data_5858 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Characterization of us-ms Dynamics of Proteins Using a Combined Analysis of 15N NMR Relaxation and Chemical Shift: Conformational Exchange in Plastocyanin Induced by Histidine Protonations ; _BMRB_accession_number 5858 _BMRB_flat_file_name bmr5858.str _Entry_type original _Submission_date 2003-07-04 _Accession_date 2003-07-07 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Hass Mathias A.S. . 2 Thuesen Marianne H. . 3 Christensen Hans E.M. . 4 Led Jens J. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 14 T1_relaxation 8 T2_relaxation 6 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 1312 "15N chemical shifts" 1312 "T1 relaxation values" 742 "T2 relaxation values" 570 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2004-02-12 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 5505 'Chemical shifts and other data' stop_ _Original_release_date 2004-02-12 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Characterization of us-ms Dynamics of Proteins Using a Combined Analysis of 15N NMR Relaxation and Chemical Shift: Conformational Exchange in Plastocyanin Induced by Histidine Protonations ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 14733549 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Hass Mathias A.S. . 2 Thuesen Marianne H. . 3 Christensen Hans E.M. . 4 Led Jens J. . stop_ _Journal_abbreviation 'J. Am. Chem. Soc.' _Journal_volume 126 _Journal_issue 3 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 753 _Page_last 765 _Year 2004 _Details . save_ ####################################### # Cited references within the entry # ####################################### save_ref_1 _Saveframe_category citation _Citation_full ; Ma L, Hass MA, Vierick N, Kristensen SM, Ulstrup J, Led JJ. Biochemistry 2003, 42,320-330. ; _Citation_title 'Backbone dynamics of reduced plastocyanin from the cyanobacterium Anabaena variabilis: regions involved in electron transfer have enhanced mobility.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 12525159 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Ma Lixin . . 2 Hass 'Mathias A S' A. . 3 Vierick Nanna . . 4 Kristensen 'Soren M' M. . 5 Ulstrup Jens . . 6 Led 'Jens J' J. . stop_ _Journal_abbreviation Biochemistry _Journal_name_full Biochemistry _Journal_volume 42 _Journal_issue 2 _Journal_CSD . _Book_title . _Book_chapter_title . _Book_volume . _Book_series . _Book_publisher . _Book_publisher_city . _Book_ISBN . _Conference_title . _Conference_site . _Conference_state_province . _Conference_country . _Conference_start_date . _Conference_end_date . _Conference_abstract_number . _Thesis_institution . _Thesis_institution_city . _Thesis_institution_country . _Page_first 320 _Page_last 330 _Year 2003 _Details ; The dynamics of the backbone of the electron-transfer protein plastocyanin from the cyanobacterium Anabaena variabilis were determined from the (15)N and (13)C(alpha) R(1) and R(2) relaxation rates and steady-state [(1)H]-(15)N and [(1)H]-(13)C nuclear Overhauser effects (NOEs) using the model-free approach. The (13)C relaxation studies were performed using (13)C in natural abundance. Overall, it is found that the protein backbone is rigid. However, the regions that are important for the function of the protein show moderate mobility primarily on the microsecond to millisecond time scale. These regions are the "northern" hydrophobic site close to the metal site, the metal site itself, and the "eastern" face of the molecule. In particular, the mobility of the latter region is interesting in light of recent findings indicating that residues also on the eastern face of plastocyanins from prokaryotes are important for the function of the protein. The study also demonstrates that relaxation rates and NOEs of the (13)C(alpha) nuclei of proteins are valuable supplements to the conventional (15)N relaxation measurements in studies of protein backbone dynamics. ; save_ ################################## # Molecular system description # ################################## save_system_A.v.PCu(I) _Saveframe_category molecular_system _Mol_system_name 'Cu (I) Plastocyanin from Anabaena Variabilis' _Abbreviation_common 'A. v. PCu(I)' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'plastocyanin monomer' $plastocyanin 'COPPER (I) ION' $CU1 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'all other bound' loop_ _Biological_function 'Electron transfer in photosynthesis' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_plastocyanin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Cu(II) Plastocyanin from Anabeana Variabilis' _Abbreviation_common 'A. v. PCu(I)' _Molecular_mass 11900 _Mol_thiol_state 'all other bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 106 _Mol_residue_sequence ; METYTVKLGSDKGLLVFEPA KLTIKPGDTVEFLNNKVPPH NVVFDAALNPAKSADLAKSL SHKQLLMSPGQSTSTTFPAD APAGEYTFYCEPHRGAGMVG KITVAG ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 0 MET 2 1 GLU 3 2 THR 4 3 TYR 5 4 THR 6 5 VAL 7 6 LYS 8 7 LEU 9 8 GLY 10 9 SER 11 10 ASP 12 11 LYS 13 12 GLY 14 13 LEU 15 14 LEU 16 15 VAL 17 16 PHE 18 17 GLU 19 18 PRO 20 19 ALA 21 20 LYS 22 21 LEU 23 22 THR 24 23 ILE 25 24 LYS 26 25 PRO 27 26 GLY 28 27 ASP 29 28 THR 30 29 VAL 31 30 GLU 32 31 PHE 33 32 LEU 34 33 ASN 35 34 ASN 36 35 LYS 37 36 VAL 38 37 PRO 39 38 PRO 40 39 HIS 41 40 ASN 42 41 VAL 43 42 VAL 44 43 PHE 45 44 ASP 46 45 ALA 47 46 ALA 48 47 LEU 49 48 ASN 50 49 PRO 