0 'Original number 67' 25684 5 >> 21 1.0 'Original number 69' 25684 5 >> 22 1.0 'Original number 70' 25684 5 >> 23 1.0 'Original number 71' 25684 5 >> 24 1.0 'Original number 74' 25684 5 >> 25 1.0 'Original number 75' 25684 5 >> 26 1.0 'Original number 76' 25684 5 >> 27 1.0 'Original number 83' 25684 5 >> 28 1.0 'Original number 84' 25684 5 >> 29 1.0 'Original number 85' 25684 5 >> 3 1.0 'Original number 38' 25684 5 >> 30 1.0 'Original number 86' 25684 5 >> 31 1.0 'Original number 89' 25684 5 >> 32 1.0 'Original number 90' 25684 5 >> 33 1.0 'Original number 94' 25684 5 >> 34 1.0 'Original number 95' 25684 5 >> 35 1.0 'Original number 96' 25684 5 >> 36 1.0 'Original number 97' 25684 5 >> 37 1.0 'Original number 98' 25684 5 >> 38 1.0 'Original number 99' 25684 5 >> 39 1.0 'Original number 101' 25684 5 >> 4 1.0 'Original number 39' 25684 5 >> 40 1.0 'Original number 102' 25684 5 >> 41 1.0 'Original number 104' 25684 5 >> 42 1.0 'Original number 105' 25684 5 >> 43 1.0 'Original number 106' 25684 5 >> 44 1.0 'Original number 107' 25684 5 >> 45 1.0 'Original number 108' 25684 5 >> 46 1.0 'Original number 109' 25684 5 >> 47 1.0 'Original number 110' 25684 5 >> 48 1.0 'Original number 111' 25684 5 >> 49 1.0 'Original number 113' 25684 5 >> 5 1.0 'Original number 40' 25684 5 >> 50 1.0 'Original number 115' 25684 5 >> 51 1.0 'Original number 117' 25684 5 >> 52 1.0 'Original number 118' 25684 5 >> 53 1.0 'Original number 119' 25684 5 >> 54 1.0 'Original number 125' 25684 5 >> 55 1.0 'Original number 126' 25684 5 >> 56 1.0 'Original number 127' 25684 5 >> 57 1.0 'Original number 128' 25684 5 >> 58 1.0 'Original number 129' 25684 5 >> 59 1.0 'Original number 130' 25684 5 >> 6 1.0 'Original number 41' 25684 5 >> 60 1.0 'Original number 131' 25684 5 >> 61 1.0 'Original number 132' 25684 5 >> 62 1.0 'Original number 133' 25684 5 >> 63 1.0 'Original number 134' 25684 5 >> 64 1.0 'Original number 136' 25684 5 >> 65 1.0 'Original number 137' 25684 5 >> 66 1.0 'Original number 138' 25684 5 >> 67 1.0 'Original number 139' 25684 5 >> 68 1.0 'Original number 140' 25684 5 >> 69 1.0 'Original number 144' 25684 5 >> 7 1.0 'Original number 42' 25684 5 >> 70 1.0 'Original number 149' 25684 5 >> 71 1.0 'Original number 150' 25684 5 >> 72 1.0 'Original number 153' 25684 5 >> 73 1.0 'Original number 154' 25684 5 >> 74 1.0 'Original number 156' 25684 5 >> 75 1.0 'Original number 157' 25684 5 >> 76 1.0 'Original number 158' 25684 5 >> 77 1.0 'Original number 160' 25684 5 >> 78 1.0 'Original number 161' 25684 5 >> 79 1.0 'Original number 162' 25684 5 >> 8 1.0 'Original number 43' 25684 5 >> 80 1.0 'Original number 163' 25684 5 >> 81 1.0 'Original number 164' 25684 5 >> 82 1.0 'Original number 165' 25684 5 >> 83 1.0 'Original number 166' 25684 5 >> 84 1.0 'Original number 167' 25684 5 >> 85 1.0 'Original number 169' 25684 5 >> 86 1.0 'Original number 170' 25684 5 >> 87 1.0 'Original number 171' 25684 5 >> 88 1.0 'Original number 172' 25684 5 >> 89 1.0 'Original number 173' 25684 5 >> 9 1.0 'Original number 44' 25684 5 >> 90 1.0 'Original number 177' 25684 5 >> 91 1.0 'Original number 178' 25684 5 >> 92 1.0 'Original number 179' 25684 5 >> 93 1.0 'Original number 180' 25684 5 >> 94 1.0 'Original number 187' 25684 5 >> 95 1.0 'Original number 188' 25684 5 >> 96 1.0 'Original number 189' 25684 5 >> 97 1.0 'Original number 190' 25684 5 >> 98 1.0 'Original number 192' 25684 5 >> 99 1.0 'Original number 193' 25684 5 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 1948713.50000 . height 25684 5 >> 1 15244147.81250 . volume 25684 5 >> 2 3751496.50000 . height 25684 5 >> 2 30720945.25000 . volume 25684 5 >> 3 18883698.00000 . height 25684 5 >> 3 145218502.00000 . volume 25684 5 >> 4 19937840.00000 . height 25684 5 >> 4 147116837.00000 . volume 25684 5 >> 5 3551434.50000 . height 25684 5 >> 5 26413472.62500 . volume 25684 5 >> 6 3797707.00000 . height 25684 5 >> 6 29743260.50000 . volume 25684 5 >> 7 4059203.75000 . height 25684 5 >> 7 30757226.00000 . volume 25684 5 >> 8 18624810.00000 . height 25684 5 >> 8 142568028.00000 . volume 25684 5 >> 9 26900644.00000 . height 25684 5 >> 9 205710866.00000 . volume 25684 5 >> 10 2603431.75000 . height 25684 5 >> 10 19633419.37500 . volume 25684 5 >> 11 7229224.50000 . height 25684 5 >> 11 53617452.50000 . volume 25684 5 >> 12 8765399.00000 . height 25684 5 >> 12 75166038.50000 . volume 25684 5 >> 13 8357019.50000 . height 25684 5 >> 13 68499988.50000 . volume 25684 5 >> 14 3137747.50000 . height 25684 5 >> 14 25033101.25000 . volume 25684 5 >> 15 3662442.25000 . height 25684 5 >> 15 30608438.50000 . volume 25684 5 >> 16 9567185.00000 . height 25684 5 >> 16 76093235.50000 . volume 25684 5 >> 17 4542952.00000 . height 25684 5 >> 17 37495938.25000 . volume 25684 5 >> 18 6155213.00000 . height 25684 5 >> 18 52814153.00000 . volume 25684 5 >> 19 5013159.50000 . height 25684 5 >> 19 41056884.25000 . volume 25684 5 >> 20 5122233.00000 . height 25684 5 >> 20 43819326.50000 . volume 25684 5 >> 21 29954714.00000 . height 25684 5 >> 21 240159308.00000 . volume 25684 5 >> 22 9988547.00000 . height 25684 5 >> 22 76631102.00000 . volume 25684 5 >> 23 15689058.00000 . height 25684 5 >> 23 126427588.00000 . volume 25684 5 >> 24 2241563.00000 . height 25684 5 >> 24 18973787.25000 . volume 25684 5 >> 25 2194177.50000 . height 25684 5 >> 25 17871499.37500 . volume 25684 5 >> 26 19865888.00000 . height 25684 5 >> 26 158007989.00000 . volume 25684 5 >> 27 13228387.00000 . height 25684 5 >> 27 107971932.00000 . volume 25684 5 >> 28 13789647.00000 . height 25684 5 >> 28 111687073.00000 . volume 25684 5 >> 29 5488932.50000 . height 25684 5 >> 29 44698601.25000 . volume 25684 5 >> 30 3438327.00000 . height 25684 5 >> 30 29394591.00000 . volume 25684 5 >> 31 13031058.00000 . height 25684 5 >> 31 103997791.00000 . volume 25684 5 >> 32 15771856.00000 . height 25684 5 >> 32 126064457.00000 . volume 25684 5 >> 33 10612773.00000 . height 25684 5 >> 33 86276894.00000 . volume 25684 5 >> 34 1504797.25000 . height 25684 5 >> 34 13731392.87500 . volume 25684 5 >> 35 1928110.75000 . height 25684 5 >> 35 15102696.12500 . volume 25684 5 >> 36 3379143.00000 . height 25684 5 >> 36 26348889.50000 . volume 25684 5 >> 37 39224432.00000 . height 25684 5 >> 37 289697396.00000 . volume 25684 5 >> 38 87879080.00000 . height 25684 5 >> 38 662916152.00000 . volume 25684 5 >> 39 5227222.00000 . height 25684 5 >> 39 42327245.75000 . volume 25684 5 >> 40 6362891.00000 . height 25684 5 >> 40 50995340.00000 . volume 25684 5 >> 41 5574060.00000 . height 25684 5 >> 41 43522927.00000 . volume 25684 5 >> 42 4011795.25000 . height 25684 5 >> 42 31552951.50000 . volume 25684 5 >> 43 1458840.25000 . height 25684 5 >> 43 10961103.25000 . volume 25684 5 >> 44 5420425.00000 . height 25684 5 >> 44 41602824.75000 . volume 25684 5 >> 45 3324956.00000 . height 25684 5 >> 45 26821750.00000 . volume 25684 5 >> 46 14881622.00000 . height 25684 5 >> 46 118318186.00000 . volume 25684 5 >> 47 4027400.25000 . height 25684 5 >> 47 32480170.25000 . volume 25684 5 >> 48 24496448.00000 . height 25684 5 >> 48 187650242.00000 . volume 25684 5 >> 49 24472976.00000 . height 25684 5 >> 49 190682421.00000 . volume 25684 5 >> 50 45906764.00000 . height 25684 5 >> 50 364353578.00000 . volume 25684 5 >> 51 18264092.00000 . height 25684 5 >> 51 145675426.00000 . volume 25684 5 >> 52 18212388.00000 . height 25684 5 >> 52 147235844.00000 . volume 25684 5 >> 53 2335807.75000 . height 25684 5 >> 53 19728605.37500 . volume 25684 5 >> 54 5469750.50000 . height 25684 5 >> 54 45571869.00000 . volume 25684 5 >> 55 15845324.00000 . height 25684 5 >> 55 128212683.00000 . volume 25684 5 >> 56 12082612.00000 . height 25684 5 >> 56 98724028.00000 . volume 25684 5 >> 57 4724004.50000 . height 25684 5 >> 57 40627976.25000 . volume 25684 5 >> 58 4719326.50000 . height 25684 5 >> 58 38170022.75000 . volume 25684 5 >> 59 18371300.00000 . height 25684 5 >> 59 151166489.00000 . volume 25684 5 >> 60 14313975.00000 . height 25684 5 >> 60 112796330.00000 . volume 25684 5 >> 61 6998270.50000 . height 25684 5 >> 61 55899915.50000 . volume 25684 5 >> 62 15999343.00000 . height 25684 5 >> 62 128727469.00000 . volume 25684 5 >> 63 3230198.50000 . height 25684 5 >> 63 27080644.75000 . volume 25684 5 >> 64 3343543.25000 . height 25684 5 >> 64 27811439.50000 . volume 25684 5 >> 65 5327291.50000 . height 25684 5 >> 65 42955623.00000 . volume 25684 5 >> 66 23910910.00000 . height 25684 5 >> 66 188551531.00000 . volume 25684 5 >> 67 20505350.00000 . height 25684 5 >> 67 160265265.00000 . volume 25684 5 >> 68 26010900.00000 . height 25684 5 >> 68 202413394.00000 . volume 25684 5 >> 69 33017472.00000 . height 25684 5 >> 69 260135964.00000 . volume 25684 5 >> 70 16553987.00000 . height 25684 5 >> 70 129935387.00000 . volume 25684 5 >> 71 4144961.25000 . height 25684 5 >> 71 32565098.50000 . volume 25684 5 >> 72 31053500.00000 . height 25684 5 >> 72 252431040.00000 . volume 25684 5 >> 73 8912221.00000 . height 25684 5 >> 73 72429516.50000 . volume 25684 5 >> 74 10031132.00000 . height 25684 5 >> 74 79076957.00000 . volume 25684 5 >> 75 2429432.00000 . height 25684 5 >> 75 18299938.43750 . volume 25684 5 >> 76 12760129.00000 . height 25684 5 >> 76 100865656.00000 . volume 25684 5 >> 77 13652380.00000 . height 25684 5 >> 77 109636435.00000 . volume 25684 5 >> 78 13952803.00000 . height 25684 5 >> 78 111875867.00000 . volume 25684 5 >> 79 3694878.25000 . height 25684 5 >> 79 28478887.00000 . volume 25684 5 >> 80 3733201.25000 . height 25684 5 >> 80 29214530.25000 . volume 25684 5 >> 81 7980199.00000 . height 25684 5 >> 81 64573338.50000 . volume 25684 5 >> 82 4464881.00000 . height 25684 5 >> 82 35259707.75000 . volume 25684 5 >> 83 22972200.00000 . height 25684 5 >> 83 186624358.00000 . volume 25684 5 >> 84 37691932.00000 . height 25684 5 >> 84 314760304.00000 . volume 25684 5 >> 85 1925703.37500 . height 25684 5 >> 85 15936626.25000 . volume 25684 5 >> 86 14545932.00000 . height 25684 5 >> 86 117841549.00000 . volume 25684 5 >> 87 20679874.00000 . height 25684 5 >> 87 166265774.00000 . volume 25684 5 >> 88 17203010.00000 . height 25684 5 >> 88 134996095.00000 . volume 25684 5 >> 89 16164100.00000 . height 25684 5 >> 89 130014203.00000 . volume 25684 5 >> 90 16588001.00000 . height 25684 5 >> 90 136732564.00000 . volume 25684 5 >> 91 15256274.00000 . height 25684 5 >> 91 126739460.00000 . volume 25684 5 >> 92 17115490.00000 . height 25684 5 >> 92 140202583.00000 . volume 25684 5 >> 93 4377358.00000 . height 25684 5 >> 93 37132821.00000 . volume 25684 5 >> 94 17005464.00000 . height 25684 5 >> 94 137667726.00000 . volume 25684 5 >> 95 2987610.50000 . height 25684 5 >> 95 24496523.25000 . volume 25684 5 >> 96 10337867.00000 . height 25684 5 >> 96 81565427.00000 . volume 25684 5 >> 97 9788731.00000 . height 25684 5 >> 97 80782677.00000 . volume 25684 5 >> 98 3250205.50000 . height 25684 5 >> 98 27174444.25000 . volume 25684 5 >> 99 3559489.50000 . height 25684 5 >> 99 30363565.75000 . volume 25684 5 >> 100 5466166.50000 . height 25684 5 >> 100 44573689.25000 . volume 25684 5 >> 101 6009035.00000 . height 25684 5 >> 101 50400352.75000 . volume 25684 5 >> 102 13926941.00000 . height 25684 5 >> 102 117261758.00000 . volume 25684 5 >> 103 15130194.00000 . height 25684 5 >> 103 122809890.00000 . volume 25684 5 >> 104 10681484.00000 . height 25684 5 >> 104 89450424.50000 . volume 25684 5 >> 105 8814595.00000 . height 25684 5 >> 105 71784148.50000 . volume 25684 5 >> 106 7582683.00000 . height 25684 5 >> 106 62331868.00000 . volume 25684 5 >> 107 4747477.50000 . height 25684 5 >> 107 39633729.25000 . volume 25684 5 >> 108 1713921.12500 . height 25684 5 >> 108 13265365.50000 . volume 25684 5 >> 109 1457070.00000 . height 25684 5 >> 109 11734601.68750 . volume 25684 5 >> 110 1585167.25000 . height 25684 5 >> 110 13125304.62500 . volume 25684 5 >> 111 9927230.00000 . height 25684 5 >> 111 80438735.00000 . volume 25684 5 >> 112 19394980.00000 . height 25684 5 >> 112 154075022.00000 . volume 25684 5 >> 113 1733759.12500 . height 25684 5 >> 113 12832369.87500 . volume 25684 5 >> 114 16667223.00000 . height 25684 5 >> 114 147331698.00000 . volume 25684 5 >> 115 14343025.00000 . height 25684 5 >> 115 125371934.50000 . volume 25684 5 >> 116 4958334.00000 . height 25684 5 >> 116 41092612.75000 . volume 25684 5 >> 117 21634390.00000 . height 25684 5 >> 117 184698350.00000 . volume 25684 5 >> 118 3445576.75000 . height 25684 5 >> 118 27486886.37500 . volume 25684 5 >> 119 37266020.00000 . height 25684 5 >> 119 311831297.00000 . volume 25684 5 >> 120 4552747.50000 . height 25684 5 >> 120 38163386.25000 . volume 25684 5 >> 121 6330846.00000 . height 25684 5 >> 121 50944128.00000 . volume 25684 5 >> 122 4782730.50000 . height 25684 5 >> 122 37106706.75000 . volume 25684 5 >> 123 1642499.12500 . height 25684 5 >> 123 13024446.37500 . volume 25684 5 >> 124 3810668.75000 . height 25684 5 >> 124 28830380.75000 . volume 25684 5 >> 125 106636040.00000 . height 25684 5 >> 125 806547774.00000 . volume 25684 5 >> 126 39476948.00000 . height 25684 5 >> 126 320526232.00000 . volume 25684 5 >> 127 9424767.00000 . height 25684 5 >> 127 75031335.50000 . volume 25684 5 >> 128 4339794.50000 . height 25684 5 >> 128 35702108.75000 . volume 25684 5 >> 129 15573329.00000 . height 25684 5 >> 129 132492969.50000 . volume 25684 5 >> 130 6518544.00000 . height 25684 5 >> 130 56544905.00000 . volume 25684 5 >> 131 2437081.00000 . height 25684 5 >> 131 21331014.37500 . volume 25684 5 >> 132 1738700.50000 . height 25684 5 >> 132 13837615.25000 . volume 25684 5 >> 133 1166005.87500 . height 25684 5 >> 133 10274844.62500 . volume 25684 5 >> 134 2315937.25000 . height 25684 5 >> 134 20686187.31250 . volume 25684 5 >> 135 1802548.75000 . height 25684 5 >> 135 14718527.50000 . volume 25684 5 >> 136 924366.93750 . height 25684 5 >> 136 7470899.40625 . volume 25684 5 >> 137 848143.43750 . height 25684 5 >> 137 6856615.03125 . volume 25684 5 >> 138 1634125.00000 . height 25684 5 >> 138 13694787.37500 . volume 25684 5 >> 139 2031208.12500 . height 25684 5 >> 139 16764267.62500 . volume 25684 5 >> 140 1621441.87500 . height 25684 5 >> 140 13844894.87500 . volume 25684 5 >> 141 6426891.50000 . height 25684 5 >> 141 53916953.00000 . volume 25684 5 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 8.441 . 21.9501089305 . . . . . . . . . . 2 25684 5 >> 1 2 7.289 . 26.5053240582 . . . . . . . . . . 2 25684 5 >> 2 1 7.495 . 31.8362144753 . . . . . . . . . . 2 25684 5 >> 2 2 7.289 . 31.8152597174 . . . . . . . . . . 2 25684 5 >> 3 1 7.286 . 10.7728410512 . . . . . . . . . . 2 25684 5 >> 3 2 7.148 . 36.9711779058 . . . . . . . . . . 2 25684 5 >> 4 1 7.286 . 10.4365171865 . . . . . . . . . . 2 25684 5 >> 4 2 4.541 . 23.8150823861 . . . . . . . . . . 2 25684 5 >> 5 1 7.286 . 10.2535123006 . . . . . . . . . . 2 25684 5 >> 5 2 4.321 . 21.3466119021 . . . . . . . . . . 2 25684 5 >> 6 1 7.286 . 10.3481579572 . . . . . . . . . . 2 25684 5 >> 6 2 4.171 . 44.7893980891 . . . . . . . . . . 2 25684 5 >> 7 1 7.286 . 11.5195289254 . . . . . . . . . . 2 25684 5 >> 7 2 3.970 . 23.4742183238 . . . . . . . . . . 2 25684 5 >> 8 1 7.286 . 10.4410573840 . . . . . . . . . . 2 25684 5 >> 8 2 3.367 . 31.1918556690 . . . . . . . . . . 2 25684 5 >> 9 1 7.286 . 10.6425723061 . . . . . . . . . . 2 25684 5 >> 9 2 3.157 . 31.2344636768 . . . . . . . . . . 2 25684 5 >> 10 1 7.286 . 11.5886796266 . . . . . . . . . . 2 25684 5 >> 10 2 1.369 . 31.4083881676 . . . . . . . . . . 2 25684 5 >> 11 1 7.286 . 11.6976443678 . . . . . . . . . . 2 25684 5 >> 11 2 1.177 . 24.6372073889 . . . . . . . . . . 2 25684 5 >> 12 1 7.497 . 22.6405682042 . . . . . . . . . . 2 25684 5 >> 12 2 7.147 . 39.3554801121 . . . . . . . . . . 2 25684 5 >> 13 1 7.147 . 27.0567834377 . . . . . . . . . . 2 25684 5 >> 13 2 4.541 . 25.7121864706 . . . . . . . . . . 2 25684 5 >> 14 1 7.147 . 23.6044870690 . . . . . . . . . . 2 25684 5 >> 14 2 4.320 . 24.4975090027 . . . . . . . . . . 2 25684 5 >> 15 1 7.147 . 33.9103862643 . . . . . . . . . . 2 25684 5 >> 15 2 4.169 . 23.1012236327 . . . . . . . . . . 