51 50 ALA 52 51 LYS 53 52 SER 54 53 ALA 55 54 ASP 56 55 LEU 57 56 ALA 58 57 LYS 59 58 SER 60 59 LEU 61 60 SER 62 61 HIS 63 62 LYS 64 63 GLN 65 64 LEU 66 65 LEU 67 66 MET 68 67 SER 69 68 PRO 70 69 GLY 71 70 GLN 72 71 SER 73 72 THR 74 73 SER 75 74 THR 76 75 THR 77 76 PHE 78 77 PRO 79 78 ALA 80 79 ASP 81 80 ALA 82 81 PRO 83 82 ALA 84 83 GLY 85 84 GLU 86 85 TYR 87 86 THR 88 87 PHE 89 88 TYR 90 89 CYS 91 90 GLU 92 91 PRO 93 92 HIS 94 93 ARG 95 94 GLY 96 95 ALA 97 96 GLY 98 97 MET 99 98 VAL 100 99 GLY 101 100 LYS 102 101 ILE 103 102 THR 104 103 VAL 105 104 ALA 106 105 GLY stop_ _Sequence_homology_query_date 2008-08-19 _Sequence_homology_query_revised_last_date 2008-08-19 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 SWISS-PROT P46444 'Plastocyanin precursor' 99.06 139 100.00 100.00 1.08e-55 SWISS-PROT P0C178 Plastocyanin 99.06 105 100.00 100.00 1.03e-54 SWISS-PROT O52830 'Plastocyanin precursor' 99.06 139 100.00 100.00 1.08e-55 REF NP_484302 'plastocyanin [Nostoc sp. PCC 7120]' 99.06 139 100.00 100.00 1.08e-55 PIR CUAI 'plastocyanin - Anabaena variabilis' 99.06 105 100.00 100.00 1.03e-54 GenBank AAA59364 'plastocyanin precursor' 99.06 139 100.00 100.00 1.08e-55 EMBL CAA05338 'plastocyanin [Nostoc sp. PCC 7119]' 99.06 139 100.00 100.00 1.08e-55 DBJ BAB77782 'plastocyanin precursor [Nostoc sp. PCC 7120]' 99.06 139 100.00 100.00 1.08e-55 PDB 2GIM '1.6 Angstrom Structure Of Plastocyanin From Anabaena Variabilis' 100.00 106 100.00 100.00 2.18e-55 PDB 2CJ3 'Crystal Structure Of Plastocyanin From A Cyanobacterium, Anabaena Variabilis' 97.17 105 100.00 100.00 1.94e-53 PDB 1TU2 'The Complex Of Nostoc Cytochrome F And Plastocyanin Determin With Paramagnetic Nmr. Based On The Structures Of Cytochrome F And Plastocyanin, 10 Structures' 99.06 105 100.00 100.00 1.03e-54 PDB 1NIN 'Plastocyanin From Anabaena Variabilis, Nmr, 20 Structures' 99.06 105 100.00 100.00 1.03e-54 PDB 1FA4 'Elucidation Of The Paramagnetic Relaxation Of Heteronuclei And Protons In Cu(Ii) Plastocyanin From Anabaena Variabilis' 99.06 105 100.00 100.00 1.03e-54 BMRB 5505 'Cu(II) Plastocyanin from Anabeana Variabilis' 99.06 105 100.00 100.00 1.03e-54 BMRB 4738 'Plastocyanin from Anabena variabilis' 99.06 105 100.00 100.00 1.03e-54 stop_ save_ ############# # Ligands # ############# save_CU1 _Saveframe_category ligand _Mol_type non-polymer _Name_common "CU1 (COPPER (I) ION)" _BMRB_code . _PDB_code CU1 _Molecular_mass 63.546 _Mol_charge 1 _Mol_paramagnetic . _Mol_aromatic no _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Wed Jul 27 13:15:34 2011 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons CU CU CU . 1 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $plastocyanin 'Anabaena variabilis' 1172 Eubacteria . Anabaena variabilis stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $plastocyanin 'recombinant technology' 'E. coli' Escherichia coli . plasmid BL21G(DE3) stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $plastocyanin 1.0 mM 0.8 1.2 '[U-95% 15N]' 'natrium ascorbate' 0.1 mM . . . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Inova _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_15N-HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name 15N-HSQC _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_Condition_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 8.50 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.80 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_3 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.46 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_4 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.96 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_5 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.59 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_6 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.05 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_7 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.78 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_8 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.35 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_9 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 4.98 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_10 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 4.60 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_11 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 4.20 0.05 na temperature 298 0.1 K stop_ save_ save_Condition_12 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.78 0.05 na temperature 293 0.1 K stop_ save_ save_Condition_13 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.78 0.05 na temperature 303 0.1 K stop_ save_ save_Condition_14 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.78 0.05 na temperature 308 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _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 . H 1 . ppm . . . . . . . N 15 . ppm . . . . . . 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_shift_set_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label 15N-HSQC stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 4 TYR N N 126.9 . . 2 . 4 TYR H H 8.83 . . 3 . 5 THR N N 118.6 . . 4 . 5 THR H H 8.58 . . 5 . 6 VAL N N 129.9 . . 6 . 6 VAL H H 9.36 . . 7 . 7 LYS N N 126.5 . . 8 . 7 LYS H H 9.06 . . 9 . 8 LEU N N 122.0 . . 10 . 8 LEU H H 8.87 . . 11 . 9 GLY N N 114.9 . . 12 . 9 GLY H H 7.67 . . 13 . 10 SER N N 119.6 . . 14 . 10 SER H H 8.67 . . 