2 25684 5 >> 16 1 7.147 . 41.9521238655 . . . . . . . . . . 2 25684 5 >> 16 2 3.969 . 23.6872583628 . . . . . . . . . . 2 25684 5 >> 17 1 7.147 . 28.1328102574 . . . . . . . . . . 2 25684 5 >> 17 2 3.368 . 29.2221084237 . . . . . . . . . . 2 25684 5 >> 18 1 7.147 . 37.4919036403 . . . . . . . . . . 2 25684 5 >> 18 2 3.157 . 33.2531053573 . . . . . . . . . . 2 25684 5 >> 19 1 7.146 . 43.7849666923 . . . . . . . . . . 2 25684 5 >> 19 2 1.176 . 25.0695738941 . . . . . . . . . . 2 25684 5 >> 20 1 8.439 . 22.7993004955 . . . . . . . . . . 2 25684 5 >> 20 2 7.146 . 35.7268145308 . . . . . . . . . . 2 25684 5 >> 21 1 8.439 . 24.9434961006 . . . . . . . . . . 2 25684 5 >> 21 2 4.321 . 24.8991418630 . . . . . . . . . . 2 25684 5 >> 22 1 8.439 . 22.5113471970 . . . . . . . . . . 2 25684 5 >> 22 2 4.171 . 20.7382254303 . . . . . . . . . . 2 25684 5 >> 23 1 8.439 . 37.8902186640 . . . . . . . . . . 2 25684 5 >> 23 2 3.974 . 24.6826093644 . . . . . . . . . . 2 25684 5 >> 24 1 8.439 . 34.1794802807 . . . . . . . . . . 2 25684 5 >> 24 2 1.613 . 36.8475448340 . . . . . . . . . . 2 25684 5 >> 25 1 8.439 . 21.7700726353 . . . . . . . . . . 2 25684 5 >> 25 2 1.371 . 30.9397000819 . . . . . . . . . . 2 25684 5 >> 26 1 8.439 . 24.8876167461 . . . . . . . . . . 2 25684 5 >> 26 2 1.177 . 23.0236910284 . . . . . . . . . . 2 25684 5 >> 27 1 7.496 . 19.5483444259 . . . . . . . . . . 2 25684 5 >> 27 2 2.269 . 30.1524996758 . . . . . . . . . . 2 25684 5 >> 28 1 7.496 . 19.8085326701 . . . . . . . . . . 2 25684 5 >> 28 2 2.709 . 28.3035915345 . . . . . . . . . . 2 25684 5 >> 29 1 7.496 . 19.6555629373 . . . . . . . . . . 2 25684 5 >> 29 2 3.157 . 30.2593689412 . . . . . . . . . . 2 25684 5 >> 30 1 7.496 . 19.7477638721 . . . . . . . . . . 2 25684 5 >> 30 2 3.369 . 33.9320395142 . . . . . . . . . . 2 25684 5 >> 31 1 7.496 . 20.7598786801 . . . . . . . . . . 2 25684 5 >> 31 2 4.463 . 25.2889003605 . . . . . . . . . . 2 25684 5 >> 32 1 7.496 . 20.4993411899 . . . . . . . . . . 2 25684 5 >> 32 2 4.541 . 24.2048408836 . . . . . . . . . . 2 25684 5 >> 33 1 8.600 . 16.4653756656 . . . . . . . . . . 2 25684 5 >> 33 2 8.362 . 28.1172688119 . . . . . . . . . . 2 25684 5 >> 34 1 8.600 . 20.1710499823 . . . . . . . . . . 2 25684 5 >> 34 2 7.988 . 37.8203694709 . . . . . . . . . . 2 25684 5 >> 35 1 8.599 . 18.7527621165 . . . . . . . . . . 2 25684 5 >> 35 2 7.677 . 29.1980104521 . . . . . . . . . . 2 25684 5 >> 36 1 8.599 . 16.2219512276 . . . . . . . . . . 2 25684 5 >> 36 2 7.410 . 26.9652809948 . . . . . . . . . . 2 25684 5 >> 37 1 8.599 . 15.3518049046 . . . . . . . . . . 2 25684 5 >> 37 2 4.445 . 21.8453351408 . . . . . . . . . . 2 25684 5 >> 38 1 8.599 . 16.4922676049 . . . . . . . . . . 2 25684 5 >> 38 2 3.973 . 22.2350936383 . . . . . . . . . . 2 25684 5 >> 39 1 8.599 . 17.6196335815 . . . . . . . . . . 2 25684 5 >> 39 2 3.808 . 47.8243455291 . . . . . . . . . . 2 25684 5 >> 40 1 8.599 . 15.2817810886 . . . . . . . . . . 2 25684 5 >> 40 2 3.783 . 43.9365394413 . . . . . . . . . . 2 25684 5 >> 41 1 8.726 . 17.0802231878 . . . . . . . . . . 2 25684 5 >> 41 2 3.783 . 46.3882461190 . . . . . . . . . . 2 25684 5 >> 42 1 8.726 . 18.0024071597 . . . . . . . . . . 2 25684 5 >> 42 2 3.808 . 51.1973630637 . . . . . . . . . . 2 25684 5 >> 43 1 8.726 . 20.3254166991 . . . . . . . . . . 2 25684 5 >> 43 2 3.974 . 24.4157854468 . . . . . . . . . . 2 25684 5 >> 44 1 8.726 . 16.1945354193 . . . . . . . . . . 2 25684 5 >> 44 2 4.445 . 24.1873785853 . . . . . . . . . . 2 25684 5 >> 45 1 8.726 . 20.2178489417 . . . . . . . . . . 2 25684 5 >> 45 2 8.602 . 23.9411601797 . . . . . . . . . . 2 25684 5 >> 46 1 8.360 . 16.1940115504 . . . . . . . . . . 2 25684 5 >> 46 2 7.988 . 28.0936947092 . . . . . . . . . . 2 25684 5 >> 47 1 8.360 . 18.5233075172 . . . . . . . . . . 2 25684 5 >> 47 2 7.675 . 24.5142728090 . . . . . . . . . . 2 25684 5 >> 48 1 8.360 . 16.5050150827 . . . . . . . . . . 2 25684 5 >> 48 2 7.410 . 22.4540708587 . . . . . . . . . . 2 25684 5 >> 49 1 8.360 . 16.4837110788 . . . . . . . . . . 2 25684 5 >> 49 2 4.439 . 23.9554792643 . . . . . . . . . . 2 25684 5 >> 50 1 8.359 . 17.0695711859 . . . . . . . . . . 2 25684 5 >> 50 2 3.973 . 26.4134723693 . . . . . . . . . . 2 25684 5 >> 51 1 8.360 . 15.8234615810 . . . . . . . . . . 2 25684 5 >> 51 2 3.312 . 29.5971985906 . . . . . . . . . . 2 25684 5 >> 52 1 8.360 . 16.5481469594 . . . . . . . . . . 2 25684 5 >> 52 2 3.195 . 30.9746246785 . . . . . . . . . . 2 25684 5 >> 53 1 8.359 . 18.7305849977 . . . . . . . . . . 2 25684 5 >> 53 2 1.266 . 36.8210021406 . . . . . . . . . . 2 25684 5 >> 54 1 7.986 . 326.9404987800 . . . . . . . . . . 2 25684 5 >> 54 2 1.132 . 75.5398068577 . . . . . . . . . . 2 25684 5 >> 55 1 7.986 . 19.4526510313 . . . . . . . . . . 2 25684 5 >> 55 2 1.266 . 29.8696104437 . . . . . . . . . . 2 25684 5 >> 56 1 7.986 . 20.0275098905 . . . . . . . . . . 2 25684 5 >> 56 2 1.390 . 30.2670523524 . . . . . . . . . . 2 25684 5 >> 57 1 7.986 . 22.6438860409 . . . . . . . . . . 2 25684 5 >> 57 2 3.194 . 32.3164276779 . . . . . . . . . . 2 25684 5 >> 58 1 7.986 . 18.8940321095 . . . . . . . . . . 2 25684 5 >> 58 2 3.313 . 31.1597250402 . . . . . . . . . . 2 25684 5 >> 59 1 7.986 . 20.2140072361 . . . . . . . . . . 2 25684 5 >> 59 2 3.959 . 31.5355136991 . . . . . . . . . . 2 25684 5 >> 60 1 7.986 . 21.1775768548 . . . . . . . . . . 2 25684 5 >> 60 2 4.438 . 24.1615343839 . . . . . . . . . . 2 25684 5 >> 61 1 7.986 . 22.9327124543 . . . . . . . . . . 2 25684 5 >> 61 2 7.409 . 24.9497825280 . . . . . . . . . . 2 25684 5 >> 62 1 7.986 . 20.7979464903 . . . . . . . . . . 2 25684 5 >> 62 2 7.676 . 26.0879751295 . . . . . . . . . . 2 25684 5 >> 63 1 7.673 . 24.0452354774 . . . . . . . . . . 2 25684 5 >> 63 2 7.407 . 37.9116972908 . . . . . . . . . . 2 25684 5 >> 64 1 7.673 . 96.3971251622 . . . . . . . . . . 2 25684 5 >> 64 2 7.172 . 25.5417544395 . . . . . . . . . . 2 25684 5 >> 65 1 7.673 . 18.4597447515 . . . . . . . . . . 2 25684 5 >> 65 2 4.438 . 24.6840063483 . . . . . . . . . . 2 25684 5 >> 66 1 7.673 . 16.9929116964 . . . . . . . . . . 2 25684 5 >> 66 2 4.124 . 25.2868048847 . . . . . . . . . . 2 25684 5 >> 67 1 7.674 . 17.6215544343 . . . . . . . . . . 2 25684 5 >> 67 2 3.958 . 27.7559738606 . . . . . . . . . . 2 25684 5 >> 68 1 7.674 . 15.6071037054 . . . . . . . . . . 2 25684 5 >> 68 2 3.916 . 27.1161552519 . . . . . . . . . . 2 25684 5 >> 69 1 7.674 . 19.5455504581 . . . . . . . . . . 2 25684 5 >> 69 2 1.132 . 24.2369715124 . . . . . . . . . . 2 25684 5 >> 70 1 7.673 . 15.7422618940 . . . . . . . . . . 2 25684 5 >> 70 2 8.272 . 27.1596363746 . . . . . . . . . . 2 25684 5 >> 71 1 7.673 . 16.0796334967 . . . . . . . . . . 2 25684 5 >> 71 2 8.362 . 24.0752706304 . . . . . . . . . . 2 25684 5 >> 72 1 7.409 . 11.4437425509 . . . . . . . . . . 2 25684 5 >> 72 2 8.364 . 25.3102043644 . . . . . . . . . . 2 25684 5 >> 73 1 7.409 . 15.2753200382 . . . . . . . . . . 2 25684 5 >> 73 2 7.988 . 29.0235620923 . . . . . . . . . . 2 25684 5 >> 74 1 8.360 . 17.4296437763 . . . . . . . . . . 2 25684 5 >> 74 2 8.603 . 25.1161982305 . . . . . . . . . . 2 25684 5 >> 75 1 8.600 . 17.1366264112 . . . . . . . . . . 2 25684 5 >> 75 2 8.729 . 22.6314878091 . . . . . . . . . . 2 25684 5 >> 76 1 7.986 . 19.8303605430 . . . . . . . . . . 2 25684 5 >> 76 2 8.362 . 25.7441424765 . . . . . . . . . . 2 25684 5 >> 77 1 8.271 . 20.8807177842 . . . . . . . . . . 2 25684 5 >> 77 2 7.727 . 26.9893789664 . . . . . . . . . . 2 25684 5 >> 78 1 8.271 . 21.5711770579 . . . . . . . . . . 2 25684 5 >> 78 2 7.677 . 25.2913450822 . . . . . . . . . . 2 25684 5 >> 79 1 8.271 . 19.1804138012 . . . . . . . . . . 2 25684 5 >> 79 2 7.260 . 26.4780828729 . . . . . . . . . . 2 25684 5 >> 80 1 8.271 . 19.8329798877 . . . . . . . . . . 2 25684 5 >> 80 2 7.172 . 21.8016793951 . . . . . . . . . . 2 25684 5 >> 81 1 8.271 . 22.7020354941 . . . . . . . . . . 2 25684 5 >> 81 2 4.126 . 26.2793619186 . . . . . . . . . . 2 25684 5 >> 82 1 8.270 . 24.8455326073 . . . . . . . . . . 2 25684 5 >> 82 2 3.962 . 23.6621126533 . . . . . . . . . . 2 25684 5 >> 83 1 8.271 . 20.2492810786 . . . . . . . . . . 2 25684 5 >> 83 2 3.915 . 30.7071022689 . . . . . . . . . . 2 25684 5 >> 84 1 8.270 . 21.8058703467 . . . . . . . . . . 2 25684 5 >> 84 2 3.818 . 34.4517175108 . . . . . . . . . . 2 25684 5 >> 85 1 8.271 . 22.6571573876 . . . . . . . . . . 2 25684 5 >> 85 2 3.091 . 35.0733753294 . . . . . . . . . . 2 25684 5 >> 86 1 7.726 . 20.8105193451 . . . . . . . . . . 2 25684 5 >> 86 2 8.274 . 28.4223351628 . . . . . . . . . . 2 25684 5 >> 87 1 7.727 . 20.6638360396 . . . . . . . . . . 2 25684 5 >> 87 2 7.259 . 26.6352435574 . . . . . . . . . . 2 25684 5 >> 88 1 7.726 . 21.8655914068 . . . . . . . . . . 2 25684 5 >> 88 2 7.171 . 22.8075077757 . . . . . . . . . . 2 25684 5 >> 89 1 7.727 . 20.7441626117 . . . . . . . . . . 2 25684 5 >> 89 2 4.402 . 26.9582960755 . . . . . . . . . . 2 25684 5 >> 90 1 7.727 . 22.9468569160 . . . . . . . . . . 2 25684 5 >> 90 2 3.818 . 33.1266783178 . . . . . . . . . . 2 25684 5 >> 91 1 7.726 . 21.4555766433 . . . . . . . . . . 2 25684 5 >> 91 2 3.230 . 31.1178155243 . . . . . . . . . . 2 25684 5 >> 92 1 7.727 . 22.4921386689 . . . . . . . . . . 2 25684 5 >> 92 2 3.090 . 32.2528649122 . . . . . . . . . . 2 25684 5 >> 93 1 7.727 . 24.1199741140 . . . . . . . . . . 2 25684 5 >> 93 2 1.515 . 68.2650133967 . . . . . . . . . . 2 25684 5 >> 94 1 7.259 . 21.7402121052 . . . . . . . . . . 2 25684 5 >> 94 2 7.729 . 26.7138238996 . . . . . . . . . . 2 25684 5 >> 95 1 7.259 . 20.8870042115 . . . . . . . . . . 2 25684 5 >> 95 2 8.273 . 27.6644714177 . . . . . . . . . . 2 25684 5 >> 96 1 7.259 . 19.7812914848 . . . . . . . . . . 2 25684 5 >> 96 2 4.402 . 25.2323225141 . . . . . . . . . . 2 25684 5 >> 97 1 7.259 . 20.6027179956 . . . . . . . . . . 2 25684 5 >> 97 2 4.196 . 27.2726174444 . . . . . . . . . . 2 25684 5 >> 98 1 7.259 . 24.1950619966 . . . . . . . . . . 2 25684 5 >> 98 2 3.818 . 35.1013150066 . . . . . . . . . . 2 25684 5 >> 99 1 7.259 . 21.6277549043 . . . . . . . . . . 2 25684 5 >> 99 2 3.586 . 28.5690184683 . . . . . . . . . . 2 25684 5 >> 100 1 7.259 . 22.8029675782 . . . . . . . . . . 2 25684 5 >> 100 2 3.230 . 31.7667145282 . . . . . . . . . . 2 25684 5 >> 101 1 7.259 . 19.1770959646 . . . . . . . . . . 2 25684 5 >> 101 2 3.093 . 36.5471933037 . . . . . . . . . . 2 25684 5 >> 102 1 7.259 . 21.9123903662 . . . . . . . . . . 2 25684 5 >> 102 2 1.514 . 70.8543229848 . . . . . . . . . . 2 25684 5 >> 103 1 7.259 . 20.0330978259 . . . . . . . . . . 2 25684 5 >> 103 2 1.472 . 69.1178720444 . . . . . . . . . . 2 25684 5 >> 104 1 7.259 . 20.7333359867 . . . . . . . . . . 2 25684 5 >> 104 2 1.262 . 33.7490346283 . . . . . . . . . . 2 25684 5 >> 105 1 7.147 . 37.0818888769 . . . . . . . . . . 2 25684 5 >> 105 2 7.287 . 27.2184843197 . . . . . . . . . . 2 25684 5 >> 106 1 7.147 . 29.5902136713 . . . . . . . . . . 2 25684 5 >> 106 2 7.496 . 28.7150032818 . . . . . . . . . . 2 25684 5 >> 107 1 7.148 . 30.0141982734 . . . . . . . . . . 2 25684 5 >> 107 2 8.444 . 28.7719303742 . . . . . . . . . . 2 25684 5 >> 108 1 8.271 . 13.5786831379 . . . . . . . . . . 2 25684 5 >> 108 2 3.231 . 35.8675606549 . . . . . . . . . . 2 25684 5 >> 109 1 8.271 . 21.3981256820 . . . . . . . . . . 2 25684 5 >> 109 2 1.393 . 30.4214190692 . . . . . . . . . . 2 25684 5 >> 110 1 8.271 . 20.4137759283 . . . . . . . . . . 2 25684 5 >> 110 2 1.266 . 31.6284131259 . . . . . . . . . . 2 25684 5 >> 111 1 7.674 . 16.1858042702 . . . . . . . . . . 2 25684 5 >> 111 2 1.392 . 30.9767201543 . . . . . . . . . . 2 25684 5 >> 112 1 7.674 . 15.9140909091 . . . . . . . . . . 2 25684 5 >> 112 2 7.987 . 29.1459728032 . . . . . . . . . . 2 25684 5 >> 113 1 7.674 . 29.1347969323 . . . . . . . . . . 2 25684 5 >> 113 2 8.603 . 24.6499548666 . . . . . . . . . . 2 25684 5 >> 114 1 7.171 . 14.4619261846 . . . . . . . . . . 2 25684 5 >> 114 2 3.092 . 35.1830385625 . . . . . . . . . . 2 25684 5 >> 115 1 7.170 . 12.7467792481 . . . . . . . . . . 2 25684 5 >> 115 2 3.230 . 33.1692863256 . . . . . . . . . . 2 25684 5 >> 116 1 7.170 . 12.2602796182 . . . . . . . . . . 2 25684 5 >> 116 2 8.273 . 27.8766383417 . . . . . . . . . . 2 25684 5 >> 117 1 7.170 . 12.4422367662 . . . . . . . . . . 2 25684 5 >> 117 2 7.730 . 29.0527241305 . . . . . . . . . . 2 25684 5 >> 118 1 7.409 . 14.3760116771 . . . . . . . . . . 2 25684 5 >> 118 2 8.601 . 24.7077550739 . . . . . . . . . . 2 25684 5 >> 119 1 7.409 . 18.3741794899 . . . . . . . . . . 2 25684 5 >> 119 2 3.195 . 34.9001493305 . . . . . . . . . . 2 25684 5 >> 120 1 7.409 . 19.7673216462 . . . . . . . . . . 2 25684 5 >> 120 2 1.263 . 29.9988314509 . . . . . . . . . . 2 25684 5 >> 121 1 7.496 . 19.5965403691 . . . . . . . . . . 2 25684 5 >> 121 2 3.734 . 27.8509687632 . . . . . . . . . . 2 25684 5 >> 122 1 7.496 . 20.6533586606 . . . . . . . . . . 2 25684 5 >> 122 2 3.971 . 24.2223031819 . . . . . . . . . . 2 25684 5 >> 123 1 8.599 . 16.6646204889 . . . . . . . . . . 2 25684 5 >> 123 2 10.638 . 28.5021815216 . . . . . . . . . . 2 25684 5 >> 124 1 8.361 . 14.8394610733 . . . . . . . . . . 2 25684 5 >> 124 2 10.641 . 27.1864846582 . . . . . . . . . . 2 25684 5 >> 125 1 7.409 . 11.7507297546 . . . . . . . . . . 2 25684 5 >> 125 2 10.641 . 18.2156654773 . . . . . . . . . . 2 25684 5 >> 126 1 7.369 . 18.1007198989 . . . . . . . . . . 2 25684 5 >> 126 2 10.639 . 21.9359644689 . . . . . . . . . . 2 25684 5 >> 127 1 7.675 . 15.3612345457 . . . . . . . . . . 2 25684 5 >> 127 2 1.263 . 30.9075694531 . . . . . . . . . . 2 25684 5 >> 128 1 7.727 . 81.1584759504 . . . . . . . . . . 2 25684 5 >> 128 2 3.957 . 66.2009697407 . . . . . . . . . . 2 25684 5 >> 129 1 7.171 . 13.2825225592 . . . . . . . . . . 2 25684 5 >> 129 2 3.958 . 29.9331732094 . . . . . . . . . . 2 25684 5 >> 130 1 7.171 . 13.8336326927 . . . . . . . . . . 2 25684 5 >> 130 2 3.818 . 32.6712615788 . . . . . . . . . . 2 25684 5 >> 131 1 7.727 . 22.5214753300 . . . . . . . . . . 2 25684 5 >> 131 2 4.199 . 30.1427207887 . . . . . . . . . . 2 25684 5 >> 132 1 7.674 . 16.3792865351 . . . . . . . . . . 2 25684 5 >> 132 2 3.197 . 41.3367524743 . . . . . . . . . . 2 25684 5 >> 133 1 7.674 . 112.3318215830 . . . . . . . . . . 2 25684 5 >> 133 2 3.091 . 27.5869388133 . . . . . . . . . . 2 25684 5 >> 134 1 7.170 . 13.2437562570 . . . . . . . . . . 2 25684 5 >> 134 2 1.389 . 35.9723344445 . . . . . . . . . . 2 25684 5 >> 135 1 7.170 . 12.9577238113 . . . . . . . . . . 2 25684 5 >> 135 2 7.990 . 27.1994504146 . . . . . . . . . . 2 25684 5 >> 136 1 8.599 . 18.1040377356 . . . . . . . . . . 2 25684 5 >> 136 2 3.195 . 26.5706330538 . . . . . . . . . . 2 25684 5 >> 137 1 8.599 . 13.6871240102 . . . . . . . . . . 2 25684 5 >> 137 2 3.312 . 19.5081811398 . . . . . . . . . . 2 25684 5 >> 138 1 7.728 . 23.2667662203 . . . . . . . . . . 2 25684 5 >> 138 2 1.390 . 44.8473729193 . . . . . . . . . . 2 25684 5 >> 139 1 7.170 . 15.5522720888 . . . . . . . . . . 2 25684 5 >> 139 2 1.515 . 80.7142350823 . . . . . . . . . . 2 25684 5 >> 140 1 7.171 . 22.0524379984 . . . . . . . . . . 2 25684 5 >> 140 2 1.472 . 89.3392134458 . . . . . . . . . . 2 25684 5 >> 141 1 7.673 . 21.6591870412 . . . . . . . . . . 2 25684 5 >> 141 2 3.820 . 37.2645445168 . . . . . . . . . . 2 25684 5 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 8.441 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 1 2 . 1 . . 7.289 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 2 1 . 1 . . 7.495 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 2 2 . 1 . . 7.289 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 3 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 3 2 . 1 . . 7.148 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 4 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 4 2 . 1 . . 4.541 . 4 1 1 25 TRP HA . . . . . . 384 . 25684 5 >> 5 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 5 2 . 1 . . 4.321 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 5 >> 6 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 6 2 . 1 . . 4.171 . 4 1 1 24 THR HB . . . . . . 296 . 25684 5 >> 7 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 7 2 . 1 . . 3.970 . 4 1 1 24 THR HA . . . . . . 401 . 25684 5 >> 8 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 8 2 . 1 . . 3.367 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 5 >> 9 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 9 2 . 1 . . 3.157 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 5 >> 10 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 10 2 . 1 . . 1.369 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 5 >> 10 2 . 2 . . 1.369 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 5 >> 11 1 . 1 . . 7.286 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 11 2 . 1 . . 1.177 . 4 1 1 24 THR MG . . . . . . 402 . 25684 5 >> 12 1 . 1 . . 7.497 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 12 2 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 13 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 13 2 . 1 . . 4.541 . 4 1 1 25 TRP HA . . . . . . 384 . 25684 5 >> 14 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 14 2 . 1 . . 4.320 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 5 >> 15 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 15 2 . 1 . . 4.169 . 4 1 1 24 THR HB . . . . . . 296 . 25684 5 >> 16 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 16 2 . 1 . . 3.969 . 4 1 1 24 THR HA . . . . . . 401 . 25684 5 >> 17 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 17 2 . 1 . . 3.368 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 5 >> 18 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 18 2 . 1 . . 3.157 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 5 >> 19 1 . 1 . . 7.146 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 19 2 . 1 . . 1.176 . 4 1 1 24 THR MG . . . . . . 402 . 25684 5 >> 20 1 . 1 . . 8.439 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 20 2 . 1 . . 7.146 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 21 1 . 1 . . 8.439 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 21 2 . 1 . . 4.321 . 4 1 1 23 PRO HA . . . . . . 371 . 25684 5 >> 22 1 . 1 . . 8.439 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 22 2 . 1 . . 4.171 . 4 1 1 24 THR HB . . . . . . 296 . 25684 5 >> 23 1 . 1 . . 8.439 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 23 2 . 1 . . 3.974 . 4 1 1 24 THR HA . . . . . . 401 . 25684 5 >> 24 1 . 1 . . 8.439 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 24 2 . 1 . . 1.613 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 5 >> 24 2 . 2 . . 1.613 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 5 >> 25 1 . 1 . . 8.439 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 25 2 . 1 . . 1.371 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 5 >> 25 2 . 2 . . 1.371 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 5 >> 26 1 . 1 . . 8.439 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 26 2 . 1 . . 1.177 . 4 1 1 24 THR MG . . . . . . 402 . 25684 5 >> 27 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 27 2 . 1 . . 2.269 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 5 >> 28 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 28 2 . 1 . . 2.709 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 5 >> 29 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 29 2 . 1 . . 3.157 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 5 >> 30 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 30 2 . 1 . . 3.369 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 5 >> 31 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 31 2 . 1 . . 4.463 . 4 1 1 26 CYS HA . . . . . . 398 . 25684 5 >> 32 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 32 2 . 1 . . 4.541 . 4 1 1 25 TRP HA . . . . . . 384 . 25684 5 >> 33 1 . 1 . . 8.600 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 33 2 . 1 . . 8.362 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 34 1 . 1 . . 8.600 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 34 2 . 1 . . 7.988 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 35 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 35 2 . 1 . . 7.677 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 36 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 36 2 . 1 . . 7.410 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 37 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 37 2 . 1 . . 4.445 . 4 1 1 15 SER HA . . . . . . 224 . 25684 5 >> 38 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 38 2 . 1 . . 3.973 . 4 1 1 16 GLY HA3 . . . . . . 312 . 25684 5 >> 38 2 . 2 . . 3.973 . 4 1 1 16 GLY HA2 . . . . . . 226 . 25684 5 >> 39 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 39 2 . 1 . . 3.808 . 4 1 1 15 SER HB3 . . . . . . 404 . 25684 5 >> 40 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 40 2 . 1 . . 3.783 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 5 >> 41 1 . 1 . . 8.726 . 4 1 1 15 SER H . . . . . . 33 . 25684 5 >> 41 2 . 1 . . 3.783 . 4 1 1 15 SER HB2 . . . . . . 225 . 25684 5 >> 42 1 . 1 . . 8.726 . 4 1 1 15 SER H . . . . . . 33 . 25684 5 >> 42 2 . 1 . . 3.808 . 4 1 1 15 SER HB3 . . . . . . 404 . 25684 5 >> 43 1 . 1 . . 8.726 . 4 1 1 15 SER H . . . . . . 33 . 25684 5 >> 43 2 . 1 . . 3.974 . 4 1 1 16 GLY HA3 . . . . . . 312 . 25684 5 >> 43 2 . 2 . . 3.974 . 4 1 1 16 GLY HA2 . . . . . . 226 . 25684 5 >> 44 1 . 1 . . 8.726 . 4 1 1 15 SER H . . . . . . 33 . 25684 5 >> 44 2 . 1 . . 4.445 . 4 1 1 15 SER HA . . . . . . 224 . 25684 5 >> 45 1 . 1 . . 8.726 . 4 1 1 15 SER H . . . . . . 33 . 25684 5 >> 45 2 . 1 . . 8.602 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 46 1 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 46 2 . 1 . . 7.988 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 47 1 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 47 2 . 1 . . 7.675 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 48 1 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 48 2 . 1 . . 7.410 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 49 1 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 49 2 . 1 . . 4.439 . 4 1 1 17 TRP HA . . . . . . 227 . 25684 5 >> 50 1 . 1 . . 8.359 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 50 2 . 1 . . 3.973 . 4 1 1 16 GLY HA3 . . . . . . 312 . 25684 5 >> 50 2 . 2 . . 3.973 . 4 1 1 16 GLY HA2 . . . . . . 226 . 25684 5 >> 51 1 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 51 2 . 1 . . 3.312 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 5 >> 52 1 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 52 2 . 1 . . 3.195 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 5 >> 53 1 . 1 . . 8.359 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 53 2 . 1 . . 1.266 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 5 >> 54 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 54 2 . 1 . . 1.132 . 4 1 1 19 THR MG . . . . . . 317 . 25684 5 >> 55 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 55 2 . 1 . . 1.266 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 5 >> 56 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 56 2 . 1 . . 1.390 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 5 >> 57 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 57 2 . 1 . . 3.194 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 5 >> 58 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 58 2 . 1 . . 3.313 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 5 >> 59 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 59 2 . 1 . . 3.959 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 5 >> 60 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 60 2 . 1 . . 4.438 . 4 1 1 17 TRP HA . . . . . . 227 . 25684 5 >> 61 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 61 2 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 62 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 62 2 . 1 . . 7.676 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 63 1 . 1 . . 7.673 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 63 2 . 1 . . 7.407 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 64 1 . 1 . . 7.673 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 64 2 . 1 . . 7.172 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 65 1 . 1 . . 7.673 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 65 2 . 1 . . 4.438 . 4 1 1 17 TRP HA . . . . . . 227 . 25684 5 >> 66 1 . 1 . . 7.673 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 66 2 . 1 . . 4.124 . 4 1 1 19 THR HB . . . . . . 314 . 25684 5 >> 67 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 67 2 . 1 . . 3.958 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 5 >> 68 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 68 2 . 1 . . 3.916 . 4 1 1 19 THR HA . . . . . . 233 . 25684 5 >> 69 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 69 2 . 1 . . 1.132 . 4 1 1 19 THR MG . . . . . . 317 . 25684 5 >> 70 1 . 1 . . 7.673 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 70 2 . 1 . . 8.272 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 71 1 . 1 . . 7.673 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 71 2 . 1 . . 8.362 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 72 1 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 72 2 . 1 . . 8.364 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 73 1 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 73 2 . 1 . . 7.988 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 74 1 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 74 2 . 1 . . 8.603 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 75 1 . 1 . . 8.600 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 75 2 . 1 . . 8.729 . 4 1 1 15 SER H . . . . . . 33 . 25684 5 >> 76 1 . 1 . . 7.986 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 76 2 . 1 . . 8.362 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 77 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 77 2 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 78 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 78 2 . 1 . . 7.677 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 79 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 79 2 . 1 . . 7.260 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 80 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 80 2 . 1 . . 7.172 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 81 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 81 2 . 1 . . 4.126 . 4 1 1 19 THR HB . . . . . . 314 . 25684 5 >> 82 1 . 1 . . 8.270 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 82 2 . 1 . . 3.962 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 5 >> 83 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 83 2 . 1 . . 3.915 . 4 1 1 19 THR HA . . . . . . 233 . 25684 5 >> 84 1 . 1 . . 8.270 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 84 2 . 1 . . 3.818 . 4 1 1 20 GLY HA2 . . . . . . 235 . 25684 5 >> 84 2 . 2 . . 3.818 . 4 1 1 20 GLY HA3 . . . . . . 315 . 25684 5 >> 85 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 85 2 . 1 . . 3.091 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 5 >> 86 1 . 1 . . 7.726 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 86 2 . 1 . . 8.274 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 87 1 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 87 2 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 88 1 . 1 . . 7.726 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 88 2 . 1 . . 7.171 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 89 1 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 89 2 . 1 . . 4.402 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 5 >> 90 1 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 90 2 . 1 . . 3.818 . 4 1 1 20 GLY HA2 . . . . . . 235 . 25684 5 >> 90 2 . 2 . . 3.818 . 4 1 1 20 GLY HA3 . . . . . . 315 . 25684 5 >> 91 1 . 1 . . 7.726 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 91 2 . 1 . . 3.230 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 5 >> 92 1 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 92 2 . 1 . . 3.090 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 5 >> 93 1 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 93 2 . 1 . . 1.515 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 5 >> 94 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 94 2 . 1 . . 7.729 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 95 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 95 2 . 1 . . 8.273 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 96 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 96 2 . 1 . . 4.402 . 4 1 1 21 TRP HA . . . . . . 238 . 25684 5 >> 97 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 97 2 . 1 . . 4.196 . 4 1 1 22 LEU HA . . . . . . 387 . 25684 5 >> 98 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 98 2 . 1 . . 3.818 . 4 1 1 20 GLY HA2 . . . . . . 235 . 25684 5 >> 98 2 . 2 . . 3.818 . 4 1 1 20 GLY HA3 . . . . . . 315 . 25684 5 >> 99 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 99 2 . 1 . . 3.586 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 5 >> 99 2 . 2 . . 3.586 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 5 >> 100 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 100 2 . 1 . . 3.230 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 5 >> 101 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 101 2 . 1 . . 3.093 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 5 >> 102 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 102 2 . 1 . . 1.514 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 5 >> 103 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 103 2 . 1 . . 1.472 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 5 >> 104 1 . 1 . . 7.259 . 4 1 1 22 LEU H . . . . . . 158 . 25684 5 >> 104 2 . 1 . . 1.262 . 4 1 1 22 LEU HG . . . . . . 370 . 25684 5 >> 105 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 105 2 . 1 . . 7.287 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 5 >> 106 1 . 1 . . 7.147 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 106 2 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 107 1 . 1 . . 7.148 . 4 1 1 25 TRP H . . . . . . 335 . 25684 5 >> 107 2 . 1 . . 8.444 . 4 1 1 24 THR H . . . . . . 399 . 25684 5 >> 108 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 108 2 . 1 . . 3.231 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 5 >> 109 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 109 2 . 1 . . 1.393 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 5 >> 110 1 . 1 . . 8.271 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 110 2 . 1 . . 1.266 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 5 >> 111 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 111 2 . 1 . . 1.392 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 5 >> 112 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 112 2 . 1 . . 7.987 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 113 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 113 2 . 1 . . 8.603 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 114 1 . 1 . . 7.171 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 114 2 . 1 . . 3.092 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 5 >> 115 1 . 1 . . 7.170 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 115 2 . 1 . . 3.230 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 5 >> 116 1 . 1 . . 7.170 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 116 2 . 1 . . 8.273 . 4 1 1 20 GLY H . . . . . . 313 . 25684 5 >> 117 1 . 1 . . 7.170 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 117 2 . 1 . . 7.730 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 118 1 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 118 2 . 1 . . 8.601 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 119 1 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 119 2 . 1 . . 3.195 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 5 >> 120 1 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 120 2 . 1 . . 