15 . 13 GLY N N 108.9 . . 16 . 13 GLY H H 8.33 . . 17 . 14 LEU N N 117.4 . . 18 . 14 LEU H H 7.46 . . 19 . 15 LEU N N 124.9 . . 20 . 15 LEU H H 8.38 . . 21 . 16 VAL N N 112.6 . . 22 . 16 VAL H H 7.48 . . 23 . 17 PHE N N 120.0 . . 24 . 17 PHE H H 8.64 . . 25 . 18 GLU N N 122.1 . . 26 . 18 GLU H H 9.02 . . 27 . 20 ALA N N 117.1 . . 28 . 20 ALA H H 8.15 . . 29 . 21 LYS N N 115.9 . . 30 . 21 LYS H H 7.39 . . 31 . 22 LEU N N 121.5 . . 32 . 22 LEU H H 7.78 . . 33 . 23 THR N N 121.1 . . 34 . 23 THR H H 8.22 . . 35 . 24 ILE N N 120.9 . . 36 . 24 ILE H H 8.92 . . 37 . 25 LYS N N 119.8 . . 38 . 25 LYS H H 9.03 . . 39 . 27 GLY N N 114.6 . . 40 . 27 GLY H H 7.11 . . 41 . 28 ASP N N 119.9 . . 42 . 28 ASP H H 7.89 . . 43 . 29 THR N N 114.9 . . 44 . 29 THR H H 8.73 . . 45 . 30 VAL N N 126.5 . . 46 . 30 VAL H H 9.18 . . 47 . 31 GLU N N 128.7 . . 48 . 31 GLU H H 9.18 . . 49 . 32 PHE N N 126.1 . . 50 . 32 PHE H H 9.13 . . 51 . 33 LEU N N 125.2 . . 52 . 33 LEU H H 8.96 . . 53 . 34 ASN N N 127.5 . . 54 . 34 ASN H H 9.33 . . 55 . 35 ASN N N 129.8 . . 56 . 35 ASN H H 8.80 . . 57 . 36 LYS N N 116.7 . . 58 . 36 LYS H H 8.11 . . 59 . 37 VAL N N 115.3 . . 60 . 37 VAL H H 8.92 . . 61 . 40 HIS N N 112.7 . . 62 . 40 HIS H H 7.18 . . 63 . 41 ASN N N 123.1 . . 64 . 41 ASN H H 9.87 . . 65 . 42 VAL N N 109.4 . . 66 . 42 VAL H H 7.10 . . 67 . 43 VAL N N 128.1 . . 68 . 43 VAL H H 9.41 . . 69 . 44 PHE N N 125.6 . . 70 . 44 PHE H H 8.69 . . 71 . 45 ASP N N 124.1 . . 72 . 45 ASP H H 8.41 . . 73 . 46 ALA N N 128.2 . . 74 . 46 ALA H H 8.62 . . 75 . 47 ALA N N 117.5 . . 76 . 47 ALA H H 8.45 . . 77 . 48 LEU N N 123.1 . . 78 . 48 LEU H H 8.66 . . 79 . 49 ASN N N 114.5 . . 80 . 49 ASN H H 8.04 . . 81 . 51 ALA N N 115.5 . . 82 . 51 ALA H H 7.01 . . 83 . 52 LYS N N 120.5 . . 84 . 52 LYS H H 7.96 . . 85 . 53 SER N N 109.8 . . 86 . 53 SER H H 8.21 . . 87 . 56 LEU N N 123.7 . . 88 . 56 LEU H H 8.13 . . 89 . 57 ALA N N 119.7 . . 90 . 57 ALA H H 7.55 . . 91 . 58 LYS N N 120.6 . . 92 . 58 LYS H H 8.51 . . 93 . 59 SER N N 115.3 . . 94 . 59 SER H H 7.73 . . 95 . 60 LEU N N 120.9 . . 96 . 60 LEU H H 6.88 . . 97 . 61 SER N N 110.7 . . 98 . 61 SER H H 6.86 . . 99 . 62 HIS N N 122.8 . . 100 . 62 HIS H H 9.59 . . 101 . 63 LYS N N 122.5 . . 102 . 63 LYS H H 8.57 . . 103 . 64 GLN N N 120.1 . . 104 . 64 GLN H H 8.34 . . 105 . 65 LEU N N 121.1 . . 106 . 65 LEU H H 8.14 . . 107 . 66 LEU N N 125.1 . . 108 . 66 LEU H H 9.52 . . 109 . 67 MET N N 121.8 . . 110 . 67 MET H H 8.06 . . 111 . 68 SER N N 113.7 . . 112 . 68 SER H H 8.39 . . 113 . 70 GLY N N 112.9 . . 114 . 70 GLY H H 9.05 . . 115 . 71 GLN N N 120.0 . . 116 . 71 GLN H H 7.54 . . 117 . 72 SER N N 116.2 . . 118 . 72 SER H H 8.63 . . 119 . 73 THR N N 115.8 . . 120 . 73 THR H H 8.73 . . 121 . 75 THR N N 121.5 . . 122 . 75 THR H H 9.54 . . 123 . 76 THR N N 126.9 . . 124 . 76 THR H H 9.10 . . 125 . 77 PHE N N 131.6 . . 126 . 77 PHE H H 9.20 . . 127 . 79 ALA N N 123.1 . . 128 . 79 ALA H H 8.81 . . 129 . 80 ASP N N 113.1 . . 130 . 80 ASP H H 8.00 . . 131 . 81 ALA N N 124.7 . . 132 . 81 ALA H H 7.59 . . 133 . 83 ALA N N 124.6 . . 134 . 83 ALA H H 8.38 . . 135 . 84 GLY N N 107.4 . . 136 . 84 GLY H H 8.86 . . 137 . 85 GLU N N 119.7 . . 138 . 85 GLU H H 8.48 . . 139 . 86 TYR N N 125.6 . . 140 . 86 TYR H H 10.17 . . 141 . 87 THR N N 121.5 . . 142 . 87 THR H H 8.61 . . 143 . 88 PHE N N 126.3 . . 144 . 88 PHE H H 8.58 . . 145 . 89 TYR N N 115.4 . . 146 . 89 TYR H H 8.92 . . 147 . 90 CYS N N 125.2 . . 148 . 90 CYS H H 7.75 . . 149 . 91 GLU N N 125.6 . . 150 . 91 GLU H H 10.05 . . 151 . 93 HIS N N 115.9 . . 152 . 93 HIS H H 8.67 . . 153 . 94 ARG N N 129.4 . . 154 . 94 ARG H H 8.50 . . 155 . 96 ALA N N 121.7 . . 156 . 96 ALA H H 7.58 . . 157 . 97 GLY N N 106.4 . . 158 . 97 GLY H H 8.07 . . 159 . 98 MET N N 124.3 . . 160 . 98 MET H H 7.65 . . 161 . 99 VAL N N 125.8 . . 162 . 99 VAL H H 7.93 . . 163 . 100 GLY N N 118.2 . . 164 . 100 GLY H H 9.00 . . 165 . 101 LYS N N 117.6 . . 166 . 101 LYS H H 8.27 . . 167 . 102 ILE N N 127.6 . . 168 . 102 ILE H H 9.47 . . 169 . 103 THR N N 126.0 . . 170 . 103 THR H H 9.26 . . 171 . 104 VAL N N 128.6 . . 172 . 104 VAL H H 9.32 . . 173 . 105 ALA N N 133.7 . . 174 . 105 ALA H H 9.26 . . 175 . 106 GLY N N 113.9 . . 176 . 106 GLY H H 7.78 . . stop_ save_ save_shift_set_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_2 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 4 TYR N N 127.0 . . 2 . 4 TYR H H 8.84 . . 3 . 5 THR N N 118.6 . . 4 . 5 THR H H 8.59 . . 5 . 6 VAL N N 129.9 . . 6 . 6 VAL H H 9.36 . . 7 . 7 LYS N N 126.5 . . 8 . 7 LYS H H 9.06 . . 9 . 8 LEU N N 122.0 . . 10 . 8 LEU H H 8.87 . . 11 . 9 GLY N N 114.9 . . 12 . 9 GLY H H 7.67 . . 13 . 10 SER N N 119.6 . . 14 . 10 SER H H 8.67 . . 15 . 11 ASP N N 121.0 . . 16 . 11 ASP H H 9.48 . . 17 . 13 GLY N N 108.9 . . 18 . 13 GLY H H 8.33 . . 19 . 14 LEU N N 117.4 . . 20 . 14 LEU H H 7.46 . . 21 . 15 LEU N N 124.9 . . 22 . 15 LEU H H 8.38 . . 23 . 16 VAL N N 112.6 . . 24 . 16 VAL H H 7.48 . . 25 . 17 PHE N N 120.0 . . 26 . 17 PHE H H 8.64 . . 27 . 18 GLU N N 122.1 . . 28 . 18 GLU H H 9.02 . . 29 . 20 ALA N N 117.1 . . 30 . 20 ALA H H 8.14 . . 31 . 21 LYS N N 115.9 . . 32 . 21 LYS H H 7.39 . . 33 . 22 LEU N N 121.5 . . 34 . 22 LEU H H 7.78 . . 35 . 23 THR N N 121.1 . . 36 . 23 THR H H 8.22 . . 37 . 24 ILE N N 120.9 . . 38 . 24 ILE H H 8.92 . . 39 . 25 LYS N N 119.7 . . 40 . 25 LYS H H 9.01 . . 41 . 27 GLY N N 114.6 . . 42 . 27 GLY H H 7.11 . . 43 . 28 ASP N N 119.9 . . 44 . 28 ASP H H 7.90 . . 45 . 29 THR N N 114.8 . . 46 . 29 THR H H 8.70 . . 47 . 30 VAL N N 126.5 . . 48 . 30 VAL H H 9.18 . . 49 . 31 GLU N N 128.7 . . 50 . 31 GLU H H 9.19 . . 51 . 32 PHE N N 126.1 . . 52 . 32 PHE H H 9.13 . . 53 . 33 LEU N N 125.2 . . 54 . 33 LEU H H 8.96 . . 55 . 34 ASN N N 127.5 . . 56 . 34 ASN H H 9.33 . . 57 . 35 ASN N N 129.7 . . 58 . 35 ASN H H 8.81 . . 59 . 36 LYS N N 116.7 . . 60 . 36 LYS H H 8.12 . . 61 . 37 VAL N N 115.3 . . 62 . 37 VAL H H 8.92 . . 63 . 40 HIS N N 112.7 . . 64 . 40 HIS H H 7.18 . . 65 . 41 ASN N N 123.1 . . 66 . 41 ASN H H 9.88 . . 67 . 42 VAL N N 109.3 . . 68 . 42 VAL H H 7.08 . . 69 . 43 VAL N N 128.1 . . 70 . 43 VAL H H 9.42 . . 71 . 44 PHE N N 125.5 . . 72 . 44 PHE H H 8.69 . . 73 . 45 ASP N N 124.1 . . 74 . 45 ASP H H 8.40 . . 75 . 46 ALA N N 128.2 . . 76 . 46 ALA H H 8.62 . . 77 . 47 ALA N N 117.5 . . 78 . 47 ALA H H 8.46 . . 79 . 48 LEU N N 123.1 . . 80 . 48 LEU H H 8.66 . . 81 . 49 ASN N N 114.5 . . 82 . 49 ASN H H 8.05 . . 83 . 51 ALA N N 115.5 . . 84 . 51 ALA H H 7.01 . . 85 . 52 LYS N N 120.5 . . 86 . 52 LYS H H 7.96 . . 87 . 53 SER N N 109.8 . . 88 . 53 SER H H 8.21 . . 89 . 56 LEU N N 123.7 . . 90 . 56 LEU H H 8.14 . . 91 . 57 ALA N N 119.6 . . 92 . 57 ALA H H 7.56 . . 93 . 58 LYS N N 120.7 . . 94 . 58 LYS H H 8.52 . . 95 . 59 SER N N 115.3 . . 96 . 59 SER H H 7.74 . . 97 . 60 LEU N N 120.8 . . 98 . 60 LEU H H 6.89 . . 99 . 61 SER N N 110.8 . . 100 . 61 SER H H 6.88 . . 101 . 62 HIS N N 122.4 . . 102 . 62 HIS H H 9.60 . . 103 . 63 LYS N N 122.6 . . 104 . 63 LYS H H 8.60 . . 105 . 64 GLN N N 120.1 . . 106 . 64 GLN H H 8.35 . . 107 . 65 LEU N N 121.2 . . 108 . 65 LEU H H 8.16 . . 109 . 66 LEU N N 125.1 . . 110 . 66 LEU H H 9.53 . . 111 . 67 MET N N 121.9 . . 112 . 67 MET H H 8.07 . . 113 . 68 SER N N 113.7 . . 114 . 68 SER H H 8.38 . . 115 . 70 GLY N N 112.9 . . 116 . 70 GLY H H 9.04 . . 117 . 71 GLN N N 120.0 . . 118 . 71 GLN H H 7.54 . . 119 . 72 SER N N 116.1 . . 120 . 72 SER H H 8.64 . . 121 . 73 THR N N 115.9 . . 122 . 73 THR H H 8.73 . . 123 . 74 SER N N 117.6 . . 124 . 74 SER H H 8.20 . . 125 . 75 THR N N 121.4 . . 126 . 75 THR H H 9.55 . . 127 . 76 THR N N 126.9 . . 128 . 76 THR H H 9.10 . . 129 . 77 PHE N N 131.6 . . 130 . 77 PHE H H 9.19 . . 131 . 79 ALA N N 123.2 . . 132 . 79 ALA H H 8.82 . . 133 . 80 ASP N N 113.1 . . 134 . 80 ASP H H 8.00 . . 135 . 81 ALA N N 124.6 . . 136 . 81 ALA H H 7.58 . . 137 . 83 ALA N N 124.6 . . 138 . 83 ALA H H 8.38 . . 139 . 84 GLY N N 107.4 . . 140 . 84 GLY H H 8.86 . . 141 . 85 GLU N N 119.7 . . 142 . 85 GLU H H 8.48 . . 143 . 86 TYR N N 125.6 . . 144 . 86 TYR H H 10.17 . . 145 . 87 THR N N 121.5 . . 146 . 87 THR H H 8.62 . . 147 . 88 PHE N N 126.3 . . 148 . 88 PHE H H 8.58 . . 149 . 89 TYR N N 115.4 . . 150 . 89 TYR H H 8.92 . . 151 . 90 CYS N N 125.2 . . 152 . 90 CYS H H 7.75 . . 153 . 91 GLU N N 125.6 . . 154 . 91 GLU H H 10.04 . . 155 . 93 HIS N N 115.8 . . 156 . 93 HIS H H 8.67 . . 157 . 94 ARG N N 129.4 . . 158 . 94 ARG H H 8.50 . . 159 . 96 ALA N N 121.7 . . 160 . 96 ALA H H 7.58 . . 161 . 97 GLY N N 106.4 . . 162 . 97 GLY H H 8.07 . . 163 . 98 MET N N 124.4 . . 164 . 98 MET H H 7.65 . . 165 . 99 VAL N N 125.8 . . 166 . 99 VAL H H 7.94 . . 167 . 100 GLY N N 118.2 . . 168 . 100 GLY H H 9.00 . . 169 . 101 LYS N N 117.6 . . 170 . 101 LYS H H 8.27 . . 171 . 102 ILE N N 127.5 . . 172 . 102 ILE H H 9.48 . . 173 . 103 THR N N 126.0 . . 174 . 103 THR H H 9.27 . . 175 . 104 VAL N N 128.7 . . 176 . 104 VAL H H 9.32 . . 177 . 105 ALA N N 133.7 . . 178 . 105 ALA H H 9.26 . . 179 . 106 GLY N N 113.8 . . 180 . 106 GLY H H 7.79 . . stop_ save_ save_shift_set_3 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_3 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.7 . . 2 . 3 THR H H 8.75 . . 3 . 4 TYR N N 127.0 . . 4 . 4 TYR H H 8.84 . . 5 . 5 THR N N 118.6 . . 6 . 5 THR H H 8.60 . . 7 . 6 VAL N N 129.9 . . 8 . 6 VAL H H 9.35 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.07 . . 11 . 8 LEU N N 122.0 . . 12 . 8 LEU H H 8.87 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.68 . . 15 . 10 SER N N 119.6 . . 16 . 10 SER H H 8.67 . . 17 . 11 ASP N N 121.0 . . 18 . 11 ASP H H 9.48 . . 19 . 13 GLY N N 108.9 . . 20 . 13 GLY H H 8.33 . . 21 . 14 LEU N N 117.4 . . 22 . 14 LEU H H 7.46 . . 23 . 15 LEU N N 124.9 . . 24 . 15 LEU H H 8.39 . . 25 . 16 VAL N N 112.6 . . 26 . 16 VAL H H 7.48 . . 27 . 17 PHE N N 120.0 . . 28 . 17 PHE H H 8.64 . . 29 . 18 GLU N N 122.1 . . 30 . 18 GLU H H 9.02 . . 31 . 20 ALA N N 117.1 . . 32 . 20 ALA H H 8.14 . . 33 . 21 LYS N N 115.9 . . 34 . 21 LYS H H 7.39 . . 35 . 22 LEU N N 121.5 . . 36 . 22 LEU H H 7.77 . . 37 . 23 THR N N 121.1 . . 38 . 23 THR H H 8.22 . . 39 . 24 ILE N N 120.8 . . 40 . 24 ILE H H 8.93 . . 41 . 25 LYS N N 119.7 . . 42 . 25 LYS H H 9.00 . . 43 . 27 GLY N N 114.6 . . 44 . 27 GLY H H 7.11 . . 45 . 28 ASP N N 119.9 . . 46 . 28 ASP H H 7.90 . . 47 . 29 THR N N 114.8 . . 48 . 29 THR H H 8.69 . . 49 . 30 VAL N N 126.5 . . 50 . 30 VAL H H 9.18 . . 51 . 31 GLU N N 128.7 . . 52 . 31 GLU H H 9.20 . . 53 . 32 PHE N N 126.0 . . 54 . 32 PHE H H 9.13 . . 55 . 33 LEU N N 125.2 . . 56 . 33 LEU H H 8.97 . . 57 . 34 ASN N N 127.5 . . 58 . 34 ASN H H 9.33 . . 59 . 35 ASN N N 129.8 . . 60 . 35 ASN H H 8.81 . . 61 . 36 LYS N N 116.7 . . 62 . 36 LYS H H 8.13 . . 63 . 37 VAL N N 115.3 . . 64 . 37 VAL H H 8.92 . . 65 . 40 HIS N N 112.7 . . 66 . 40 HIS H H 7.18 . . 67 . 41 ASN N N 123.1 . . 68 . 41 ASN H H 9.88 . . 69 . 42 VAL N N 109.2 . . 70 . 42 VAL H H 7.05 . . 71 . 