1.263 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 5 >> 121 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 121 2 . 1 . . 3.734 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 5 >> 121 2 . 2 . . 3.734 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 5 >> 122 1 . 1 . . 7.496 . 4 1 1 26 CYS H . . . . . . 400 . 25684 5 >> 122 2 . 1 . . 3.971 . 4 1 1 24 THR HA . . . . . . 401 . 25684 5 >> 123 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 123 2 . 1 . . 10.638 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 5 >> 124 1 . 1 . . 8.361 . 4 1 1 17 TRP H . . . . . . 21 . 25684 5 >> 124 2 . 1 . . 10.641 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 5 >> 125 1 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 5 >> 125 2 . 1 . . 10.641 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 5 >> 126 1 . 1 . . 7.369 . 4 1 1 17 TRP HZ2 . . . . . . 392 . 25684 5 >> 126 2 . 1 . . 10.639 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 5 >> 127 1 . 1 . . 7.675 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 127 2 . 1 . . 1.263 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 5 >> 128 1 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 128 2 . 1 . . 3.957 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 5 >> 129 1 . 1 . . 7.171 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 129 2 . 1 . . 3.958 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 5 >> 130 1 . 1 . . 7.171 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 130 2 . 1 . . 3.818 . 4 1 1 20 GLY HA2 . . . . . . 235 . 25684 5 >> 130 2 . 2 . . 3.818 . 4 1 1 20 GLY HA3 . . . . . . 315 . 25684 5 >> 131 1 . 1 . . 7.727 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 131 2 . 1 . . 4.199 . 4 1 1 22 LEU HA . . . . . . 387 . 25684 5 >> 132 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 132 2 . 1 . . 3.197 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 5 >> 133 1 . 1 . . 7.674 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 133 2 . 1 . . 3.091 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 5 >> 134 1 . 1 . . 7.170 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 134 2 . 1 . . 1.389 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 5 >> 135 1 . 1 . . 7.170 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 135 2 . 1 . . 7.990 . 4 1 1 18 LEU H . . . . . . 17 . 25684 5 >> 136 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 136 2 . 1 . . 3.195 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 5 >> 137 1 . 1 . . 8.599 . 4 1 1 16 GLY H . . . . . . 23 . 25684 5 >> 137 2 . 1 . . 3.312 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 5 >> 138 1 . 1 . . 7.728 . 4 1 1 21 TRP H . . . . . . 3 . 25684 5 >> 138 2 . 1 . . 1.390 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 5 >> 139 1 . 1 . . 7.170 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 139 2 . 1 . . 1.515 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 5 >> 140 1 . 1 . . 7.171 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 5 >> 140 2 . 1 . . 1.472 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 5 >> 141 1 . 1 . . 7.673 . 4 1 1 19 THR H . . . . . . 1 . 25684 5 >> 141 2 . 1 . . 3.820 . 4 1 1 20 GLY HA2 . . . . . . 235 . 25684 5 >> 141 2 . 2 . . 3.820 . 4 1 1 20 GLY HA3 . . . . . . 315 . 25684 5 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3_4_5_6 _Saveframe_category spectral_peak_list _Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_3.peaks.' _Experiment_label '2D 1H-1H NOESY' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H stop_ _Sample_label $wr18_39 _Sample_conditions_label $2 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3_4_5_6 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 6 >> _Spectral_peak_list.Sample_ID 3 >> _Spectral_peak_list.Sample_label $wr18_39 >> _Spectral_peak_list.Sample_condition_list_ID 2 >> _Spectral_peak_list.Sample_condition_list_label $2 >> _Spectral_peak_list.Experiment_ID 11 >> _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_3.peaks.' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 11718.75 Hz . . . 25684 6 >> 2 H 1 1H . . 11718.75 Hz . . . 25684 6 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 'Original number 1' 25684 6 >> 10 1.0 'Original number 14' 25684 6 >> 11 1.0 'Original number 15' 25684 6 >> 12 1.0 'Original number 16' 25684 6 >> 13 1.0 'Original number 20' 25684 6 >> 14 1.0 'Original number 21' 25684 6 >> 15 1.0 'Original number 31' 25684 6 >> 16 1.0 'Original number 32' 25684 6 >> 17 1.0 'Original number 33' 25684 6 >> 18 1.0 'Original number 34' 25684 6 >> 19 1.0 'Original number 35' 25684 6 >> 2 1.0 'Original number 2' 25684 6 >> 20 1.0 'Original number 36' 25684 6 >> 21 1.0 'Original number 37' 25684 6 >> 22 1.0 'Original number 38' 25684 6 >> 23 1.0 'Original number 39' 25684 6 >> 24 1.0 'Original number 40' 25684 6 >> 25 1.0 'Original number 47' 25684 6 >> 3 1.0 'Original number 4' 25684 6 >> 4 1.0 'Original number 5' 25684 6 >> 5 1.0 'Original number 6' 25684 6 >> 6 1.0 'Original number 8' 25684 6 >> 7 1.0 'Original number 11' 25684 6 >> 8 1.0 'Original number 12' 25684 6 >> 9 1.0 'Original number 13' 25684 6 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 2847561.75000 . height 25684 6 >> 1 22066429.75000 . volume 25684 6 >> 2 1599637.12500 . height 25684 6 >> 2 12348915.00000 . volume 25684 6 >> 3 1267220.50000 . height 25684 6 >> 3 9445078.00000 . volume 25684 6 >> 4 1655396.50000 . height 25684 6 >> 4 11746141.87500 . volume 25684 6 >> 5 1035269.62500 . height 25684 6 >> 5 7997209.12500 . volume 25684 6 >> 6 1409797.25000 . height 25684 6 >> 6 10062117.25000 . volume 25684 6 >> 7 2189853.25000 . height 25684 6 >> 7 15576200.12500 . volume 25684 6 >> 8 1939275.75000 . height 25684 6 >> 8 14373971.62500 . volume 25684 6 >> 9 2340683.00000 . height 25684 6 >> 9 16402698.62500 . volume 25684 6 >> 10 1504159.25000 . height 25684 6 >> 10 11362037.75000 . volume 25684 6 >> 11 1482331.75000 . height 25684 6 >> 11 11926540.87500 . volume 25684 6 >> 12 586510.81250 . height 25684 6 >> 12 4888867.78125 . volume 25684 6 >> 13 6090723.00000 . height 25684 6 >> 13 46128325.75000 . volume 25684 6 >> 14 1180599.62500 . height 25684 6 >> 14 8364136.31250 . volume 25684 6 >> 15 31573696.00000 . height 25684 6 >> 15 239983188.00000 . volume 25684 6 >> 16 13051134.00000 . height 25684 6 >> 16 102176385.00000 . volume 25684 6 >> 17 43222216.00000 . height 25684 6 >> 17 296392120.00000 . volume 25684 6 >> 18 117696736.00000 . height 25684 6 >> 18 755448060.00000 . volume 25684 6 >> 19 3879395.50000 . height 25684 6 >> 19 28953407.50000 . volume 25684 6 >> 20 1134936.50000 . height 25684 6 >> 20 8165793.25000 . volume 25684 6 >> 21 3629414.00000 . height 25684 6 >> 21 25784784.75000 . volume 25684 6 >> 22 1447082.87500 . height 25684 6 >> 22 10821713.68750 . volume 25684 6 >> 23 27195270.00000 . height 25684 6 >> 23 203900930.00000 . volume 25684 6 >> 24 76387496.00000 . height 25684 6 >> 24 545538376.00000 . volume 25684 6 >> 25 1984276.00000 . height 25684 6 >> 25 13261418.12500 . volume 25684 6 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 10.183 . 13.04180477750 . . . . . . . . . . 2 25684 6 >> 1 2 0.528 . 24.50798638160 . . . . . . . . . . 2 25684 6 >> 2 1 10.184 . 11.47936563940 . . . . . . . . . . 2 25684 6 >> 2 2 0.680 . 36.93904727700 . . . . . . . . . . 2 25684 6 >> 3 1 10.630 . 12.12193456010 . . . . . . . . . . 2 25684 6 >> 3 2 0.529 . 24.75944347680 . . . . . . . . . . 2 25684 6 >> 4 1 10.630 . 8.69369250722 . . . . . . . . . . 2 25684 6 >> 4 2 0.671 . 23.66350963710 . . . . . . . . . . 2 25684 6 >> 5 1 10.185 . 10.44498640110 . . . . . . . . . . 2 25684 6 >> 5 2 0.766 . 20.53636126220 . . . . . . . . . . 2 25684 6 >> 6 1 10.184 . 9.85091901384 . . . . . . . . . . 2 25684 6 >> 6 2 1.261 . 26.85980871320 . . . . . . . . . . 2 25684 6 >> 7 1 10.632 . 9.71287954599 . . . . . . . . . . 2 25684 6 >> 7 2 3.196 . 27.36691385510 . . . . . . . . . . 2 25684 6 >> 8 1 10.631 . 10.05108060780 . . . . . . . . . . 2 25684 6 >> 8 2 3.313 . 26.77598968150 . . . . . . . . . . 2 25684 6 >> 9 1 10.182 . 9.57903102972 . . . . . . . . . . 2 25684 6 >> 9 2 3.092 . 28.97554077210 . . . . . . . . . . 2 25684 6 >> 10 1 10.184 . 11.20424713010 . . . . . . . . . . 2 25684 6 >> 10 2 3.230 . 28.23164686560 . . . . . . . . . . 2 25684 6 >> 11 1 10.717 . 12.43341830560 . . . . . . . . . . 2 25684 6 >> 11 2 3.155 . 30.54575063290 . . . . . . . . . . 2 25684 6 >> 12 1 10.717 . 11.65473076980 . . . . . . . . . . 2 25684 6 >> 12 2 3.364 . 21.95779234170 . . . . . . . . . . 2 25684 6 >> 13 1 10.183 . 12.32541399080 . . . . . . . . . . 2 25684 6 >> 13 2 3.954 . 25.98529681560 . . . . . . . . . . 2 25684 6 >> 14 1 10.183 . 8.67186463438 . . . . . . . . . . 2 25684 6 >> 14 2 1.389 . 26.81650221350 . . . . . . . . . . 2 25684 6 >> 15 1 10.716 . 21.05197927450 . . . . . . . . . . 2 25684 6 >> 15 2 7.287 . 20.14241181310 . . . . . . . . . . 2 25684 6 >> 16 1 10.716 . 20.87892789860 . . . . . . . . . . 2 25684 6 >> 16 2 7.392 . 23.36106263100 . . . . . . . . . . 2 25684 6 >> 17 1 10.632 . 11.07066054830 . . . . . . . . . . 2 25684 6 >> 17 2 7.373 . 21.29073254760 . . . . . . . . . . 2 25684 6 >> 18 1 10.632 . 11.06900162990 . . . . . . . . . . 2 25684 6 >> 18 2 7.409 . 16.12363848840 . . . . . . . . . . 2 25684 6 >> 19 1 10.632 . 10.57023473550 . . . . . . . . . . 2 25684 6 >> 19 2 8.360 . 27.64875534920 . . . . . . . . . . 2 25684 6 >> 20 1 10.184 . 10.21046773530 . . . . . . . . . . 2 25684 6 >> 20 2 8.275 . 23.04447116330 . . . . . . . . . . 2 25684 6 >> 21 1 10.184 . 11.36935316030 . . . . . . . . . . 2 25684 6 >> 21 2 7.730 . 24.50693864380 . . . . . . . . . . 2 25684 6 >> 22 1 10.184 . 11.57828955910 . . . . . . . . . . 2 25684 6 >> 22 2 7.677 . 30.50663508470 . . . . . . . . . . 2 25684 6 >> 23 1 10.184 . 12.91258377020 . . . . . . . . . . 2 25684 6 >> 23 2 7.381 . 25.44920425860 . . . . . . . . . . 2 25684 6 >> 24 1 10.184 . 12.58420525120 . . . . . . . . . . 2 25684 6 >> 24 2 7.172 . 20.21226100620 . . . . . . . . . . 2 25684 6 >> 25 1 10.185 . 10.44498640110 . . . . . . . . . . 2 25684 6 >> 25 2 10.642 . 28.12490856740 . . . . . . . . . . 2 25684 6 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 10.183 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 1 2 . 1 . . 0.528 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 6 >> 2 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 2 2 . 1 . . 0.680 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 6 >> 3 1 . 1 . . 10.630 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> 3 2 . 1 . . 0.529 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 6 >> 4 1 . 1 . . 10.630 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> 4 2 . 1 . . 0.671 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 6 >> 5 1 . 1 . . 10.185 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 5 2 . 1 . . 0.766 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 6 >> 5 2 . 2 . . 0.766 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 6 >> 6 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 6 2 . 1 . . 1.261 . 4 1 1 22 LEU HG . . . . . . 370 . 25684 6 >> 7 1 . 1 . . 10.632 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> 7 2 . 1 . . 3.196 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 6 >> 8 1 . 1 . . 10.631 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> 8 2 . 1 . . 3.313 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 6 >> 9 1 . 1 . . 10.182 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 9 2 . 1 . . 3.092 . 4 1 1 21 TRP HB2 . . . . . . 236 . 25684 6 >> 10 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 10 2 . 1 . . 3.230 . 4 1 1 21 TRP HB3 . . . . . . 237 . 25684 6 >> 11 1 . 1 . . 10.717 . 4 1 1 25 TRP HE1 . . . . . . 385 . 25684 6 >> 11 2 . 1 . . 3.155 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 6 >> 12 1 . 1 . . 10.717 . 4 1 1 25 TRP HE1 . . . . . . 385 . 25684 6 >> 12 2 . 1 . . 3.364 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 6 >> 13 1 . 1 . . 10.183 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 13 2 . 1 . . 3.954 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 6 >> 14 1 . 1 . . 10.183 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 14 2 . 1 . . 1.389 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 6 >> 15 1 . 1 . . 10.716 . 4 1 1 25 TRP HE1 . . . . . . 385 . 25684 6 >> 15 2 . 1 . . 7.287 . 4 1 1 25 TRP HD1 . . . . . . 390 . 25684 6 >> 16 1 . 1 . . 10.716 . 4 1 1 25 TRP HE1 . . . . . . 385 . 25684 6 >> 16 2 . 1 . . 7.392 . 4 1 1 25 TRP HZ2 . . . . . . 409 . 25684 6 >> 17 1 . 1 . . 10.632 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> 17 2 . 1 . . 7.373 . 4 1 1 17 TRP HZ2 . . . . . . 392 . 25684 6 >> 18 1 . 1 . . 10.632 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> 18 2 . 1 . . 7.409 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 6 >> 19 1 . 1 . . 10.632 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> 19 2 . 1 . . 8.360 . 4 1 1 17 TRP H . . . . . . 21 . 25684 6 >> 20 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 20 2 . 1 . . 8.275 . 4 1 1 20 GLY H . . . . . . 313 . 25684 6 >> 21 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 21 2 . 1 . . 7.730 . 4 1 1 21 TRP H . . . . . . 3 . 25684 6 >> 22 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 22 2 . 1 . . 7.677 . 4 1 1 19 THR H . . . . . . 1 . 25684 6 >> 23 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 23 2 . 1 . . 7.381 . 4 1 1 21 TRP HZ2 . . . . . . 391 . 25684 6 >> 24 1 . 1 . . 10.184 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 24 2 . 1 . . 7.172 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 6 >> 25 1 . 1 . . 10.185 . 4 1 1 21 TRP HE1 . . . . . . 407 . 25684 6 >> 25 2 . 1 . . 10.642 . 4 1 1 17 TRP HE1 . . . . . . 406 . 25684 6 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3_4_5_6_7 _Saveframe_category spectral_peak_list _Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_4.peaks.' _Experiment_label '2D 1H-1H NOESY' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H stop_ _Sample_label $wr18_39 _Sample_conditions_label $2 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3_4_5_6_7 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6_7 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 7 >> _Spectral_peak_list.Sample_ID 3 >> _Spectral_peak_list.Sample_label $wr18_39 >> _Spectral_peak_list.Sample_condition_list_ID 2 >> _Spectral_peak_list.Sample_condition_list_label $2 >> _Spectral_peak_list.Experiment_ID 11 >> _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_4.peaks.' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 11718.75 Hz . . . 25684 7 >> 2 H 1 1H . . 11718.75 Hz . . . 