43 VAL N N 128.2 . . 72 . 43 VAL H H 9.42 . . 73 . 44 PHE N N 125.5 . . 74 . 44 PHE H H 8.70 . . 75 . 45 ASP N N 124.1 . . 76 . 45 ASP H H 8.40 . . 77 . 46 ALA N N 128.2 . . 78 . 46 ALA H H 8.62 . . 79 . 47 ALA N N 117.5 . . 80 . 47 ALA H H 8.46 . . 81 . 48 LEU N N 123.1 . . 82 . 48 LEU H H 8.67 . . 83 . 49 ASN N N 114.5 . . 84 . 49 ASN H H 8.05 . . 85 . 51 ALA N N 115.5 . . 86 . 51 ALA H H 7.01 . . 87 . 52 LYS N N 120.5 . . 88 . 52 LYS H H 7.96 . . 89 . 53 SER N N 109.8 . . 90 . 53 SER H H 8.21 . . 91 . 56 LEU N N 123.7 . . 92 . 56 LEU H H 8.14 . . 93 . 57 ALA N N 119.7 . . 94 . 57 ALA H H 7.56 . . 95 . 58 LYS N N 120.7 . . 96 . 58 LYS H H 8.52 . . 97 . 59 SER N N 115.3 . . 98 . 59 SER H H 7.74 . . 99 . 60 LEU N N 120.8 . . 100 . 60 LEU H H 6.89 . . 101 . 61 SER N N 110.9 . . 102 . 61 SER H H 6.90 . . 103 . 62 HIS N N 122.2 . . 104 . 62 HIS H H 9.61 . . 105 . 63 LYS N N 122.7 . . 106 . 63 LYS H H 8.63 . . 107 . 64 GLN N N 120.1 . . 108 . 64 GLN H H 8.35 . . 109 . 65 LEU N N 121.3 . . 110 . 65 LEU H H 8.16 . . 111 . 66 LEU N N 125.0 . . 112 . 66 LEU H H 9.52 . . 113 . 67 MET N N 121.9 . . 114 . 67 MET H H 8.07 . . 115 . 68 SER N N 113.7 . . 116 . 68 SER H H 8.38 . . 117 . 70 GLY N N 112.9 . . 118 . 70 GLY H H 9.04 . . 119 . 71 GLN N N 120.0 . . 120 . 71 GLN H H 7.54 . . 121 . 72 SER N N 116.1 . . 122 . 72 SER H H 8.64 . . 123 . 73 THR N N 116.0 . . 124 . 73 THR H H 8.74 . . 125 . 74 SER N N 117.7 . . 126 . 74 SER H H 8.21 . . 127 . 75 THR N N 121.4 . . 128 . 75 THR H H 9.55 . . 129 . 76 THR N N 127.0 . . 130 . 76 THR H H 9.11 . . 131 . 77 PHE N N 131.6 . . 132 . 77 PHE H H 9.18 . . 133 . 79 ALA N N 123.2 . . 134 . 79 ALA H H 8.82 . . 135 . 80 ASP N N 113.2 . . 136 . 80 ASP H H 8.00 . . 137 . 81 ALA N N 124.6 . . 138 . 81 ALA H H 7.58 . . 139 . 83 ALA N N 124.6 . . 140 . 83 ALA H H 8.38 . . 141 . 84 GLY N N 107.4 . . 142 . 84 GLY H H 8.86 . . 143 . 85 GLU N N 119.8 . . 144 . 85 GLU H H 8.48 . . 145 . 86 TYR N N 125.6 . . 146 . 86 TYR H H 10.17 . . 147 . 87 THR N N 121.5 . . 148 . 87 THR H H 8.62 . . 149 . 88 PHE N N 126.3 . . 150 . 88 PHE H H 8.58 . . 151 . 89 TYR N N 115.4 . . 152 . 89 TYR H H 8.92 . . 153 . 90 CYS N N 125.2 . . 154 . 90 CYS H H 7.75 . . 155 . 91 GLU N N 125.6 . . 156 . 91 GLU H H 10.04 . . 157 . 93 HIS N N 115.8 . . 158 . 93 HIS H H 8.66 . . 159 . 94 ARG N N 129.4 . . 160 . 94 ARG H H 8.50 . . 161 . 96 ALA N N 121.7 . . 162 . 96 ALA H H 7.57 . . 163 . 97 GLY N N 106.4 . . 164 . 97 GLY H H 8.07 . . 165 . 98 MET N N 124.3 . . 166 . 98 MET H H 7.65 . . 167 . 99 VAL N N 125.8 . . 168 . 99 VAL H H 7.94 . . 169 . 100 GLY N N 118.2 . . 170 . 100 GLY H H 8.99 . . 171 . 101 LYS N N 117.6 . . 172 . 101 LYS H H 8.27 . . 173 . 102 ILE N N 127.5 . . 174 . 102 ILE H H 9.48 . . 175 . 103 THR N N 126.0 . . 176 . 103 THR H H 9.27 . . 177 . 104 VAL N N 128.7 . . 178 . 104 VAL H H 9.32 . . 179 . 105 ALA N N 133.7 . . 180 . 105 ALA H H 9.25 . . 181 . 106 GLY N N 113.8 . . 182 . 106 GLY H H 7.79 . . stop_ save_ save_shift_set_4 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_4 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.7 . . 2 . 3 THR H H 8.77 . . 3 . 4 TYR N N 127.0 . . 4 . 4 TYR H H 8.84 . . 5 . 5 THR N N 118.6 . . 6 . 5 THR H H 8.60 . . 7 . 6 VAL N N 129.9 . . 8 . 6 VAL H H 9.34 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.07 . . 11 . 8 LEU N N 122.0 . . 12 . 8 LEU H H 8.87 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.68 . . 15 . 10 SER N N 119.6 . . 16 . 10 SER H H 8.67 . . 17 . 11 ASP N N 121.0 . . 18 . 11 ASP H H 9.48 . . 19 . 13 GLY N N 108.9 . . 20 . 13 GLY H H 8.33 . . 21 . 14 LEU N N 117.4 . . 22 . 14 LEU H H 7.46 . . 23 . 15 LEU N N 124.9 . . 24 . 15 LEU H H 8.39 . . 25 . 16 VAL N N 112.6 . . 26 . 16 VAL H H 7.48 . . 27 . 17 PHE N N 120.0 . . 28 . 17 PHE H H 8.64 . . 29 . 18 GLU N N 122.1 . . 30 . 18 GLU H H 9.01 . . 31 . 20 ALA N N 117.1 . . 32 . 20 ALA H H 8.14 . . 33 . 21 LYS N N 115.9 . . 34 . 21 LYS H H 7.39 . . 35 . 22 LEU N N 121.5 . . 36 . 22 LEU H H 7.77 . . 37 . 23 THR N N 121.1 . . 38 . 23 THR H H 8.22 . . 39 . 24 ILE N N 120.8 . . 40 . 24 ILE H H 8.93 . . 41 . 25 LYS N N 119.6 . . 42 . 25 LYS H H 8.99 . . 43 . 27 GLY N N 114.6 . . 44 . 27 GLY H H 7.10 . . 45 . 28 ASP N N 119.9 . . 46 . 28 ASP H H 7.91 . . 47 . 29 THR N N 114.8 . . 48 . 29 THR H H 8.68 . . 49 . 30 VAL N N 126.5 . . 50 . 30 VAL H H 9.17 . . 51 . 31 GLU N N 128.8 . . 52 . 31 GLU H H 9.21 . . 53 . 32 PHE N N 126.0 . . 54 . 32 PHE H H 9.14 . . 55 . 33 LEU N N 125.3 . . 56 . 33 LEU H H 8.97 . . 57 . 34 ASN N N 127.4 . . 58 . 34 ASN H H 9.33 . . 59 . 35 ASN N N 129.7 . . 60 . 35 ASN H H 8.81 . . 61 . 36 LYS N N 116.7 . . 62 . 36 LYS H H 8.13 . . 63 . 37 VAL N N 115.3 . . 64 . 37 VAL H H 8.93 . . 65 . 40 HIS N N 112.6 . . 66 . 40 HIS H H 7.18 . . 67 . 41 ASN N N 123.1 . . 68 . 41 ASN H H 9.88 . . 69 . 42 VAL N N 109.1 . . 70 . 42 VAL H H 7.01 . . 71 . 43 VAL N N 128.3 . . 72 . 43 VAL H H 9.43 . . 73 . 44 PHE N N 125.5 . . 74 . 44 PHE H H 8.71 . . 75 . 45 ASP N N 124.1 . . 76 . 45 ASP H H 8.39 . . 77 . 46 ALA N N 128.2 . . 78 . 46 ALA H H 8.62 . . 79 . 47 ALA N N 117.6 . . 80 . 47 ALA H H 8.45 . . 81 . 48 LEU N N 123.2 . . 82 . 48 LEU H H 8.67 . . 83 . 49 ASN N N 114.5 . . 84 . 49 ASN H H 8.06 . . 85 . 51 ALA N N 115.5 . . 86 . 51 ALA H H 7.01 . . 87 . 52 LYS N N 120.5 . . 88 . 52 LYS H H 7.96 . . 89 . 53 SER N N 109.8 . . 90 . 53 SER H H 8.22 . . 91 . 54 ALA N N 134.0 . . 92 . 54 ALA H H 9.19 . . 93 . 55 ASP N N 120.0 . . 94 . 55 ASP H H 8.41 . . 95 . 56 LEU N N 123.7 . . 96 . 56 LEU H H 8.14 . . 97 . 57 ALA N N 119.7 . . 98 . 57 ALA H H 7.57 . . 99 . 58 LYS N N 120.8 . . 100 . 58 LYS H H 8.53 . . 101 . 59 SER N N 115.3 . . 102 . 59 SER H H 7.74 . . 103 . 60 LEU N N 120.7 . . 104 . 60 LEU H H 6.89 . . 105 . 61 SER N N 111.0 . . 106 . 61 SER H H 6.92 . . 107 . 62 HIS N N 121.6 . . 108 . 62 HIS H H 9.62 . . 109 . 63 LYS N N 122.8 . . 110 . 63 LYS H H 8.69 . . 111 . 64 GLN N N 120.2 . . 112 . 64 GLN H H 8.36 . . 113 . 65 LEU N N 121.5 . . 114 . 65 LEU H H 8.19 . . 115 . 66 LEU N N 125.0 . . 116 . 66 LEU H H 9.52 . . 117 . 67 MET N N 121.9 . . 118 . 67 MET H H 8.08 . . 119 . 68 SER N N 113.7 . . 120 . 68 SER H H 8.37 . . 121 . 70 GLY N N 112.8 . . 122 . 70 GLY H H 9.04 . . 123 . 71 GLN N N 119.9 . . 124 . 71 GLN H H 7.53 . . 125 . 72 SER N N 116.0 . . 126 . 72 SER H H 8.65 . . 127 . 73 THR N N 116.2 . . 128 . 73 THR H H 8.74 . . 129 . 74 SER N N 118.0 . . 130 . 74 SER H H 8.18 . . 131 . 75 THR N N 121.2 . . 132 . 75 THR H H 9.55 . . 133 . 76 THR N N 127.0 . . 134 . 76 THR H H 9.11 . . 135 . 77 PHE N N 131.6 . . 136 . 77 PHE H H 9.18 . . 137 . 79 ALA N N 123.2 . . 138 . 79 ALA H H 8.82 . . 139 . 80 ASP N N 113.2 . . 140 . 80 ASP H H 8.01 . . 141 . 81 ALA N N 124.6 . . 142 . 81 ALA H H 7.58 . . 143 . 83 ALA N N 124.6 . . 144 . 83 ALA H H 8.38 . . 145 . 84 GLY N N 107.4 . . 146 . 84 GLY H H 8.86 . . 147 . 85 GLU N N 119.8 . . 148 . 85 GLU H H 8.48 . . 149 . 86 TYR N N 125.6 . . 150 . 86 TYR H H 10.17 . . 151 . 87 THR N N 121.5 . . 152 . 87 THR H H 8.62 . . 153 . 88 PHE N N 126.3 . . 154 . 88 PHE H H 8.58 . . 155 . 89 TYR N N 115.4 . . 156 . 89 TYR H H 8.93 . . 157 . 90 CYS N N 125.2 . . 158 . 90 CYS H H 7.75 . . 159 . 91 GLU N N 125.6 . . 160 . 91 GLU H H 10.04 . . 161 . 93 HIS N N 115.7 . . 162 . 93 HIS H H 8.65 . . 163 . 94 ARG N N 129.4 . . 164 . 94 ARG H H 8.50 . . 165 . 95 GLY N N 107.6 . . 166 . 95 GLY H H 9.10 . . 167 . 96 ALA N N 121.7 . . 168 . 96 ALA H H 7.57 . . 169 . 97 GLY N N 106.4 . . 170 . 97 GLY H H 8.07 . . 171 . 98 MET N N 124.3 . . 172 . 98 MET H H 7.65 . . 173 . 99 VAL N N 125.8 . . 174 . 99 VAL H H 7.94 . . 175 . 100 GLY N N 118.2 . . 176 . 100 GLY H H 8.99 . . 177 . 101 LYS N N 117.6 . . 178 . 101 LYS H H 8.27 . . 179 . 102 ILE N N 127.5 . . 180 . 102 ILE H H 9.48 . . 181 . 103 THR N N 126.0 . . 182 . 103 THR H H 9.27 . . 183 . 104 VAL N N 128.7 . . 184 . 104 VAL H H 9.32 . . 185 . 105 ALA N N 133.7 . . 186 . 105 ALA H H 9.25 . . 187 . 106 GLY N N 113.8 . . 188 . 106 GLY H H 7.80 . . stop_ save_ save_shift_set_5 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_5 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.7 . . 2 . 3 THR H H 8.78 . . 3 . 4 TYR N N 127.0 . . 4 . 4 TYR H H 8.84 . . 5 . 5 THR N N 118.5 . . 6 . 5 THR H H 8.61 . . 7 . 6 VAL N N 129.8 . . 8 . 6 VAL H H 9.33 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.07 . . 11 . 8 LEU N N 122.0 . . 12 . 8 LEU H H 8.86 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.68 . . 15 . 10 SER N N 119.7 . . 16 . 10 SER H H 8.68 . . 17 . 11 ASP N N 121.0 . . 18 . 11 ASP H H 9.48 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.50 . . 21 . 13 GLY N N 108.9 . . 22 . 13 GLY H H 8.33 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.46 . . 25 . 15 LEU N N 124.9 . . 26 . 15 LEU H H 8.40 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.48 . . 29 . 17 PHE N N 120.0 . . 30 . 17 PHE H H 8.65 . . 31 . 18 GLU N N 122.1 . . 32 . 18 GLU H H 9.01 . . 33 . 20 ALA N N 117.1 . . 34 . 20 ALA H H 8.13 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.39 . . 37 . 22 LEU N N 121.5 . . 38 . 22 LEU H H 7.77 . . 39 . 23 THR N N 121.1 . . 40 . 23 THR H H 8.22 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.93 . . 43 . 25 LYS N N 119.6 . . 44 . 25 LYS H H 8.99 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.10 . . 47 . 28 ASP N N 119.9 . . 48 . 28 ASP H H 7.91 . . 49 . 29 THR N N 114.8 . . 50 . 29 THR H H 8.67 . . 51 . 30 VAL N N 126.5 . . 52 . 30 VAL H H 9.16 . . 53 . 31 GLU N N 128.8 . . 54 . 31 GLU H H 9.22 . . 55 . 32 PHE N N 125.9 . . 56 . 32 PHE H H 9.15 . . 57 . 33 LEU N N 125.3 . . 58 . 33 LEU H H 8.97 . . 59 . 34 ASN N N 127.4 . . 60 . 34 ASN H H 9.33 . . 61 . 35 ASN N N 129.7 . . 62 . 35 ASN H H 8.81 . . 63 . 36 LYS N N 116.7 . . 64 . 36 LYS H H 8.13 . . 65 . 37 VAL N N 115.4 . . 66 . 37 VAL H H 8.93 . . 67 . 40 HIS N N 112.6 . . 68 . 40 HIS H H 7.18 . . 69 . 41 ASN N N 123.0 . . 70 . 41 ASN H H 9.88 . . 71 . 42 VAL N N 109.0 . . 72 . 42 VAL H H 6.97 . . 73 . 43 VAL N N 128.4 . . 74 . 43 VAL H H 9.44 . . 75 . 44 PHE N N 125.5 . . 76 . 44 PHE H H 8.71 . . 77 . 45 ASP N N 124.0 . . 78 . 45 ASP H H 8.39 . . 79 . 46 ALA N N 128.2 . . 80 . 46 ALA H H 8.62 . . 81 . 47 ALA N N 117.6 . . 82 . 47 ALA H H 8.45 . . 83 . 48 LEU N N 123.1 . . 84 . 48 LEU H H 8.66 . . 85 . 49 ASN N N 114.6 . . 86 . 49 ASN H H 8.06 . . 87 . 51 ALA N N 115.5 . . 88 . 51 ALA H H 7.01 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 7.96 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.22 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.19 . . 95 . 55 ASP N N 120.0 . . 96 . 55 ASP H H 8.41 . . 97 . 56 LEU N N 123.7 . . 98 . 56 LEU H H 8.14 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.57 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.54 . . 103 . 59 SER N N 115.3 . . 104 . 59 SER H H 7.74 . . 105 . 60 LEU N N 120.6 . . 106 . 60 LEU H H 6.89 . . 107 . 61 SER N N 111.1 . . 108 . 61 SER H H 6.94 . . 109 . 62 HIS N N 121.1 . . 110 . 