25684 7 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 'Original number 1' 25684 7 >> 10 1.0 'Original number 20' 25684 7 >> 11 1.0 'Original number 21' 25684 7 >> 12 1.0 'Original number 22' 25684 7 >> 13 1.0 'Original number 24' 25684 7 >> 14 1.0 'Original number 25' 25684 7 >> 15 1.0 'Original number 27' 25684 7 >> 16 1.0 'Original number 38' 25684 7 >> 17 1.0 'Original number 39' 25684 7 >> 18 1.0 'Original number 40' 25684 7 >> 19 1.0 'Original number 41' 25684 7 >> 2 1.0 'Original number 2' 25684 7 >> 20 1.0 'Original number 42' 25684 7 >> 21 1.0 'Original number 44' 25684 7 >> 22 1.0 'Original number 45' 25684 7 >> 23 1.0 'Original number 46' 25684 7 >> 24 1.0 'Original number 48' 25684 7 >> 25 1.0 'Original number 49' 25684 7 >> 26 1.0 'Original number 50' 25684 7 >> 27 1.0 'Original number 51' 25684 7 >> 28 1.0 'Original number 52' 25684 7 >> 29 1.0 'Original number 53' 25684 7 >> 3 1.0 'Original number 3' 25684 7 >> 30 1.0 'Original number 54' 25684 7 >> 31 1.0 'Original number 55' 25684 7 >> 32 1.0 'Original number 57' 25684 7 >> 33 1.0 'Original number 58' 25684 7 >> 34 1.0 'Original number 59' 25684 7 >> 35 1.0 'Original number 60' 25684 7 >> 36 1.0 'Original number 61' 25684 7 >> 37 1.0 'Original number 62' 25684 7 >> 38 1.0 'Original number 63' 25684 7 >> 39 1.0 'Original number 64' 25684 7 >> 4 1.0 'Original number 4' 25684 7 >> 40 1.0 'Original number 65' 25684 7 >> 41 1.0 'Original number 66' 25684 7 >> 42 1.0 'Original number 68' 25684 7 >> 43 1.0 'Original number 71' 25684 7 >> 44 1.0 'Original number 72' 25684 7 >> 45 1.0 'Original number 74' 25684 7 >> 46 1.0 'Original number 75' 25684 7 >> 47 1.0 'Original number 76' 25684 7 >> 48 1.0 'Original number 77' 25684 7 >> 49 1.0 'Original number 78' 25684 7 >> 5 1.0 'Original number 13' 25684 7 >> 6 1.0 'Original number 14' 25684 7 >> 7 1.0 'Original number 16' 25684 7 >> 8 1.0 'Original number 18' 25684 7 >> 9 1.0 'Original number 19' 25684 7 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 10077509.00 . height 25684 7 >> 1 81789171.50 . volume 25684 7 >> 2 6589545.50 . height 25684 7 >> 2 52340191.50 . volume 25684 7 >> 3 5120117.00 . height 25684 7 >> 3 40860536.00 . volume 25684 7 >> 4 5558398.00 . height 25684 7 >> 4 44038428.75 . volume 25684 7 >> 5 14651017.00 . height 25684 7 >> 5 116377013.00 . volume 25684 7 >> 6 10846335.00 . height 25684 7 >> 6 85079100.00 . volume 25684 7 >> 7 28430064.00 . height 25684 7 >> 7 220560396.00 . volume 25684 7 >> 8 16710960.00 . height 25684 7 >> 8 131850632.00 . volume 25684 7 >> 9 25661578.00 . height 25684 7 >> 9 206179742.00 . volume 25684 7 >> 10 7532202.50 . height 25684 7 >> 10 58829254.00 . volume 25684 7 >> 11 3227163.00 . height 25684 7 >> 11 25063308.75 . volume 25684 7 >> 12 6648053.00 . height 25684 7 >> 12 53556045.00 . volume 25684 7 >> 13 43975588.00 . height 25684 7 >> 13 348372032.00 . volume 25684 7 >> 14 7253291.00 . height 25684 7 >> 14 58869142.50 . volume 25684 7 >> 15 60124972.00 . height 25684 7 >> 15 485906644.00 . volume 25684 7 >> 16 13718938.00 . height 25684 7 >> 16 115708836.00 . volume 25684 7 >> 17 10683344.00 . height 25684 7 >> 17 86169707.00 . volume 25684 7 >> 18 41870744.00 . height 25684 7 >> 18 314217436.00 . volume 25684 7 >> 19 9005905.00 . height 25684 7 >> 19 74102601.50 . volume 25684 7 >> 20 26412254.00 . height 25684 7 >> 20 210681090.00 . volume 25684 7 >> 21 43160904.00 . height 25684 7 >> 21 336891906.00 . volume 25684 7 >> 22 66800796.00 . height 25684 7 >> 22 537006192.00 . volume 25684 7 >> 23 24066596.00 . height 25684 7 >> 23 194313670.00 . volume 25684 7 >> 24 62991008.00 . height 25684 7 >> 24 497513876.00 . volume 25684 7 >> 25 34578844.00 . height 25684 7 >> 25 269674294.00 . volume 25684 7 >> 26 26107906.00 . height 25684 7 >> 26 213526628.00 . volume 25684 7 >> 27 10522297.00 . height 25684 7 >> 27 77495006.00 . volume 25684 7 >> 28 11385360.00 . height 25684 7 >> 28 87001492.00 . volume 25684 7 >> 29 9323167.00 . height 25684 7 >> 29 77999259.50 . volume 25684 7 >> 30 14382296.00 . height 25684 7 >> 30 122430362.00 . volume 25684 7 >> 31 6319885.00 . height 25684 7 >> 31 56465330.00 . volume 25684 7 >> 32 11916642.00 . height 25684 7 >> 32 99776179.00 . volume 25684 7 >> 33 56633532.00 . height 25684 7 >> 33 456000496.00 . volume 25684 7 >> 34 21792410.00 . height 25684 7 >> 34 172911178.00 . volume 25684 7 >> 35 10116387.00 . height 25684 7 >> 35 91564500.00 . volume 25684 7 >> 36 9567995.00 . height 25684 7 >> 36 79905403.50 . volume 25684 7 >> 37 7036396.00 . height 25684 7 >> 37 61533330.00 . volume 25684 7 >> 38 15367262.00 . height 25684 7 >> 38 135729540.00 . volume 25684 7 >> 39 6003648.50 . height 25684 7 >> 39 51411263.00 . volume 25684 7 >> 40 2942382.00 . height 25684 7 >> 40 25942390.75 . volume 25684 7 >> 41 10771249.00 . height 25684 7 >> 41 90122150.00 . volume 25684 7 >> 42 7781570.00 . height 25684 7 >> 42 61366465.50 . volume 25684 7 >> 43 19097194.00 . height 25684 7 >> 43 151911216.00 . volume 25684 7 >> 44 7614244.50 . height 25684 7 >> 44 61596718.50 . volume 25684 7 >> 45 22399712.00 . height 25684 7 >> 45 172654918.00 . volume 25684 7 >> 46 8001896.50 . height 25684 7 >> 46 62412814.00 . volume 25684 7 >> 47 9027751.00 . height 25684 7 >> 47 70836339.50 . volume 25684 7 >> 48 12852860.00 . height 25684 7 >> 48 99825316.00 . volume 25684 7 >> 49 24995522.00 . height 25684 7 >> 49 203847314.00 . volume 25684 7 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 8.355 . 17.4790620804 . . . . . . . . . . 2 25684 7 >> 1 2 3.057 . 29.8954546452 . . . . . . . . . . 2 25684 7 >> 2 1 8.355 . 16.5519886650 . . . . . . . . . . 2 25684 7 >> 2 2 3.256 . 27.3480545729 . . . . . . . . . . 2 25684 7 >> 3 1 8.076 . 17.0720159076 . . . . . . . . . . 2 25684 7 >> 3 2 3.057 . 28.7827569991 . . . . . . . . . . 2 25684 7 >> 4 1 8.076 . 16.0040217452 . . . . . . . . . . 2 25684 7 >> 4 2 3.258 . 28.2281544060 . . . . . . . . . . 2 25684 7 >> 5 1 8.053 . 17.7401234396 . . . . . . . . . . 2 25684 7 >> 5 2 3.748 . 27.6798382401 . . . . . . . . . . 2 25684 7 >> 6 1 8.053 . 17.8216723725 . . . . . . . . . . 2 25684 7 >> 6 2 3.889 . 26.3568945229 . . . . . . . . . . 2 25684 7 >> 7 1 8.053 . 17.3299340531 . . . . . . . . . . 2 25684 7 >> 7 2 4.305 . 23.9058863372 . . . . . . . . . . 2 25684 7 >> 8 1 8.052 . 17.0019920915 . . . . . . . . . . 2 25684 7 >> 8 2 4.482 . 29.9268867821 . . . . . . . . . . 2 25684 7 >> 9 1 8.053 . 18.0556671694 . . . . . . . . . . 2 25684 7 >> 9 2 8.110 . 89.0771043487 . . . . . . . . . . 2 25684 7 >> 10 1 8.053 . 18.2943767868 . . . . . . . . . . 2 25684 7 >> 10 2 8.272 . 25.9163207375 . . . . . . . . . . 2 25684 7 >> 11 1 8.053 . 20.2552182600 . . . . . . . . . . 2 25684 7 >> 11 2 2.302 . 29.7781080008 . . . . . . . . . . 2 25684 7 >> 12 1 8.052 . 18.4925738722 . . . . . . . . . . 2 25684 7 >> 12 2 1.937 . 32.8563619405 . . . . . . . . . . 2 25684 7 >> 13 1 8.125 . 14.9793340825 . . . . . . . . . . 2 25684 7 >> 13 2 3.737 . 27.9766973108 . . . . . . . . . . 2 25684 7 >> 14 1 8.356 . 17.7043257281 . . . . . . . . . . 2 25684 7 >> 14 2 3.737 . 27.7245417237 . . . . . . . . . . 2 25684 7 >> 15 1 8.125 . 15.7682807185 . . . . . . . . . . 2 25684 7 >> 15 2 4.268 . 33.8251702487 . . . . . . . . . . 2 25684 7 >> 16 1 8.108 . 18.4087548405 . . . . . . . . . . 2 25684 7 >> 16 2 1.937 . 33.3725474775 . . . . . . . . . . 2 25684 7 >> 17 1 8.107 . 17.0320272446 . . . . . . . . . . 2 25684 7 >> 17 2 2.301 . 29.3687917292 . . . . . . . . . . 2 25684 7 >> 18 1 8.266 . 17.7476322278 . . . . . . . . . . 2 25684 7 >> 18 2 1.127 . 20.0229696929 . . . . . . . . . . 2 25684 7 >> 19 1 8.266 . 17.9379712790 . . . . . . . . . . 2 25684 7 >> 19 2 3.748 . 40.6571198255 . . . . . . . . . . 2 25684 7 >> 20 1 8.266 . 17.9070630111 . . . . . . . . . . 2 25684 7 >> 20 2 4.263 . 26.2437388301 . . . . . . . . . . 2 25684 7 >> 21 1 8.266 . 16.9281265698 . . . . . . . . . . 2 25684 7 >> 21 2 4.482 . 23.1857411563 . . . . . . . . . . 2 25684 7 >> 22 1 8.108 . 19.8411871679 . . . . . . . . . . 2 25684 7 >> 22 2 4.453 . 23.4162434936 . . . . . . . . . . 2 25684 7 >> 23 1 8.107 . 20.6896802410 . . . . . . . . . . 2 25684 7 >> 23 2 4.306 . 27.0819291472 . . . . . . . . . . 2 25684 7 >> 24 1 8.076 . 18.6539255083 . . . . . . . . . . 2 25684 7 >> 24 2 4.257 . 31.8631064147 . . . . . . . . . . 2 25684 7 >> 25 1 8.076 . 16.4538505487 . . . . . . . . . . 2 25684 7 >> 25 2 1.610 . 28.7289731205 . . . . . . . . . . 2 25684 7 >> 26 1 8.076 . 17.3662556335 . . . . . . . . . . 2 25684 7 >> 26 2 1.522 . 46.7018689960 . . . . . . . . . . 2 25684 7 >> 27 1 8.076 . 17.6760368049 . . . . . . . . . . 2 25684 7 >> 27 2 0.858 . 20.2807132155 . . . . . . . . . . 2 25684 7 >> 28 1 8.076 . 18.0111383088 . . . . . . . . . . 2 25684 7 >> 28 2 0.810 . 21.9396315515 . . . . . . . . . . 2 25684 7 >> 29 1 8.080 . 16.2525102496 . . . . . . . . . . 2 25684 7 >> 29 2 1.793 . 28.8183800876 . . . . . . . . . . 2 25684 7 >> 30 1 8.081 . 16.7046091519 . . . . . . . . . . 2 25684 7 >> 30 2 1.675 . 30.3753186017 . . . . . . . . . . 2 25684 7 >> 31 1 8.081 . 20.8436977118 . . . . . . . . . . 2 25684 7 >> 31 2 1.353 . 51.1764083058 . . . . . . . . . . 2 25684 7 >> 32 1 8.081 . 17.0936691575 . . . . . . . . . . 2 25684 7 >> 32 2 7.928 . 26.2547400780 . . . . . . . . . . 2 25684 7 >> 33 1 7.923 . 15.8617040142 . . . . . . . . . . 2 25684 7 >> 33 2 4.274 . 21.6329935938 . . . . . . . . . . 2 25684 7 >> 34 1 8.356 . 17.0700950548 . . . . . . . . . . 2 25684 7 >> 34 2 4.274 . 23.2758466154 . . . . . . . . . . 2 25684 7 >> 35 1 7.923 . 19.5541069843 . . . . . . . . . . 2 25684 7 >> 35 2 4.078 . 24.6630515903 . . . . . . . . . . 2 25684 7 >> 36 1 7.923 . 15.9586197697 . . . . . . . . . . 2 25684 7 >> 36 2 2.206 . 25.7010105997 . . . . . . . . . . 2 25684 7 >> 37 1 7.923 . 16.8979167938 . . . . . . . . . . 2 25684 7 >> 37 2 1.995 . 28.4265261143 . . . . . . . . . . 2 25684 7 >> 38 1 7.923 . 16.8477999978 . . . . . . . . . . 2 25684 7 >> 38 2 1.827 . 32.6056033373 . . . . . . . . . . 2 25684 7 >> 39 1 7.924 . 16.6242825799 . . . . . . . . . . 2 25684 7 >> 39 2 1.675 . 29.3988268822 . . . . . . . . . . 2 25684 7 >> 40 1 7.923 . 15.8866751008 . . . . . . . . . . 2 25684 7 >> 40 2 1.609 . 30.6400470436 . . . . . . . . . . 2 25684 7 >> 41 1 7.923 . 16.7342950590 . . . . . . . . . . 2 25684 7 >> 41 2 8.085 . 25.4013575613 . . . . . . . . . . 2 25684 7 >> 42 1 8.355 . 17.9332564585 . . . . . . . . . . 2 25684 7 >> 42 2 8.130 . 24.1367379203 . . . . . . . . . . 2 25684 7 >> 43 1 8.267 . 17.3487933353 . . . . . . . . . . 2 25684 7 >> 43 2 8.130 . 25.7696374319 . . . . . . . . . . 2 25684 7 >> 44 1 8.266 . 17.9009512067 . . . . . . . . . . 2 25684 7 >> 44 2 8.058 . 31.8910460919 . . . . . . . . . . 2 25684 7 >> 45 1 8.126 . 14.2008648254 . . . . . . . . . . 2 25684 7 >> 45 2 8.271 . 24.8619471677 . . . . . . . . . . 2 25684 7 >> 46 1 8.126 . 14.6199599840 . . . . . . . . . . 2 25684 7 >> 46 2 8.361 . 23.5809129663 . . . . . . . . . . 2 25684 7 >> 47 1 8.073 . 15.5164743774 . . . . . . . . . . 2 25684 7 >> 47 2 8.361 . 24.1826637648 . . . . . . . . . . 2 25684 7 >> 48 1 8.355 . 17.7123583853 . . . . . . . . . . 2 25684 7 >> 48 2 8.079 . 24.0162480623 . . . . . . . . . . 2 25684 7 >> 49 1 8.108 . 26.4468253590 . . . . . . . . . . 2 25684 7 >> 49 2 1.109 . 24.5303381234 . . . . . . . . . . 2 25684 7 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 8.355 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 1 2 . 1 . . 3.057 . 4 1 1 32 HIS HB3 . . . . . . 259 . 25684 7 >> 2 1 . 1 . . 8.355 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 2 2 . 1 . . 3.256 . 4 1 1 32 HIS HB2 . . . . . . 258 . 25684 7 >> 3 1 . 1 . . 8.076 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 3 2 . 1 . . 3.057 . 4 1 1 32 HIS HB3 . . . . . . 259 . 25684 7 >> 4 1 . 1 . . 8.076 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 4 2 . 1 . . 3.258 . 4 1 1 32 HIS HB2 . . . . . . 258 . 25684 7 >> 5 1 . 1 . . 8.053 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 5 2 . 1 . . 3.748 . 4 1 1 29 SER HB3 . . . . . . 253 . 25684 7 >> 6 1 . 1 . . 8.053 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 6 2 . 1 . . 3.889 . 4 1 1 29 SER HB2 . . . . . . 252 . 25684 7 >> 7 1 . 1 . . 8.053 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 7 2 . 1 . . 4.305 . 4 1 1 28 THR HA . . . . . . 411 . 25684 7 >> 8 1 . 1 . . 8.052 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 8 2 . 1 . . 4.482 . 4 1 1 29 SER HA . . . . . . 251 . 25684 7 >> 9 1 . 1 . . 8.053 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 9 2 . 1 . . 8.110 . 4 1 1 28 THR H . . . . . . 124 . 25684 7 >> 10 1 . 1 . . 8.053 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 10 2 . 1 . . 8.272 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 11 1 . 1 . . 8.053 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 11 2 . 1 . . 2.302 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 7 >> 11 2 . 2 . . 2.302 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 7 >> 12 1 . 1 . . 8.052 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 12 2 . 1 . . 1.937 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 7 >> 12 2 . 2 . . 1.937 . 4 1 1 27 PRO HG2 . . . . . . 394 . 25684 7 >> 13 1 . 1 . . 8.125 . 4 1 1 31 SER H . . . . . . 99 . 25684 7 >> 13 2 . 1 . . 3.737 . 4 1 1 31 SER HB2 . . . . . . 291 . 25684 7 >> 14 1 . 1 . . 8.356 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 14 2 . 1 . . 3.737 . 4 1 1 31 SER HB2 . . . . . . 291 . 25684 7 >> 15 1 . 1 . . 8.125 . 4 1 1 31 SER H . . . . . . 99 . 25684 7 >> 15 2 . 1 . . 4.268 . 4 1 1 31 SER HA . . . . . . 326 . 25684 7 >> 16 1 . 1 . . 8.108 . 4 1 1 28 THR H . . . . . . 124 . 25684 7 >> 16 2 . 1 . . 1.937 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 7 >> 16 2 . 2 . . 1.937 . 4 1 1 27 PRO HG2 . . . . . . 394 . 25684 7 >> 17 1 . 1 . . 8.107 . 4 1 1 28 THR H . . . . . . 124 . 25684 7 >> 17 2 . 1 . . 2.301 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 7 >> 17 2 . 2 . . 2.301 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 7 >> 18 1 . 1 . . 8.266 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 18 2 . 1 . . 1.127 . 4 1 1 30 THR MG . . . . . . 256 . 25684 7 >> 19 1 . 1 . . 8.266 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 19 2 . 1 . . 3.748 . 4 1 1 29 SER HB3 . . . . . . 253 . 25684 7 >> 20 1 . 1 . . 8.266 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 20 2 . 1 . . 4.263 . 4 1 1 30 THR HA . . . . . . 325 . 25684 7 >> 21 1 . 1 . . 8.266 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 21 2 . 1 . . 4.482 . 4 1 1 29 SER HA . . . . . . 251 . 25684 7 >> 22 1 . 1 . . 8.108 . 4 1 1 28 THR H . . . . . . 124 . 25684 7 >> 22 2 . 1 . . 4.453 . 4 1 1 27 PRO HA . . . . . . 412 . 25684 7 >> 23 1 . 1 . . 8.107 . 4 1 1 28 THR H . . . . . . 124 . 25684 7 >> 23 2 . 1 . . 4.306 . 4 1 1 28 THR HA . . . . . . 411 . 25684 7 >> 24 1 . 1 . . 8.076 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 24 2 . 1 . . 4.257 . 4 1 1 33 LEU HA . . . . . . 327 . 25684 7 >> 25 1 . 1 . . 8.076 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 25 2 . 1 . . 1.610 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 7 >> 26 1 . 1 . . 8.076 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 26 2 . 1 . . 1.522 . 4 1 1 33 LEU HB2 . . . . . . 261 . 25684 7 >> 27 1 . 1 . . 8.076 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 27 2 . 1 . . 0.858 . 4 1 1 33 LEU MD1 . . . . . . 264 . 25684 7 >> 28 1 . 1 . . 8.076 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 28 2 . 1 . . 0.810 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 7 >> 29 1 . 1 . . 8.080 . 4 1 1 34 LYS H . . . . . . 29 . 25684 7 >> 29 2 . 1 . . 1.793 . 4 1 1 34 LYS HB3 . . . . . . 273 . 25684 7 >> 30 1 . 1 . . 8.081 . 4 1 1 34 LYS H . . . . . . 29 . 25684 7 >> 30 2 . 1 . . 1.675 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 7 >> 31 1 . 1 . . 8.081 . 4 1 1 34 LYS H . . . . . . 29 . 25684 7 >> 31 2 . 1 . . 1.353 . 4 1 1 34 LYS HG3 . . . . . . 269 . 25684 7 >> 31 2 . 2 . . 1.353 . 4 1 1 34 LYS HG2 . . . . . . 268 . 25684 7 >> 32 1 . 1 . . 8.081 . 4 1 1 34 LYS H . . . . . . 29 . 25684 7 >> 32 2 . 1 . . 7.928 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 33 1 . 1 . . 7.923 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 33 2 . 1 . . 4.274 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 7 >> 34 1 . 1 . . 8.356 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 34 2 . 1 . . 4.274 . 4 1 1 34 LYS HA . . . . . . 266 . 25684 7 >> 35 1 . 1 . . 7.923 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 35 2 . 1 . . 4.078 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 7 >> 36 1 . 1 . . 7.923 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 36 2 . 1 . . 2.206 . 4 1 1 35 GLU HG2 . . . . . . 277 . 25684 7 >> 37 1 . 1 . . 7.923 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 37 2 . 1 . . 1.995 . 4 1 1 35 GLU HG3 . . . . . . 413 . 25684 7 >> 38 1 . 1 . . 7.923 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 38 2 . 1 . . 1.827 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 7 >> 38 2 . 2 . . 1.827 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 7 >> 39 1 . 1 . . 7.924 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 39 2 . 1 . . 1.675 . 4 1 1 34 LYS HB2 . . . . . . 272 . 25684 7 >> 40 1 . 1 . . 7.923 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 40 2 . 1 . . 1.609 . 4 1 1 33 LEU HB3 . . . . . . 262 . 25684 7 >> 41 1 . 1 . . 7.923 . 4 1 1 35 GLU H . . . . . . 39 . 25684 7 >> 41 2 . 