62 HIS H H 9.63 . . 111 . 63 LYS N N 123.1 . . 112 . 63 LYS H H 8.74 . . 113 . 64 GLN N N 120.3 . . 114 . 64 GLN H H 8.37 . . 115 . 65 LEU N N 121.7 . . 116 . 65 LEU H H 8.20 . . 117 . 66 LEU N N 125.0 . . 118 . 66 LEU H H 9.51 . . 119 . 67 MET N N 121.9 . . 120 . 67 MET H H 8.09 . . 121 . 68 SER N N 113.6 . . 122 . 68 SER H H 8.36 . . 123 . 70 GLY N N 112.8 . . 124 . 70 GLY H H 9.03 . . 125 . 71 GLN N N 119.9 . . 126 . 71 GLN H H 7.52 . . 127 . 72 SER N N 115.9 . . 128 . 72 SER H H 8.65 . . 129 . 73 THR N N 116.3 . . 130 . 73 THR H H 8.74 . . 131 . 74 SER N N 118.2 . . 132 . 74 SER H H 8.17 . . 133 . 75 THR N N 121.1 . . 134 . 75 THR H H 9.55 . . 135 . 76 THR N N 127.1 . . 136 . 76 THR H H 9.11 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.18 . . 139 . 79 ALA N N 123.2 . . 140 . 79 ALA H H 8.82 . . 141 . 80 ASP N N 113.2 . . 142 . 80 ASP H H 8.01 . . 143 . 81 ALA N N 124.6 . . 144 . 81 ALA H H 7.58 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.38 . . 147 . 84 GLY N N 107.4 . . 148 . 84 GLY H H 8.86 . . 149 . 85 GLU N N 119.8 . . 150 . 85 GLU H H 8.48 . . 151 . 86 TYR N N 125.6 . . 152 . 86 TYR H H 10.17 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.62 . . 155 . 88 PHE N N 126.3 . . 156 . 88 PHE H H 8.58 . . 157 . 89 TYR N N 115.3 . . 158 . 89 TYR H H 8.94 . . 159 . 90 CYS N N 125.2 . . 160 . 90 CYS H H 7.75 . . 161 . 91 GLU N N 125.6 . . 162 . 91 GLU H H 10.03 . . 163 . 93 HIS N N 115.7 . . 164 . 93 HIS H H 8.62 . . 165 . 94 ARG N N 129.3 . . 166 . 94 ARG H H 8.49 . . 167 . 95 GLY N N 107.6 . . 168 . 95 GLY H H 9.09 . . 169 . 96 ALA N N 121.7 . . 170 . 96 ALA H H 7.57 . . 171 . 97 GLY N N 106.4 . . 172 . 97 GLY H H 8.07 . . 173 . 98 MET N N 124.3 . . 174 . 98 MET H H 7.65 . . 175 . 99 VAL N N 125.8 . . 176 . 99 VAL H H 7.94 . . 177 . 100 GLY N N 118.2 . . 178 . 100 GLY H H 8.98 . . 179 . 101 LYS N N 117.6 . . 180 . 101 LYS H H 8.27 . . 181 . 102 ILE N N 127.5 . . 182 . 102 ILE H H 9.48 . . 183 . 103 THR N N 126.0 . . 184 . 103 THR H H 9.27 . . 185 . 104 VAL N N 128.7 . . 186 . 104 VAL H H 9.33 . . 187 . 105 ALA N N 133.7 . . 188 . 105 ALA H H 9.25 . . 189 . 106 GLY N N 113.8 . . 190 . 106 GLY H H 7.80 . . stop_ save_ save_shift_set_6 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_6 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.6 . . 2 . 3 THR H H 8.79 . . 3 . 4 TYR N N 127.0 . . 4 . 4 TYR H H 8.84 . . 5 . 5 THR N N 118.4 . . 6 . 5 THR H H 8.62 . . 7 . 6 VAL N N 129.7 . . 8 . 6 VAL H H 9.32 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.08 . . 11 . 8 LEU N N 121.9 . . 12 . 8 LEU H H 8.86 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.67 . . 15 . 10 SER N N 119.7 . . 16 . 10 SER H H 8.68 . . 17 . 11 ASP N N 121.0 . . 18 . 11 ASP H H 9.48 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.51 . . 21 . 13 GLY N N 108.9 . . 22 . 13 GLY H H 8.33 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.47 . . 25 . 15 LEU N N 125.0 . . 26 . 15 LEU H H 8.43 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.50 . . 29 . 17 PHE N N 120.1 . . 30 . 17 PHE H H 8.67 . . 31 . 18 GLU N N 122.1 . . 32 . 18 GLU H H 9.01 . . 33 . 20 ALA N N 117.0 . . 34 . 20 ALA H H 8.12 . . 35 . 21 LYS N N 115.8 . . 36 . 21 LYS H H 7.39 . . 37 . 22 LEU N N 121.5 . . 38 . 22 LEU H H 7.76 . . 39 . 23 THR N N 121.1 . . 40 . 23 THR H H 8.23 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.93 . . 43 . 25 LYS N N 119.6 . . 44 . 25 LYS H H 8.98 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.10 . . 47 . 28 ASP N N 119.8 . . 48 . 28 ASP H H 7.91 . . 49 . 29 THR N N 114.7 . . 50 . 29 THR H H 8.67 . . 51 . 30 VAL N N 126.4 . . 52 . 30 VAL H H 9.16 . . 53 . 31 GLU N N 128.8 . . 54 . 31 GLU H H 9.23 . . 55 . 32 PHE N N 125.9 . . 56 . 32 PHE H H 9.16 . . 57 . 33 LEU N N 125.3 . . 58 . 33 LEU H H 8.98 . . 59 . 34 ASN N N 127.3 . . 60 . 34 ASN H H 9.34 . . 61 . 35 ASN N N 129.7 . . 62 . 35 ASN H H 8.79 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.14 . . 65 . 37 VAL N N 115.6 . . 66 . 37 VAL H H 8.95 . . 67 . 40 HIS N N 112.4 . . 68 . 40 HIS H H 7.21 . . 69 . 41 ASN N N 122.9 . . 70 . 41 ASN H H 9.85 . . 71 . 42 VAL N N 108.9 . . 72 . 42 VAL H H 6.95 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.43 . . 75 . 44 PHE N N 125.5 . . 76 . 44 PHE H H 8.72 . . 77 . 45 ASP N N 124.0 . . 78 . 45 ASP H H 8.39 . . 79 . 46 ALA N N 128.2 . . 80 . 46 ALA H H 8.63 . . 81 . 47 ALA N N 117.6 . . 82 . 47 ALA H H 8.46 . . 83 . 48 LEU N N 123.1 . . 84 . 48 LEU H H 8.67 . . 85 . 49 ASN N N 114.5 . . 86 . 49 ASN H H 8.06 . . 87 . 51 ALA N N 115.5 . . 88 . 51 ALA H H 7.01 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 7.96 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.22 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.19 . . 95 . 55 ASP N N 120.0 . . 96 . 55 ASP H H 8.42 . . 97 . 56 LEU N N 123.7 . . 98 . 56 LEU H H 8.15 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.58 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.55 . . 103 . 59 SER N N 115.3 . . 104 . 59 SER H H 7.75 . . 105 . 60 LEU N N 120.5 . . 106 . 60 LEU H H 6.90 . . 107 . 61 SER N N 111.1 . . 108 . 61 SER H H 6.97 . . 109 . 62 HIS N N 120.7 . . 110 . 62 HIS H H 9.63 . . 111 . 63 LYS N N 123.3 . . 112 . 63 LYS H H 8.78 . . 113 . 64 GLN N N 120.3 . . 114 . 64 GLN H H 8.38 . . 115 . 65 LEU N N 121.8 . . 116 . 65 LEU H H 8.23 . . 117 . 66 LEU N N 124.9 . . 118 . 66 LEU H H 9.49 . . 119 . 67 MET N N 121.9 . . 120 . 67 MET H H 8.11 . . 121 . 68 SER N N 113.7 . . 122 . 