1 . . 8.085 . 4 1 1 34 LYS H . . . . . . 29 . 25684 7 >> 42 1 . 1 . . 8.355 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 42 2 . 1 . . 8.130 . 4 1 1 31 SER H . . . . . . 99 . 25684 7 >> 43 1 . 1 . . 8.267 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 43 2 . 1 . . 8.130 . 4 1 1 31 SER H . . . . . . 99 . 25684 7 >> 44 1 . 1 . . 8.266 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 44 2 . 1 . . 8.058 . 4 1 1 29 SER H . . . . . . 119 . 25684 7 >> 45 1 . 1 . . 8.126 . 4 1 1 31 SER H . . . . . . 99 . 25684 7 >> 45 2 . 1 . . 8.271 . 4 1 1 30 THR H . . . . . . 129 . 25684 7 >> 46 1 . 1 . . 8.126 . 4 1 1 31 SER H . . . . . . 99 . 25684 7 >> 46 2 . 1 . . 8.361 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 47 1 . 1 . . 8.073 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 47 2 . 1 . . 8.361 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 48 1 . 1 . . 8.355 . 4 1 1 32 HIS H . . . . . . 337 . 25684 7 >> 48 2 . 1 . . 8.079 . 4 1 1 33 LEU H . . . . . . 27 . 25684 7 >> 49 1 . 1 . . 8.108 . 4 1 1 28 THR H . . . . . . 124 . 25684 7 >> 49 2 . 1 . . 1.109 . 4 1 1 28 THR MG . . . . . . 250 . 25684 7 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3_4_5_6_7_8 _Saveframe_category spectral_peak_list _Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_5.peaks.' _Experiment_label '2D 1H-1H NOESY' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H stop_ _Sample_label $wr18_39 _Sample_conditions_label $2 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3_4_5_6_7_8 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6_7_8 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 8 >> _Spectral_peak_list.Sample_ID 3 >> _Spectral_peak_list.Sample_label $wr18_39 >> _Spectral_peak_list.Sample_condition_list_ID 2 >> _Spectral_peak_list.Sample_condition_list_label $2 >> _Spectral_peak_list.Experiment_ID 11 >> _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_5.peaks.' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 11718.75 Hz . . . 25684 8 >> 2 H 1 1H . . 11718.75 Hz . . . 25684 8 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 'Original number 1' 25684 8 >> 10 1.0 'Original number 10' 25684 8 >> 11 1.0 'Original number 11' 25684 8 >> 12 1.0 'Original number 12' 25684 8 >> 13 1.0 'Original number 13' 25684 8 >> 14 1.0 'Original number 14' 25684 8 >> 15 1.0 'Original number 15' 25684 8 >> 16 1.0 'Original number 17' 25684 8 >> 17 1.0 'Original number 18' 25684 8 >> 18 1.0 'Original number 19' 25684 8 >> 19 1.0 'Original number 20' 25684 8 >> 2 1.0 'Original number 2' 25684 8 >> 20 1.0 'Original number 21' 25684 8 >> 21 1.0 'Original number 22' 25684 8 >> 22 1.0 'Original number 23' 25684 8 >> 23 1.0 'Original number 24' 25684 8 >> 24 1.0 'Original number 25' 25684 8 >> 25 1.0 'Original number 26' 25684 8 >> 26 1.0 'Original number 28' 25684 8 >> 27 1.0 'Original number 30' 25684 8 >> 28 1.0 'Original number 31' 25684 8 >> 29 1.0 'Original number 32' 25684 8 >> 3 1.0 'Original number 3' 25684 8 >> 30 1.0 'Original number 33' 25684 8 >> 31 1.0 'Original number 34' 25684 8 >> 32 1.0 'Original number 35' 25684 8 >> 33 1.0 'Original number 36' 25684 8 >> 34 1.0 'Original number 37' 25684 8 >> 35 1.0 'Original number 42' 25684 8 >> 36 1.0 'Original number 43' 25684 8 >> 37 1.0 'Original number 44' 25684 8 >> 38 1.0 'Original number 45' 25684 8 >> 39 1.0 'Original number 46' 25684 8 >> 4 1.0 'Original number 4' 25684 8 >> 40 1.0 'Original number 50' 25684 8 >> 41 1.0 'Original number 53' 25684 8 >> 42 1.0 'Original number 54' 25684 8 >> 43 1.0 'Original number 55' 25684 8 >> 44 1.0 'Original number 56' 25684 8 >> 45 1.0 'Original number 57' 25684 8 >> 46 1.0 'Original number 59' 25684 8 >> 47 1.0 'Original number 60' 25684 8 >> 48 1.0 'Original number 62' 25684 8 >> 5 1.0 'Original number 5' 25684 8 >> 6 1.0 'Original number 6' 25684 8 >> 7 1.0 'Original number 7' 25684 8 >> 8 1.0 'Original number 8' 25684 8 >> 9 1.0 'Original number 9' 25684 8 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 2200867.750 . height 25684 8 >> 1 17845407.500 . volume 25684 8 >> 2 7421599.000 . height 25684 8 >> 2 61400155.500 . volume 25684 8 >> 3 4085420.500 . height 25684 8 >> 3 33078709.250 . volume 25684 8 >> 4 8663366.000 . height 25684 8 >> 4 69827887.000 . volume 25684 8 >> 5 2958596.500 . height 25684 8 >> 5 23415301.250 . volume 25684 8 >> 6 8211172.500 . height 25684 8 >> 6 64108692.000 . volume 25684 8 >> 7 2810247.750 . height 25684 8 >> 7 18374341.625 . volume 25684 8 >> 8 5320651.000 . height 25684 8 >> 8 40410448.000 . volume 25684 8 >> 9 40494648.000 . height 25684 8 >> 9 331176338.000 . volume 25684 8 >> 10 2972470.000 . height 25684 8 >> 10 24386638.250 . volume 25684 8 >> 11 2640403.000 . height 25684 8 >> 11 21795267.500 . volume 25684 8 >> 12 13394435.000 . height 25684 8 >> 12 105908631.000 . volume 25684 8 >> 13 13438678.000 . height 25684 8 >> 13 103573027.000 . volume 25684 8 >> 14 17022760.000 . height 25684 8 >> 14 132296673.000 . volume 25684 8 >> 15 19775460.000 . height 25684 8 >> 15 164170030.000 . volume 25684 8 >> 16 3812267.750 . height 25684 8 >> 16 31362642.000 . volume 25684 8 >> 17 1900173.375 . height 25684 8 >> 17 16376190.250 . volume 25684 8 >> 18 14006741.000 . height 25684 8 >> 18 118225006.000 . volume 25684 8 >> 19 6822586.500 . height 25684 8 >> 19 57239823.000 . volume 25684 8 >> 20 4681675.500 . height 25684 8 >> 20 40818706.500 . volume 25684 8 >> 21 3276141.000 . height 25684 8 >> 21 27483443.000 . volume 25684 8 >> 22 3146622.750 . height 25684 8 >> 22 26550783.000 . volume 25684 8 >> 23 6245800.000 . height 25684 8 >> 23 52674332.500 . volume 25684 8 >> 24 26595754.000 . height 25684 8 >> 24 226849848.000 . volume 25684 8 >> 25 43350392.000 . height 25684 8 >> 25 371359460.000 . volume 25684 8 >> 26 1977225.875 . height 25684 8 >> 26 17605046.000 . volume 25684 8 >> 27 9309623.000 . height 25684 8 >> 27 77395431.000 . volume 25684 8 >> 28 2538453.750 . height 25684 8 >> 28 21971961.750 . volume 25684 8 >> 29 4413604.500 . height 25684 8 >> 29 36073394.750 . volume 25684 8 >> 30 8016032.000 . height 25684 8 >> 30 69144510.500 . volume 25684 8 >> 31 6191926.000 . height 25684 8 >> 31 51297873.500 . volume 25684 8 >> 32 5198444.500 . height 25684 8 >> 32 44751127.500 . volume 25684 8 >> 33 9928585.000 . height 25684 8 >> 33 81808849.500 . volume 25684 8 >> 34 2026353.250 . height 25684 8 >> 34 18352323.750 . volume 25684 8 >> 35 8016676.500 . height 25684 8 >> 35 67654470.000 . volume 25684 8 >> 36 11084631.000 . height 25684 8 >> 36 91609526.000 . volume 25684 8 >> 37 62885572.000 . height 25684 8 >> 37 515844020.000 . volume 25684 8 >> 38 139821968.000 . height 25684 8 >> 38 1106694184.000 . volume 25684 8 >> 39 4260602.500 . height 25684 8 >> 39 34960375.000 . volume 25684 8 >> 40 74352504.000 . height 25684 8 >> 40 625405800.000 . volume 25684 8 >> 41 29812594.000 . height 25684 8 >> 41 250152416.000 . volume 25684 8 >> 42 3911349.250 . height 25684 8 >> 42 31832865.250 . volume 25684 8 >> 43 2782787.750 . height 25684 8 >> 43 24255204.500 . volume 25684 8 >> 44 2225821.250 . height 25684 8 >> 44 19927048.000 . volume 25684 8 >> 45 3048135.750 . height 25684 8 >> 45 24387074.750 . volume 25684 8 >> 46 1688805.750 . height 25684 8 >> 46 15599531.125 . volume 25684 8 >> 47 2534412.000 . height 25684 8 >> 47 19950894.000 . volume 25684 8 >> 48 2716680.250 . height 25684 8 >> 48 22509053.750 . volume 25684 8 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 4.195 . 30.3257256746 . . . . . . . . . . 2 25684 8 >> 1 2 0.699 . 26.9415322691 . . . . . . . . . . 2 25684 8 >> 2 1 3.956 . 26.1696986854 . . . . . . . . . . 2 25684 8 >> 2 2 0.531 . 24.1524539888 . . . . . . . . . . 2 25684 8 >> 3 1 3.953 . 28.1939283013 . . . . . . . . . . 2 25684 8 >> 3 2 0.675 . 29.4246710837 . . . . . . . . . . 2 25684 8 >> 4 1 4.262 . 19.6478795260 . . . . . . . . . . 2 25684 8 >> 4 2 1.127 . 25.6018247455 . . . . . . . . . . 2 25684 8 >> 5 1 4.269 . 11.6808805615 . . . . . . . . . . 2 25684 8 >> 5 2 3.735 . 32.4218999594 . . . . . . . . . . 2 25684 8 >> 6 1 4.171 . 15.2578577399 . . . . . . . . . . 2 25684 8 >> 6 2 1.177 . 24.2837704718 . . . . . . . . . . 2 25684 8 >> 7 1 4.077 . 13.2455024868 . . . . . . . . . . 2 25684 8 >> 7 2 1.996 . 28.6905560642 . . . . . . . . . . 2 25684 8 >> 8 1 4.077 . 12.0894983411 . . . . . . . . . . 2 25684 8 >> 8 2 1.826 . 33.1406481564 . . . . . . . . . . 2 25684 8 >> 9 1 3.894 . 22.7694399655 . . . . . . . . . . 2 25684 8 >> 9 2 3.751 . 33.2656782120 . . . . . . . . . . 2 25684 8 >> 10 1 3.956 . 27.8949737549 . . . . . . . . . . 2 25684 8 >> 10 2 1.391 . 32.0537947118 . . . . . . . . . . 2 25684 8 >> 11 1 3.957 . 34.3420542777 . . . . . . . . . . 2 25684 8 >> 11 2 1.263 . 32.2039704770 . . . . . . . . . . 2 25684 8 >> 12 1 4.126 . 20.4322859645 . . . . . . . . . . 2 25684 8 >> 12 2 1.133 . 23.2185702771 . . . . . . . . . . 2 25684 8 >> 13 1 3.973 . 15.4604203999 . . . . . . . . . . 2 25684 8 >> 13 2 1.177 . 22.5487165153 . . . . . . . . . . 2 25684 8 >> 14 1 3.918 . 17.2178260982 . . . . . . . . . . 2 25684 8 >> 14 2 1.132 . 24.4402326643 . . . . . . . . . . 2 25684 8 >> 15 1 3.736 . 25.4921615124 . . . . . . . . . . 2 25684 8 >> 15 2 1.939 . 32.7117741108 . . . . . . . . . . 2 25684 8 >> 16 1 3.736 . 26.0041560978 . . . . . . . . . . 2 25684 8 >> 16 2 2.299 . 53.8090243936 . . . . . . . . . . 2 25684 8 >> 17 1 3.736 . 24.9131117016 . . . . . . . . . . 2 25684 8 >> 17 2 2.710 . 26.5398994088 . . . . . . . . . . 2 25684 8 >> 18 1 3.588 . 29.9031380564 . . . . . . . . . . 2 25684 8 >> 18 2 3.159 . 32.4037391692 . . . . . . . . . . 2 25684 8 >> 19 1 3.588 . 31.3636846840 . . . . . . . . . . 2 25684 8 >> 19 2 1.614 . 31.6046644002 . . . . . . . . . . 2 25684 8 >> 20 1 3.588 . 33.4242358804 . . . . . . . . . . 2 25684 8 >> 20 2 1.368 . 37.8184486181 . . . . . . . . . . 2 25684 8 >> 21 1 3.588 . 27.6581849903 . . . . . . . . . . 2 25684 8 >> 21 2 1.263 . 35.3869982064 . . . . . . . . . . 2 25684 8 >> 22 1 3.588 . 34.5334410667 . . . . . . . . . . 2 25684 8 >> 22 2 0.764 . 30.4416753352 . . . . . . . . . . 2 25684 8 >> 23 1 3.589 . 31.1052426696 . . . . . . . . . . 2 25684 8 >> 23 2 0.701 . 30.6309666485 . . . . . . . . . . 2 25684 8 >> 24 1 3.374 . 39.0778295696 . . . . . . . . . . 2 25684 8 >> 24 2 3.159 . 38.5700259358 . . . . . . . . . . 2 25684 8 >> 25 1 3.315 . 38.5330058634 . . . . . . . . . . 2 25684 8 >> 25 2 3.196 . 34.9001493305 . . . . . . . . . . 2 25684 8 >> 26 1 3.162 . 30.1867257804 . . . . . . . . . . 2 25684 8 >> 26 2 2.269 . 27.2034667432 . . . . . . . . . . 2 25684 8 >> 27 1 3.162 . 31.3580967486 . . . . . . . . . . 2 25684 8 >> 27 2 1.614 . 30.7497102767 . . . . . . . . . . 2 25684 8 >> 28 1 3.162 . 31.9748651236 . . . . . . . . . . 2 25684 8 >> 28 2 1.517 . 76.5547156334 . . . . . . . . . . 2 25684 8 >> 29 1 3.162 . 29.9799721688 . . . . . . . . . . 2 25684 8 >> 29 2 1.471 . 64.6356493235 . . . . . . . . . . 2 25684 8 >> 30 1 3.162 . 32.5217843056 . . . . . . . . . . 2 25684 8 >> 30 2 1.368 . 34.2617277056 . . . . . . . . . . 2 25684 8 >> 31 1 3.162 . 30.3012784570 . . . . . . . . . . 2 25684 8 >> 31 2 1.262 . 32.8577589244 . . . . . . . . . . 2 25684 8 >> 32 1 3.162 . 36.1623242497 . . . . . . . . . . 2 25684 8 >> 32 2 0.766 . 29.5566860586 . . . . . . . . . . 2 25684 8 >> 33 1 3.162 . 32.6531007886 . . . . . . . . . . 2 25684 8 >> 33 2 0.699 . 27.7273356915 . . . . . . . . . . 2 25684 8 >> 34 1 3.060 . 42.0715659857 . . . . . . . . . . 2 25684 8 >> 34 2 0.808 . 24.4891270995 . . . . . . . . . . 2 25684 8 >> 35 1 1.956 . 35.0943300873 . . . . . . . . . . 2 25684 8 >> 35 2 1.368 . 34.8100438714 . . . . . . . . . . 2 25684 8 >> 36 1 1.958 . 36.4668667316 . . . . . . . . . . 2 25684 8 >> 36 2 1.615 . 31.1394687742 . . . . . . . . . . 2 25684 8 >> 37 1 2.309 . 28.9867166430 . . . . . . . . . . 2 25684 8 >> 37 2 1.937 . 33.2642812282 . . . . . . . . . . 2 25684 8 >> 38 1 2.002 . 20.4246025532 . . . . . . . . . . 2 25684 8 >> 38 2 1.830 . 25.5508348346 . . . . . . . . . . 2 25684 8 >> 39 1 3.160 . 27.1706376225 . . . . . . . . . . 2 25684 8 >> 39 2 1.952 . 31.3692726195 . . . . . . . . . . 2 25684 8 >> 40 1 1.618 . 22.2839880735 . . . . . . . . . . 2 25684 8 >> 40 2 1.369 . 38.6985484511 . . . . . . . . . . 2 25684 8 >> 41 1 2.715 . 34.1618433595 . . . . . . . . . . 2 25684 8 >> 41 2 2.268 . 30.5492430925 . . . . . . . . . . 2 25684 8 >> 42 1 2.715 . 33.2908239216 . . . . . . . . . . 2 25684 8 >> 42 2 0.767 . 27.9054511338 . . . . . . . . . . 2 25684 8 >> 43 1 2.715 . 38.5532621294 . . . . . . . . . . 2 25684 8 >> 43 2 0.699 . 35.3918876499 . . . . . . . . . . 2 25684 8 >> 44 1 2.280 . 46.2639145553 . . . . . . . . . . 2 25684 8 >> 44 2 0.698 . 38.0189158022 . . . . . . . . . . 2 25684 8 >> 45 1 2.280 . 43.3777458966 . . . . . . . . . . 2 25684 8 >> 45 2 0.767 . 27.0742457360 . . . . . . . . . . 2 25684 8 >> 46 1 2.280 . 45.2420208603 . . . . . . . . . . 2 25684 8 >> 46 2 1.368 . 41.4184760302 . . . . . . . . . . 2 25684 8 >> 47 1 2.279 . 56.0148619115 . . . . . . . . . . 2 25684 8 >> 47 2 1.613 . 27.1413009614 . . . . . . . . . . 2 25684 8 >> 48 1 3.589 . 37.4377705157 . . . . . . . . . . 2 25684 8 >> 48 2 1.473 . 70.1097305864 . . . . . . . . . . 2 25684 8 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 4.195 . 4 1 1 22 LEU HA . . . . . . 387 . 25684 8 >> 1 2 . 1 . . 0.699 . 4 1 1 22 LEU MD2 . . . . . . 414 . 25684 8 >> 2 1 . 1 . . 3.956 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 8 >> 2 2 . 1 . . 0.531 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 8 >> 3 1 . 1 . . 3.953 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 8 >> 3 2 . 1 . . 0.675 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 8 >> 4 1 . 1 . . 4.262 . 4 1 1 30 THR HA . . . . . . 325 . 25684 8 >> 4 2 . 1 . . 1.127 . 4 1 1 30 THR MG . . . . . . 256 . 25684 8 >> 5 1 . 1 . . 4.269 . 4 1 1 31 SER HA . . . . . . 326 . 25684 8 >> 5 2 . 1 . . 3.735 . 4 1 1 31 SER HB2 . . . . . . 291 . 25684 8 >> 6 1 . 1 . . 4.171 . 4 1 1 24 THR HB . . . . . . 296 . 25684 8 >> 6 2 . 1 . . 1.177 . 4 1 1 24 THR MG . . . . . . 402 . 25684 8 >> 7 1 . 1 . . 4.077 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 8 >> 7 2 . 1 . . 1.996 . 4 1 1 35 GLU HG3 . . . . . . 413 . 25684 8 >> 8 1 . 1 . . 4.077 . 4 1 1 35 GLU HA . . . . . . 274 . 25684 8 >> 8 2 . 1 . . 1.826 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 8 >> 8 2 . 2 . . 1.826 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 8 >> 9 1 . 1 . . 3.894 . 4 1 1 29 SER HB2 . . . . . . 252 . 25684 8 >> 9 2 . 1 . . 3.751 . 4 1 1 29 SER HB3 . . . . . . 253 . 25684 8 >> 10 1 . 1 . . 3.956 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 8 >> 10 2 . 1 . . 1.391 . 4 1 1 18 LEU HB3 . . . . . . 355 . 25684 8 >> 11 1 . 1 . . 3.957 . 4 1 1 18 LEU HA . . . . . . 229 . 25684 8 >> 11 2 . 1 . . 1.263 . 4 1 1 18 LEU HB2 . . . . . . 230 . 25684 8 >> 12 1 . 1 . . 4.126 . 4 1 1 19 THR HB . . . . . . 314 . 25684 8 >> 12 2 . 1 . . 1.133 . 4 1 1 19 THR MG . . . . . . 317 . 25684 8 >> 13 1 . 1 . . 3.973 . 4 1 1 24 THR HA . . . . . . 401 . 25684 8 >> 13 2 . 1 . . 1.177 . 4 1 1 24 THR MG . . . . . . 402 . 25684 8 >> 14 1 . 1 . . 3.918 . 4 1 1 19 THR HA . . . . . . 233 . 25684 8 >> 14 2 . 1 . . 1.132 . 4 1 1 19 THR MG . . . . . . 317 . 25684 8 >> 15 1 . 1 . . 3.736 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 8 >> 15 1 . 2 . . 3.736 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 8 >> 15 2 . 1 . . 1.939 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 8 >> 15 2 . 2 . . 1.939 . 4 1 1 27 PRO HG2 . . . . . . 394 . 25684 8 >> 16 1 . 1 . . 3.736 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 8 >> 16 1 . 2 . . 3.736 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 8 >> 16 2 . 1 . . 2.299 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 8 >> 16 2 . 2 . . 2.299 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 8 >> 17 1 . 1 . . 3.736 . 4 1 1 27 PRO HD3 . . . . . . 357 . 25684 8 >> 17 1 . 2 . . 3.736 . 4 1 1 27 PRO HD2 . . . . . . 245 . 25684 8 >> 17 2 . 1 . . 2.710 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 8 >> 18 1 . 1 . . 3.588 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 8 >> 18 1 . 2 . . 3.588 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 8 >> 18 2 . 1 . . 3.159 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 19 1 . 1 . . 3.588 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 8 >> 19 1 . 2 . . 3.588 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 8 >> 19 2 . 1 . . 1.614 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 19 2 . 2 . . 1.614 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 20 1 . 1 . . 3.588 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 8 >> 20 1 . 2 . . 3.588 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 8 >> 20 2 . 1 . . 1.368 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 8 >> 20 2 . 2 . . 1.368 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 8 >> 21 1 . 1 . . 3.588 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 8 >> 21 1 . 2 . . 3.588 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 8 >> 21 2 . 1 . . 1.263 . 4 1 1 22 LEU HG . . . . . . 370 . 25684 8 >> 22 1 . 1 . . 3.588 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 8 >> 22 1 . 2 . . 3.588 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 8 >> 22 2 . 1 . . 0.764 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 8 >> 22 2 . 2 . . 0.764 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 8 >> 23 1 . 1 . . 3.589 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 8 >> 23 1 . 2 . . 3.589 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 8 >> 23 2 . 1 . . 0.701 . 4 1 1 22 LEU MD2 . . . . . . 414 . 25684 8 >> 24 1 . 1 . . 3.374 . 4 1 1 25 TRP HB2 . . . . . . 242 . 25684 8 >> 24 2 . 1 . . 3.159 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 25 1 . 1 . . 3.315 . 4 1 1 17 TRP HB2 . . . . . . 228 . 25684 8 >> 25 2 . 1 . . 3.196 . 4 1 1 17 TRP HB3 . . . . . . 386 . 25684 8 >> 26 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 26 2 . 1 . . 2.269 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 8 >> 27 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 27 2 . 1 . . 1.614 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 27 2 . 2 . . 1.614 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 28 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 28 2 . 1 . . 1.517 . 4 1 1 22 LEU HB3 . . . . . . 362 . 25684 8 >> 29 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 29 2 . 1 . . 1.471 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 8 >> 30 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 30 2 . 1 . . 1.368 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 8 >> 30 2 . 2 . . 1.368 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 8 >> 31 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 31 2 . 1 . . 1.262 . 4 1 1 22 LEU HG . . . . . . 370 . 25684 8 >> 32 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 32 2 . 1 . . 0.766 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 8 >> 32 2 . 2 . . 0.766 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 8 >> 33 1 . 1 . . 3.162 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 33 2 . 1 . . 0.699 . 4 1 1 22 LEU MD2 . . . . . . 414 . 25684 8 >> 34 1 . 1 . . 3.060 . 4 1 1 32 HIS HB3 . . . . . . 259 . 25684 8 >> 34 2 . 1 . . 0.808 . 4 1 1 33 LEU MD2 . . . . . . 265 . 25684 8 >> 35 1 . 1 . . 1.956 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 35 1 . 2 . . 1.956 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 35 2 . 1 . . 1.368 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 8 >> 35 2 . 2 . . 1.368 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 8 >> 36 1 . 1 . . 1.958 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 36 1 . 2 . . 1.958 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 36 2 . 1 . . 1.615 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 36 2 . 2 . . 1.615 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 37 1 . 1 . . 2.309 . 4 1 1 27 PRO HB3 . . . . . . 247 . 25684 8 >> 37 1 . 2 . . 2.309 . 4 1 1 27 PRO HB2 . . . . . . 246 . 25684 8 >> 37 2 . 1 . . 1.937 . 4 1 1 27 PRO HG3 . . . . . . 395 . 25684 8 >> 37 2 . 2 . . 1.937 . 4 1 1 27 PRO HG2 . . . . . . 394 . 25684 8 >> 38 1 . 1 . . 2.002 . 4 1 1 35 GLU HG3 . . . . . . 413 . 25684 8 >> 38 2 . 1 . . 1.830 . 4 1 1 35 GLU HB3 . . . . . . 276 . 25684 8 >> 38 2 . 2 . . 1.830 . 4 1 1 35 GLU HB2 . . . . . . 275 . 25684 8 >> 39 1 . 1 . . 3.160 . 4 1 1 25 TRP HB3 . . . . . . 243 . 25684 8 >> 39 2 . 1 . . 1.952 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 39 2 . 2 . . 1.952 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 40 1 . 1 . . 1.618 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 40 1 . 2 . . 1.618 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 40 2 . 1 . . 1.369 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 8 >> 40 2 . 2 . . 1.369 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 8 >> 41 1 . 1 . . 2.715 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 8 >> 41 2 . 1 . . 2.268 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 8 >> 42 1 . 1 . . 2.715 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 8 >> 42 2 . 1 . . 0.767 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 8 >> 42 2 . 2 . . 0.767 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 8 >> 43 1 . 1 . . 2.715 . 4 1 1 26 CYS HB2 . . . . . . 290 . 25684 8 >> 43 2 . 1 . . 0.699 . 4 1 1 22 LEU MD2 . . . . . . 414 . 25684 8 >> 44 1 . 1 . . 2.280 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 8 >> 44 2 . 1 . . 0.698 . 4 1 1 22 LEU MD2 . . . . . . 414 . 25684 8 >> 45 1 . 1 . . 2.280 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 8 >> 45 2 . 1 . . 0.767 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 8 >> 45 2 . 2 . . 0.767 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 8 >> 46 1 . 1 . . 2.280 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 8 >> 46 2 . 1 . . 1.368 . 4 1 1 23 PRO HG2 . . . . . . 331 . 25684 8 >> 46 2 . 2 . . 1.368 . 4 1 1 23 PRO HG3 . . . . . . 342 . 25684 8 >> 47 1 . 1 . . 2.279 . 4 1 1 26 CYS HB3 . . . . . . 396 . 25684 8 >> 47 2 . 1 . . 1.613 . 4 1 1 23 PRO HB2 . . . . . . 372 . 25684 8 >> 47 2 . 2 . . 1.613 . 4 1 1 23 PRO HB3 . . . . . . 373 . 25684 8 >> 48 1 . 1 . . 3.589 . 4 1 1 23 PRO HD3 . . . . . . 388 . 25684 8 >> 48 1 . 2 . . 3.589 . 4 1 1 23 PRO HD2 . . . . . . 375 . 25684 8 >> 48 2 . 1 . . 1.473 . 4 1 1 22 LEU HB2 . . . . . . 309 . 25684 8 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3_4_5_6_7_8_9 _Saveframe_category spectral_peak_list _Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_6.peaks.' _Experiment_label '2D 1H-1H NOESY' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 H 1H stop_ _Sample_label $wr18_39 _Sample_conditions_label $2 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3_4_5_6_7_8_9 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6_7_8_9 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 9 >> _Spectral_peak_list.Sample_ID 3 >> _Spectral_peak_list.Sample_label $wr18_39 >> _Spectral_peak_list.Sample_condition_list_ID 2 >> _Spectral_peak_list.Sample_condition_list_label $2 >> _Spectral_peak_list.Experiment_ID 11 >> _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Details 'cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_6.peaks.' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 11718.75 Hz . . . 25684 9 >> 2 H 1 1H . . 11718.75 Hz . . . 25684 9 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 'Original number 1' 25684 9 >> 10 1.0 'Original number 11' 25684 9 >> 11 1.0 'Original number 12' 25684 9 >> 12 1.0 'Original number 13' 25684 9 >> 13 1.0 'Original number 14' 25684 9 >> 14 1.0 'Original number 15' 25684 9 >> 15 1.0 'Original number 16' 25684 9 >> 16 1.0 'Original number 17' 25684 9 >> 17 1.0 'Original number 18' 25684 9 >> 18 1.0 'Original number 19' 25684 9 >> 19 1.0 'Original number 20' 25684 9 >> 2 1.0 'Original number 2' 25684 9 >> 20 1.0 'Original number 22' 25684 9 >> 3 1.0 'Original number 3' 25684 9 >> 4 1.0 'Original number 4' 25684 9 >> 5 1.0 'Original number 5' 25684 9 >> 6 1.0 'Original number 7' 25684 9 >> 7 1.0 'Original number 8' 25684 9 >> 8 1.0 'Original number 9' 25684 9 >> 9 1.0 'Original number 10' 25684 9 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 2259896.000 . height 25684 9 >> 1 17056784.125 . volume 25684 9 >> 2 2269223.250 . height 25684 9 >> 2 18091388.500 . volume 25684 9 >> 3 8182308.500 . height 25684 9 >> 3 63711782.000 . volume 25684 9 >> 4 9186619.000 . height 25684 9 >> 4 70636152.000 . volume 25684 9 >> 5 2315121.500 . height 25684 9 >> 5 18805776.500 . volume 25684 9 >> 6 3489491.750 . height 25684 9 >> 6 29463883.000 . volume 25684 9 >> 7 3361936.000 . height 25684 9 >> 7 27967492.500 . volume 25684 9 >> 8 11279039.000 . height 25684 9 >> 8 89514078.000 . volume 25684 9 >> 9 11108512.000 . height 25684 9 >> 9 87976489.500 . volume 25684 9 >> 10 10891087.000 . height 25684 9 >> 10 81549519.000 . volume 25684 9 >> 11 12260803.000 . height 25684 9 >> 11 87443139.000 . volume 25684 9 >> 12 10553473.000 . height 25684 9 >> 12 73059444.500 . volume 25684 9 >> 13 3393611.500 . height 25684 9 >> 13 27054747.000 . volume 25684 9 >> 14 5096278.000 . height 25684 9 >> 14 40495583.750 . volume 25684 9 >> 15 6396971.500 . height 25684 9 >> 15 49866160.500 . volume 25684 9 >> 16 6145651.500 . height 25684 9 >> 16 44948482.250 . volume 25684 9 >> 17 3253346.000 . height 25684 9 >> 17 23042259.000 . volume 25684 9 >> 18 2098633.750 . height 25684 9 >> 18 17611833.625 . volume 25684 9 >> 19 4807763.000 . height 25684 9 >> 19 35200783.500 . volume 25684 9 >> 20 1890770.875 . height 25684 9 >> 20 15703446.500 . volume 25684 9 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 8.359 . 13.9452167787 . . . . . . . . . . 2 25684 9 >> 1 2 0.675 . 27.0616728812 . . . . . . . . . . 2 25684 9 >> 2 1 8.359 . 17.2871514224 . . . . . . . . . . 2 25684 9 >> 2 2 0.529 . 27.7440994978 . . . . . . . . . . 2 25684 9 >> 3 1 7.983 . 20.2655210160 . . . . . . . . . . 2 25684 9 >> 3 2 0.672 . 24.7091520578 . . . . . . . . . . 2 25684 9 >> 4 1 7.982 . 18.4827949852 . . . . . . . . . . 2 25684 9 >> 4 2 0.528 . 23.9233486354 . . . . . . . . . . 2 25684 9 >> 5 1 7.722 . 27.3057958111 . . . . . . . . . . 2 25684 9 >> 5 2 0.527 . 27.1496828645 . . . . . . . . . . 2 25684 9 >> 6 1 7.724 . 23.9949440584 . . . . . . . . . . 2 25684 9 >> 6 2 0.700 . 41.0350039601 . . . . . . . . . . 2 25684 9 >> 7 1 7.723 . 20.7176199183 . . . . . . . . . . 2 25684 9 >> 7 2 0.766 . 27.0819291472 . . . . . . . . . . 2 25684 9 >> 8 1 7.257 . 18.5962999240 . . . . . . . . . . 2 25684 9 >> 8 2 0.700 . 28.1652901322 . . . . . . . . . . 2 25684 9 >> 9 1 7.256 . 19.4512540475 . . . . . . . . . . 2 25684 9 >> 9 2 0.765 . 25.6109051406 . . . . . . . . . . 2 25684 9 >> 10 1 7.407 . 18.4737145901 . . . . . . . . . . 2 25684 9 >> 10 2 0.674 . 30.0274696201 . . . . . . . . . . 2 25684 9 >> 11 1 7.407 . 16.0813797265 . . . . . . . . . . 2 25684 9 >> 11 2 0.528 . 25.4705082625 . . . . . . . . . . 2 25684 9 >> 12 1 7.167 . 8.9833047241 . . . . . . . . . . 2 25684 9 >> 12 2 0.529 . 25.5808699876 . . . . . . . . . . 2 25684 9 >> 13 1 7.672 . 17.8398331627 . . . . . . . . . . 2 25684 9 >> 13 2 0.764 . 24.1280067712 . . . . . . . . . . 2 25684 9 >> 14 1 7.672 . 18.5575336218 . . . . . . . . . . 2 25684 9 >> 14 2 0.675 . 32.9660251737 . . . . . . . . . . 2 25684 9 >> 15 1 7.672 . 16.0590279847 . . . . . . . . . . 2 25684 9 >> 15 2 0.528 . 25.2462923527 . . . . . . . . . . 2 25684 9 >> 16 1 7.167 . 10.1689947769 . . . . . . . . . . 2 25684 9 >> 16 2 0.675 . 36.3690778613 . . . . . . . . . . 2 25684 9 >> 17 1 7.167 . 11.0354740173 . . . . . . . . . . 2 25684 9 >> 17 2 0.763 . 25.4181213677 . . . . . . . . . . 2 25684 9 >> 18 1 8.266 . 23.6996565945 . . . . . . . . . . 2 25684 9 >> 18 2 0.764 . 27.9766973108 . . . . . . . . . . 2 25684 9 >> 19 1 7.406 . 23.9666551352 . . . . . . . . . . 2 25684 9 >> 19 2 0.764 . 28.8302544504 . . . . . . . . . . 2 25684 9 >> 20 1 7.256 . 21.8554632738 . . . . . . . . . . 2 25684 9 >> 20 2 0.529 . 24.9962322414 . . . . . . . . . . 2 25684 9 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 8.359 . 4 1 1 17 TRP H . . . . . . 21 . 25684 9 >> 1 2 . 1 . . 0.675 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 9 >> 2 1 . 1 . . 8.359 . 4 1 1 17 TRP H . . . . . . 21 . 25684 9 >> 2 2 . 1 . . 0.529 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 9 >> 3 1 . 1 . . 7.983 . 4 1 1 18 LEU H . . . . . . 17 . 25684 9 >> 3 2 . 1 . . 0.672 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 9 >> 4 1 . 1 . . 7.982 . 4 1 1 18 LEU H . . . . . . 17 . 25684 9 >> 4 2 . 1 . . 0.528 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 9 >> 5 1 . 1 . . 7.722 . 4 1 1 21 TRP H . . . . . . 3 . 25684 9 >> 5 2 . 1 . . 0.527 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 9 >> 6 1 . 1 . . 7.724 . 4 1 1 21 TRP H . . . . . . 3 . 25684 9 >> 6 2 . 1 . . 0.700 . 4 1 1 22 LEU MD2 . . . . . . 414 . 25684 9 >> 7 1 . 1 . . 7.723 . 4 1 1 21 TRP H . . . . . . 3 . 25684 9 >> 7 2 . 1 . . 0.766 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 9 >> 7 2 . 2 . . 0.766 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 9 >> 8 1 . 1 . . 7.257 . 4 1 1 22 LEU H . . . . . . 158 . 25684 9 >> 8 2 . 1 . . 0.700 . 4 1 1 22 LEU MD2 . . . . . . 414 . 25684 9 >> 9 1 . 1 . . 7.256 . 4 1 1 22 LEU H . . . . . . 158 . 25684 9 >> 9 2 . 1 . . 0.765 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 9 >> 9 2 . 2 . . 0.765 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 9 >> 10 1 . 1 . . 7.407 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 9 >> 10 2 . 1 . . 0.674 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 9 >> 11 1 . 1 . . 7.407 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 9 >> 11 2 . 1 . . 0.528 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 9 >> 12 1 . 1 . . 7.167 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 9 >> 12 2 . 1 . . 0.529 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 9 >> 13 1 . 1 . . 7.672 . 4 1 1 19 THR H . . . . . . 1 . 25684 9 >> 13 2 . 1 . . 0.764 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 9 >> 13 2 . 2 . . 0.764 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 9 >> 14 1 . 1 . . 7.672 . 4 1 1 19 THR H . . . . . . 1 . 25684 9 >> 14 2 . 1 . . 0.675 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 9 >> 15 1 . 1 . . 7.672 . 4 1 1 19 THR H . . . . . . 1 . 25684 9 >> 15 2 . 1 . . 0.528 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 9 >> 16 1 . 1 . . 7.167 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 9 >> 16 2 . 1 . . 0.675 . 4 1 1 18 LEU MD2 . . . . . . 381 . 25684 9 >> 17 1 . 1 . . 7.167 . 4 1 1 21 TRP HD1 . . . . . . 405 . 25684 9 >> 17 2 . 1 . . 0.763 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 9 >> 17 2 . 2 . . 0.763 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 9 >> 18 1 . 1 . . 8.266 . 4 1 1 20 GLY H . . . . . . 313 . 25684 9 >> 18 2 . 1 . . 0.764 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 9 >> 18 2 . 2 . . 0.764 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 9 >> 19 1 . 1 . . 7.406 . 4 1 1 17 TRP HD1 . . . . . . 403 . 25684 9 >> 19 2 . 1 . . 0.764 . 4 1 1 22 LEU MD1 . . . . . . 408 . 25684 9 >> 19 2 . 2 . . 0.764 . 4 1 1 22 LEU MD2 . . . . . . 410 . 25684 9 >> 20 1 . 1 . . 7.256 . 4 1 1 22 LEU H . . . . . . 158 . 25684 9 >> 20 2 . 1 . . 0.529 . 4 1 1 18 LEU MD1 . . . . . . 341 . 25684 9 >> >> stop_ >> >>save_ >> ; save_ save_peak_list_1_2_3_4_5_6_7_8_9_10 _Saveframe_category spectral_peak_list _Details 'Default list' _Experiment_label '2D 1H-15N HSQC/HMQC' _Number_of_spectral_dimensions 2 loop_ _Expt_dimension_ID _Atom_type _Spectral_region 1 H 1H 2 N 15N stop_ _Sample_label $wr10_43_1 _Sample_conditions_label $1 _Text_data_format "NMR-STAR v3" _Text_data ; >>save_peak_list_1_2_3_4_5_6_7_8_9_10 >> _Spectral_peak_list.Sf_category spectral_peak_list >> _Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6_7_8_9_10 >> _Spectral_peak_list.Entry_ID 25684 >> _Spectral_peak_list.ID 10 >> _Spectral_peak_list.Sample_ID 1 >> _Spectral_peak_list.Sample_label $wr10_43_1 >> _Spectral_peak_list.Sample_condition_list_ID 1 >> _Spectral_peak_list.Sample_condition_list_label $1 >> _Spectral_peak_list.Experiment_ID 12 >> _Spectral_peak_list.Experiment_name '2D 1H-15N HSQC/HMQC' >> _Spectral_peak_list.Number_of_spectral_dimensions 2 >> _Spectral_peak_list.Details 'Default list' >> _Spectral_peak_list.Text_data_format . >> _Spectral_peak_list.Text_data . >> >> loop_ >> _Spectral_dim.ID >> _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.Center_frequency_offset >> _Spectral_dim.Encoding_code >> _Spectral_dim.Encoded_source_dimension_ID >> _Spectral_dim.Entry_ID >> _Spectral_dim.Spectral_peak_list_ID >> >> 1 H 1 1H . . 5580.35693359 Hz . . . 25684 10 >> 2 N 15 15N . . 1772.53698730 Hz . . . 25684 10 >> >> stop_ >> >> loop_ >> _Peak.ID >> _Peak.Figure_of_merit >> _Peak.Details >> _Peak.Entry_ID >> _Peak.Spectral_peak_list_ID >> >> 1 1.0 . 25684 10 >> 10 1.0 . 25684 10 >> 11 1.0 . 25684 10 >> 12 1.0 . 25684 10 >> 13 1.0 . 25684 10 >> 14 1.0 . 25684 10 >> 15 1.0 . 25684 10 >> 16 1.0 . 25684 10 >> 17 1.0 . 25684 10 >> 18 1.0 . 25684 10 >> 19 1.0 . 25684 10 >> 2 1.0 . 25684 10 >> 20 1.0 . 25684 10 >> 21 1.0 . 25684 10 >> 22 1.0 . 25684 10 >> 23 1.0 . 25684 10 >> 24 1.0 . 25684 10 >> 25 1.0 . 25684 10 >> 26 1.0 . 25684 10 >> 27 1.0 . 25684 10 >> 28 1.0 . 25684 10 >> 29 1.0 . 25684 10 >> 3 1.0 . 25684 10 >> 30 1.0 . 25684 10 >> 31 1.0 . 25684 10 >> 32 1.0 . 25684 10 >> 33 1.0 . 25684 10 >> 34 1.0 . 25684 10 >> 35 1.0 . 25684 10 >> 36 1.0 . 25684 10 >> 37 1.0 . 25684 10 >> 4 1.0 . 25684 10 >> 5 1.0 . 25684 10 >> 6 1.0 . 25684 10 >> 7 1.0 . 25684 10 >> 8 1.0 . 25684 10 >> 9 1.0 . 25684 10 >> >> stop_ >> >> loop_ >> _Peak_general_char.Peak_ID >> _Peak_general_char.Intensity_val >> _Peak_general_char.Intensity_val_err >> _Peak_general_char.Measurement_method >> _Peak_general_char.Entry_ID >> _Peak_general_char.Spectral_peak_list_ID >> >> 1 90313.2500000 . height 25684 10 >> 1 669508.8945310 . volume 25684 10 >> 2 36800.1484375 . height 25684 10 >> 2 286566.6640620 . volume 25684 10 >> 3 417636.3750000 . height 25684 10 >> 3 2569430.3593800 . volume 25684 10 >> 4 864797.4375000 . height 25684 10 >> 4 4608990.0625000 . volume 25684 10 >> 5 2330669.7500000 . height 25684 10 >> 5 10424585.3438000 . volume 25684 10 >> 6 3932420.2500000 . height 25684 10 >> 6 19577962.1094000 . volume 25684 10 >> 7 3307607.7500000 . height 25684 10 >> 7 17090858.9258000 . volume 25684 10 >> 8 3997393.5000000 . height 25684 10 >> 8 20292429.3125000 . volume 25684 10 >> 9 3985081.7500000 . height 25684 10 >> 9 16993036.1250000 . volume 25684 10 >> 10 3075018.0000000 . height 25684 10 >> 10 16751730.4062000 . volume 25684 10 >> 11 3797184.2500000 . height 25684 10 >> 11 19043436.7988000 . volume 25684 10 >> 12 2688521.7500000 . height 25684 10 >> 12 13023881.1250000 . volume 25684 10 >> 13 3514139.0000000 . height 25684 10 >> 13 15372329.3750000 . volume 25684 10 >> 14 3620126.5000000 . height 25684 10 >> 14 17407754.0000000 . volume 25684 10 >> 15 3557370.0000000 . height 25684 10 >> 15 17194578.7695000 . volume 25684 10 >> 16 4173686.0000000 . height 25684 10 >> 16 19418077.9375000 . volume 25684 10 >> 17 664710.7500000 . height 25684 10 >> 17 3968466.9375000 . volume 25684 10 >> 18 1500294.5000000 . height 25684 10 >> 18 7852347.8750000 . volume 25684 10 >> 19 3411027.5000000 . height 25684 10 >> 19 15967874.0625000 . volume 25684 10 >> 20 2107511.5000000 . height 25684 10 >> 20 11223448.5664000 . volume 25684 10 >> 21 1064114.3750000 . height 25684 10 >> 21 5697160.6250000 . volume 25684 10 >> 22 1936440.0000000 . height 25684 10 >> 22 9603539.6250000 . volume 25684 10 >> 23 227624.5312500 . height 25684 10 >> 23 1447864.2421900 . volume 25684 10 >> 24 3033205.5000000 . height 25684 10 >> 24 15061127.9219000 . volume 25684 10 >> 25 3193726.5000000 . height 25684 10 >> 25 14751563.0000000 . volume 25684 10 >> 26 2209262.2500000 . height 25684 10 >> 26 11726956.7656000 . volume 25684 10 >> 27 2025077.3750000 . height 25684 10 >> 27 10107639.5078000 . volume 25684 10 >> 28 997161.2500000 . height 25684 10 >> 28 6092788.8750000 . volume 25684 10 >> 29 140965.4375000 . height 25684 10 >> 29 1010542.1015600 . volume 25684 10 >> 30 271068.6875000 . height 25684 10 >> 30 1806958.6718800 . volume 25684 10 >> 31 117835.9062500 . height 25684 10 >> 31 869509.1406250 . volume 25684 10 >> 32 76793.8750000 . height 25684 10 >> 32 565639.2109380 . volume 25684 10 >> 33 35564.3867188 . height 25684 10 >> 33 280721.2246090 . volume 25684 10 >> 34 1565056.3750000 . height 25684 10 >> 34 9282912.1875000 . volume 25684 10 >> 35 38467.0117188 . height 25684 10 >> 35 333336.3378910 . volume 25684 10 >> 36 25032.0078125 . height 25684 10 >> 36 186129.9882810 . volume 25684 10 >> 37 174457.9375000 . height 25684 10 >> 37 1136376.7031200 . volume 25684 10 >> >> stop_ >> >> loop_ >> _Peak_char.Peak_ID >> _Peak_char.Spectral_dim_ID >> _Peak_char.Chem_shift_val >> _Peak_char.Chem_shift_val_err >> _Peak_char.Line_width_val >> _Peak_char.Line_width_val_err >> _Peak_char.Phase_val >> _Peak_char.Phase_val_err >> _Peak_char.Decay_rate_val >> _Peak_char.Decay_rate_val_err >> _Peak_char.Coupling_pattern >> _Peak_char.Bounding_box_upper_val >> _Peak_char.Bounding_box_lower_val >> _Peak_char.Bounding_box_range_val >> _Peak_char.Details >> _Peak_char.Derivation_method_ID >> _Peak_char.Entry_ID >> _Peak_char.Spectral_peak_list_ID >> >> 1 1 7.749 . 52.6293693331 . . . . . . . . . . 2 25684 10 >> 1 2 119.274 . 24.5116617524 . . . . . . . . . . 2 25684 10 >> 2 1 7.439 . 53.4342980996 . . . . . . . . . . 2 25684 10 >> 2 2 120.432 . 25.1064265197 . . . . . . . . . . 2 25684 10 >> 3 1 10.030 . 26.9759236697 . . . . . . . . . . 2 25684 10 >> 3 2 129.173 . 16.7422003109 . . . . . . . . . . 2 25684 10 >> 4 1 10.328 . 22.7006542898 . . . . . . . . . . 2 25684 10 >> 4 2 129.872 . 13.7610733189 . . . . . . . . . . 2 25684 10 >> 5 1 8.569 . 16.8270026011 . . . . . . . . . . 2 25684 10 >> 5 2 119.619 . 11.8492841448 . . . . . . . . . . 2 25684 10 >> 6 1 7.940 . 16.4814154158 . . . . . . . . . . 2 25684 10 >> 6 2 127.795 . 13.9623789265 . . . . . . . . . . 2 25684 10 >> 7 1 8.390 . 15.5038593643 . . . . . . . . . . 2 25684 10 >> 7 2 125.737 . 14.9853885892 . . . . . . . . . . 2 25684 10 >> 8 1 8.201 . 16.7767777070 . . . . . . . . . . 2 25684 10 >> 8 2 124.672 . 13.9635278859 . . . . . . . . . . 2 25684 10 >> 9 1 8.264 . 15.0964057532 . . . . . . . . . . 2 25684 10 >> 9 2 124.163 . 12.4565686074 . . . . . . . . . . 2 25684 10 >> 10 1 8.387 . 16.7225614305 . . . . . . . . . . 2 25684 10 >> 10 2 123.609 . 14.8223684212 . . . . . . . . . . 2 25684 10 >> 11 1 8.322 . 16.4857394133 . . . . . . . . . . 2 25684 10 >> 11 2 122.524 . 13.7058968556 . . . . . . . . . . 2 25684 10 >> 12 1 8.286 . 18.5176856258 . . . . . . . . . . 2 25684 10 >> 12 2 122.166 . 12.2752707407 . . . . . . . . . . 2 25684 10 >> 13 1 8.460 . 16.7588164865 . . . . . . . . . . 2 25684 10 >> 13 2 122.293 . 11.2144246570 . . . . . . . . . . 2 25684 10 >> 14 1 8.226 . 18.4375253643 . . . . . . . . . . 2 25684 10 >> 14 2 120.988 . 12.6436244775 . . . . . . . . . . 2 25684 10 >> 15 1 8.261 . 15.9874818546 . . . . . . . . . . 2 25684 10 >> 15 2 119.567 . 13.9460953987 . . . . . . . . . . 2 25684 10 >> 16 1 8.160 . 16.9221305462 . . . . . . . . . . 2 25684 10 >> 16 2 118.889 . 12.9691365564 . . . . . . . . . . 2 25684 10 >> 17 1 8.286 . 25.4660170023 . . . . . . . . . . 2 25684 10 >> 17 2 117.677 . 15.9754482098 . . . . . . . . . . 2 25684 10 >> 18 1 8.222 . 20.5007374049 . . . . . . . . . . 2 25684 10 >> 18 2 117.746 . 13.7690235895 . . . . . . . . . . 2 25684 10 >> 19 1 8.196 . 19.8614510045 . . . . . . . . . . 2 25684 10 >> 19 2 116.317 . 11.5286848578 . . . . . . . . . . 2 25684 10 >> 20 1 8.160 . 16.6806519162 . . . . . . . . . . 2 25684 10 >> 20 2 115.680 . 14.7162943780 . . . . . . . . . . 2 25684 10 >> 21 1 8.201 . 22.1860985866 . . . . . . . . . . 2 25684 10 >> 21 2 115.410 . 14.1268650083 . . . . . . . . . . 2 25684 10 >> 22 1 8.303 . 19.6329443671 . . . . . . . . . . 2 25684 10 >> 22 2 115.064 . 13.4156195312 . . . . . . . . . . 2 25684 10 >> 23 1 8.194 . 27.6083914588 . . . . . . . . . . 2 25684 10 >> 23 2 113.615 . 17.0886974066 . . . . . . . . . . 2 25684 10 >> 24 1 8.406 . 17.4370188646 . . . . . . . . . . 2 25684 10 >> 24 2 107.583 . 13.9635278859 . . . . . . . . . . 2 25684 10 >> 25 1 8.248 . 17.8351592503 . . . . . . . . . . 2 25684 10 >> 25 2 108.433 . 12.8906375383 . . . . . . . . . . 2 25684 10 >> 26 1 8.382 . 18.8077260739 . . . . . . . . . . 2 25684 10 >> 26 2 108.755 . 14.4492075440 . . . . . . . . . . 2 25684 10 >> 27 1 8.424 . 17.6192919902 . . . . . . . . . . 2 25684 10 >> 27 2 110.213 . 14.1178846361 . . . . . . . . . . 2 25684 10 >> 28 1 8.487 . 24.0713614991 . . . . . . . . . . 2 25684 10 >> 28 2 110.661 . 16.3023337574 . . . . . . . . . . 2 25684 10 >> 29 1 7.867 . 41.7914358927 . . . . . . . . . . 2 25684 10 >> 29 2 119.279 . 22.1386248152 . . . . . . . . . . 2 25684 10 >> 30 1 8.244 . 39.5742230178 . . . . . . . . . . 2 25684 10 >> 30 2 121.301 . 36.2265044430 . . . . . . . . . . 2 25684 10 >> 31 1 7.703 . 35.4078851135 . . . . . . . . . . 2 25684 10 >> 31 2 111.191 . 24.4264010424 . . . . . . . . . . 2 25684 10 >> 32 1 8.293 . 51.5287456603 . . . . . . . . . . 2 25684 10 >> 32 2 109.749 . 23.9502300137 . . . . . . . . . . 2 25684 10 >> 33 1 7.814 . 141.4901789970 . . . . . . . . . . 2 25684 10 >> 33 2 111.291 . 27.4944131354 . . . . . . . . . . 2 25684 10 >> 34 1 8.158 . 23.7031564807 . . . . . . . . . . 2 25684 10 >> 34 2 123.242 . 13.4800669080 . . . . . . . . . . 2 25684 10 >> 35 1 7.955 . 112.2330140280 . . . . . . . . . . 2 25684 10 >> 35 2 119.055 . 30.9480529751 . . . . . . . . . . 2 25684 10 >> 36 1 7.748 . 133.4648396260 . . . . . . . . . . 2 25684 10 >> 36 2 121.041 . 25.4253882095 . . . . . . . . . . 2 25684 10 >> 37 1 8.452 . 35.2834870314 . . . . . . . . . . 2 25684 10 >> 37 2 120.590 . 17.5479642053 . . . . . . . . . . 2 25684 10 >> >> stop_ >> >> loop_ >> _Assigned_peak_chem_shift.Peak_ID >> _Assigned_peak_chem_shift.Spectral_dim_ID >> _Assigned_peak_chem_shift.Peak_contribution_ID >> _Assigned_peak_chem_shift.Set_ID >> _Assigned_peak_chem_shift.Magnetization_linkage_ID >> _Assigned_peak_chem_shift.Assembly_atom_ID >> _Assigned_peak_chem_shift.Val >> _Assigned_peak_chem_shift.Figure_of_merit >> _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID >> _Assigned_peak_chem_shift.Atom_chem_shift_ID >> _Assigned_peak_chem_shift.Entity_assembly_ID >> _Assigned_peak_chem_shift.Entity_ID >> _Assigned_peak_chem_shift.Comp_index_ID >> _Assigned_peak_chem_shift.Comp_ID >> _Assigned_peak_chem_shift.Atom_ID >> _Assigned_peak_chem_shift.Auth_atom_peak_num >> _Assigned_peak_chem_shift.Auth_entity_ID >> _Assigned_peak_chem_shift.Auth_seq_ID >> _Assigned_peak_chem_shift.Auth_comp_ID >> _Assigned_peak_chem_shift.Auth_atom_ID >> _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID >> _Assigned_peak_chem_shift.Resonance_ID >> _Assigned_peak_chem_shift.Details >> _Assigned_peak_chem_shift.Entry_ID >> _Assigned_peak_chem_shift.Spectral_peak_list_ID >> >> 1 1 . 1 . . 7.749 . 4 1 1 21 TRP H . . . . . . 3 . 25684 10 >> 1 2 . 1 . . 119.274 . 4 1 1 21 TRP N . . . . . . 4 . 25684 10 >> 2 1 . 1 . . 7.439 . 4 1 1 22 LEU H . . . . . . 5 . 25684 10 >> 2 2 . 1 . . 120.432 . 4 1 1 22 LEU N . . . . . . 6 . 25684 10 >> 3 1 . 1 . . 10.030 . 4 1 1 21 TRP HE1 . . . . . . 155 . 25684 10 >> 3 2 . 1 . . 129.173 . 4 1 1 21 TRP NE1 . . . . . . 380 . 25684 10 >> 4 1 . 1 . . 10.328 . 4 1 1 17 TRP HE1 . . . . . . 310 . 25684 10 >> 4 2 . 1 . . 129.872 . 4 1 1 17 TRP NE1 . . . . . . 321 . 25684 10 >> 5 1 . 1 . . 8.569 . 4 1 1 3 MET H . . . . . . 7 . 25684 10 >> 5 2 . 1 . . 119.619 . 4 1 1 3 MET N . . . . . . 8 . 25684 10 >> 6 1 . 1 . . 7.940 . 4 1 1 39 LYS H . . . . . . 31 . 25684 10 >> 6 2 . 1 . . 127.795 . 4 1 1 39 LYS N . . . . . . 32 . 25684 10 >> 7 1 . 1 . . 8.390 . 4 1 1 9 ALA H . . . . . . 15 . 25684 10 >> 7 2 . 1 . . 125.737 . 4 1 1 9 ALA N . . . . . . 16 . 25684 10 >> 8 1 . 1 . . 8.201 . 4 1 1 11 ALA H . . . . . . 37 . 25684 10 >> 8 2 . 1 . . 124.672 . 4 1 1 11 ALA N . . . . . . 38 . 25684 10 >> 9 1 . 1 . . 8.264 . 4 1 1 36 ALA H . . . . . . 19 . 25684 10 >> 9 2 . 1 . . 124.163 . 4 1 1 36 ALA N . . . . . . 20 . 25684 10 >> 10 1 . 1 . . 8.387 . 4 1 1 7 ASP H . . . . . . 35 . 25684 10 >> 10 2 . 1 . . 123.609 . 4 1 1 7 ASP N . . . . . . 36 . 25684 10 >> 11 1 . 1 . . 8.322 . 4 1 1 38 GLU H . . . . . . 41 . 25684 10 >> 11 2 . 1 . . 122.524 . 4 1 1 38 GLU N . . . . . . 42 . 25684 10 >> 12 1 . 1 . . 8.286 . 4 1 1 34 LYS H . . . . . . 29 . 25684 10 >> 12 2 . 1 . . 122.166 . 4 1 1 34 LYS N . . . . . . 30 . 25684 10 >> 13 1 . 1 . . 8.460 . 4 1 1 35 GLU H . . . . . . 39 . 25684 10 >> 13 2 . 1 . . 122.293 . 4 1 1 35 GLU N . . . . . . 40 . 25684 10 >> 14 1 . 1 . . 8.226 . 4 1 1 6 VAL H . . . . . . 11 . 25684 10 >> 14 2 . 1 . . 120.988 . 4 1 1 6 VAL N . . . . . . 12 . 25684 10 >> 15 1 . 1 . . 8.261 . 4 1 1 37 GLU H . . . . . . 43 . 25684 10 >> 15 2 . 1 . . 119.567 . 4 1 1 37 GLU N . . . . . . 44 . 25684 10 >> 16 1 . 1 . . 8.160 . 4 1 1 10 ASP H . . . . . . 9 . 25684 10 >> 16 2 . 1 . . 118.889 . 4 1 1 10 ASP N . . . . . . 10 . 25684 10 >> 17 1 . 1 . . 8.286 . 4 1 1 29 SER H . . . . . . 119 . 25684 10 >> 17 2 . 1 . . 117.677 . 4 1 1 29 SER N . . . . . . 118 . 25684 10 >> 18 1 . 1 . . 8.222 . 4 1 1 31 SER H . . . . . . 99 . 25684 10 >> 18 2 . 1 . . 117.746 . 4 1 1 31 SER N . . . . . . 98 . 25684 10 >> 19 1 . 1 . . 8.196 . 4 1 1 8 SER H . . . . . . 51 . 25684 10 >> 19 2 . 1 . . 116.317 . 4 1 1 8 SER N . . . . . . 52 . 25684 10 >> 20 1 . 1 . . 8.160 . 4 1 1 5 SER H . . . . . . 49 . 25684 10 >> 20 2 . 1 . . 115.680 . 4 1 1 5 SER N . . . . . . 50 . 25684 10 >> 21 1 . 1 . . 8.201 . 4 1 1 30 THR H . . . . . . 129 . 25684 10 >> 21 2 . 1 . . 115.410 . 4 1 1 30 THR N . . . . . . 128 . 25684 10 >> 22 1 . 1 . . 8.303 . 4 1 1 15 SER H . . . . . . 33 . 25684 10 >> 22 2 . 1 . . 115.064 . 4 1 1 15 SER N . . . . . . 34 . 25684 10 >> 23 1 . 1 . . 8.194 . 4 1 1 28 THR H . . . . . . 124 . 25684 10 >> 23 2 . 1 . . 113.615 . 4 1 1 28 THR N . . . . . . 123 . 25684 10 >> 24 1 . 1 . . 8.406 . 4 1 1 12 GLY H . . . . . . 47 . 25684 10 >> 24 2 . 1 . . 107.583 . 4 1 1 12 GLY N . . . . . . 48 . 25684 10 >> 25 1 . 1 . . 8.248 . 4 1 1 13 GLY H . . . . . . 45 . 25684 10 >> 25 2 . 1 . . 108.433 . 4 1 1 13 GLY N . . . . . . 46 . 25684 10 >> 26 1 . 1 . . 8.382 . 4 1 1 14 GLY H . . . . . . 13 . 25684 10 >> 26 2 . 1 . . 108.755 . 4 1 1 14 GLY N . . . . . . 14 . 25684 10 >> 27 1 . 1 . . 8.424 . 4 1 1 4 GLY H . . . . . . 25 . 25684 10 >> 27 2 . 1 . . 110.213 . 4 1 1 4 GLY N . . . . . . 26 . 25684 10 >> 28 1 . 1 . . 8.487 . 4 1 1 16 GLY H . . . . . . 23 . 25684 10 >> 28 2 . 1 . . 110.661 . 4 1 1 16 GLY N . . . . . . 24 . 25684 10 >> 29 1 . 1 . . 7.867 . 4 1 1 18 LEU H . . . . . . 17 . 25684 10 >> 29 2 . 1 . . 119.279 . 4 1 1 18 LEU N . . . . . . 18 . 25684 10 >> 30 1 . 1 . . 8.244 . 4 1 1 17 TRP H . . . . . . 21 . 25684 10 >> 30 2 . 1 . . 121.301 . 4 1 1 17 TRP N . . . . . . 22 . 25684 10 >> 31 1 . 1 . . 7.703 . 4 1 1 19 THR H . . . . . . 1 . 25684 10 >> 31 2 . 1 . . 111.191 . 4 1 1 19 THR N . . . . . . 2 . 25684 10 >> 32 1 . 1 . . 8.293 . 4 1 1 20 GLY H . . . . . . 313 . 25684 10 >> 32 2 . 1 . . 109.749 . 4 1 1 20 GLY N . . . . . . 107 . 25684 10 >> 33 1 . 1 . . 7.814 . 4 1 1 24 THR H . . . . . . 318 . 25684 10 >> 33 2 . 1 . . 111.291 . 4 1 1 24 THR N . . . . . . 319 . 25684 10 >> 34 1 . 1 . . 8.158 . 4 1 1 33 LEU H . . . . . . 27 . 25684 10 >> 34 2 . 1 . . 123.242 . 4 1 1 33 LEU N . . . . . . 28 . 25684 10 >> 35 1 . 1 . . 7.955 . 4 1 1 26 CYS H . . . . . . 332 . 25684 10 >> 35 2 . 1 . . 119.055 . 4 1 1 26 CYS N . . . . . . 333 . 25684 10 >> 36 1 . 1 . . 7.748 . 4 1 1 25 TRP H . . . . . . 335 . 25684 10 >> 36 2 . 1 . . 121.041 . 4 1 1 25 TRP N . . . . . . 334 . 25684 10 >> 37 1 . 1 . . 8.452 . 4 1 1 32 HIS H . . . . . . 337 . 25684 10 >> 37 2 . 1 . . 120.590 . 4 1 1 32 HIS N . . . . . . 338 . 25684 10 >> >> stop_ >> >>save_ >> ; save_