68 SER H H 8.37 . . 123 . 70 GLY N N 112.8 . . 124 . 70 GLY H H 9.02 . . 125 . 71 GLN N N 119.8 . . 126 . 71 GLN H H 7.52 . . 127 . 72 SER N N 115.8 . . 128 . 72 SER H H 8.66 . . 129 . 73 THR N N 116.2 . . 130 . 73 THR H H 8.73 . . 131 . 74 SER N N 118.3 . . 132 . 74 SER H H 8.16 . . 133 . 75 THR N N 121.0 . . 134 . 75 THR H H 9.55 . . 135 . 76 THR N N 127.1 . . 136 . 76 THR H H 9.12 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.17 . . 139 . 79 ALA N N 123.1 . . 140 . 79 ALA H H 8.83 . . 141 . 80 ASP N N 113.1 . . 142 . 80 ASP H H 8.00 . . 143 . 81 ALA N N 124.6 . . 144 . 81 ALA H H 7.58 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.39 . . 147 . 84 GLY N N 107.3 . . 148 . 84 GLY H H 8.86 . . 149 . 85 GLU N N 119.7 . . 150 . 85 GLU H H 8.49 . . 151 . 86 TYR N N 125.5 . . 152 . 86 TYR H H 10.17 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.63 . . 155 . 88 PHE N N 126.2 . . 156 . 88 PHE H H 8.58 . . 157 . 89 TYR N N 115.2 . . 158 . 89 TYR H H 8.96 . . 159 . 90 CYS N N 125.1 . . 160 . 90 CYS H H 7.75 . . 161 . 91 GLU N N 125.6 . . 162 . 91 GLU H H 10.03 . . 163 . 93 HIS N N 115.3 . . 164 . 93 HIS H H 8.58 . . 165 . 94 ARG N N 129.2 . . 166 . 94 ARG H H 8.46 . . 167 . 95 GLY N N 107.6 . . 168 . 95 GLY H H 9.09 . . 169 . 96 ALA N N 121.6 . . 170 . 96 ALA H H 7.56 . . 171 . 97 GLY N N 106.3 . . 172 . 97 GLY H H 8.08 . . 173 . 98 MET N N 124.0 . . 174 . 98 MET H H 7.63 . . 175 . 99 VAL N N 125.9 . . 176 . 99 VAL H H 7.95 . . 177 . 100 GLY N N 118.1 . . 178 . 100 GLY H H 8.97 . . 179 . 101 LYS N N 117.6 . . 180 . 101 LYS H H 8.28 . . 181 . 102 ILE N N 127.4 . . 182 . 102 ILE H H 9.48 . . 183 . 103 THR N N 126.0 . . 184 . 103 THR H H 9.27 . . 185 . 104 VAL N N 128.7 . . 186 . 104 VAL H H 9.33 . . 187 . 105 ALA N N 133.7 . . 188 . 105 ALA H H 9.25 . . 189 . 106 GLY N N 113.8 . . 190 . 106 GLY H H 7.81 . . stop_ save_ save_shift_set_7 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_7 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.6 . . 2 . 3 THR H H 8.79 . . 3 . 4 TYR N N 127.0 . . 4 . 4 TYR H H 8.84 . . 5 . 5 THR N N 118.5 . . 6 . 5 THR H H 8.63 . . 7 . 6 VAL N N 129.7 . . 8 . 6 VAL H H 9.31 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.09 . . 11 . 8 LEU N N 121.9 . . 12 . 8 LEU H H 8.86 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.66 . . 15 . 10 SER N N 119.7 . . 16 . 10 SER H H 8.69 . . 17 . 11 ASP N N 121.0 . . 18 . 11 ASP H H 9.47 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.51 . . 21 . 13 GLY N N 108.9 . . 22 . 13 GLY H H 8.33 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.46 . . 25 . 15 LEU N N 125.1 . . 26 . 15 LEU H H 8.44 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.50 . . 29 . 17 PHE N N 120.2 . . 30 . 17 PHE H H 8.69 . . 31 . 18 GLU N N 122.2 . . 32 . 18 GLU H H 9.00 . . 33 . 20 ALA N N 116.9 . . 34 . 20 ALA H H 8.10 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.39 . . 37 . 22 LEU N N 121.5 . . 38 . 22 LEU H H 7.77 . . 39 . 23 THR N N 121.1 . . 40 . 23 THR H H 8.23 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.93 . . 43 . 25 LYS N N 119.6 . . 44 . 25 LYS H H 8.98 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.10 . . 47 . 28 ASP N N 119.8 . . 48 . 28 ASP H H 7.91 . . 49 . 29 THR N N 114.8 . . 50 . 29 THR H H 8.67 . . 51 . 30 VAL N N 126.4 . . 52 . 30 VAL H H 9.16 . . 53 . 31 GLU N N 128.8 . . 54 . 31 GLU H H 9.23 . . 55 . 32 PHE N N 126.0 . . 56 . 32 PHE H H 9.16 . . 57 . 33 LEU N N 125.3 . . 58 . 33 LEU H H 8.97 . . 59 . 34 ASN N N 127.3 . . 60 . 34 ASN H H 9.34 . . 61 . 35 ASN N N 129.7 . . 62 . 35 ASN H H 8.78 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.16 . . 65 . 37 VAL N N 115.6 . . 66 . 37 VAL H H 8.96 . . 67 . 40 HIS N N 112.3 . . 68 . 40 HIS H H 7.22 . . 69 . 41 ASN N N 122.9 . . 70 . 41 ASN H H 9.83 . . 71 . 42 VAL N N 108.9 . . 72 . 42 VAL H H 6.95 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.42 . . 75 . 44 PHE N N 125.5 . . 76 . 44 PHE H H 8.73 . . 77 . 45 ASP N N 124.0 . . 78 . 45 ASP H H 8.39 . . 79 . 46 ALA N N 128.2 . . 80 . 46 ALA H H 8.62 . . 81 . 47 ALA N N 117.6 . . 82 . 47 ALA H H 8.46 . . 83 . 48 LEU N N 123.1 . . 84 . 48 LEU H H 8.66 . . 85 . 49 ASN N N 114.6 . . 86 . 49 ASN H H 8.07 . . 87 . 51 ALA N N 115.5 . . 88 . 51 ALA H H 7.00 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 7.96 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.22 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.19 . . 95 . 55 ASP N N 120.0 . . 96 . 55 ASP H H 8.42 . . 97 . 56 LEU N N 123.8 . . 98 . 56 LEU H H 8.14 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.57 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.55 . . 103 . 59 SER N N 115.4 . . 104 . 59 SER H H 7.75 . . 105 . 60 LEU N N 120.5 . . 106 . 60 LEU H H 6.90 . . 107 . 61 SER N N 111.2 . . 108 . 61 SER H H 6.97 . . 109 . 62 HIS N N 120.6 . . 110 . 62 HIS H H 9.63 . . 111 . 63 LYS N N 123.4 . . 112 . 63 LYS H H 8.79 . . 113 . 64 GLN N N 120.4 . . 114 . 64 GLN H H 8.39 . . 115 . 65 LEU N N 121.8 . . 116 . 65 LEU H H 8.23 . . 117 . 66 LEU N N 124.9 . . 118 . 66 LEU H H 9.48 . . 119 . 67 MET N N 122.0 . . 120 . 67 MET H H 8.11 . . 121 . 68 SER N N 113.7 . . 122 . 68 SER H H 8.38 . . 123 . 70 GLY N N 112.8 . . 124 . 70 GLY H H 9.02 . . 125 . 71 GLN N N 119.8 . . 126 . 71 GLN H H 7.51 . . 127 . 72 SER N N 115.8 . . 128 . 72 SER H H 8.67 . . 129 . 73 THR N N 116.3 . . 130 . 73 THR H H 8.74 . . 131 . 74 SER N N 118.3 . . 132 . 74 SER H H 8.16 . . 133 . 75 THR N N 121.0 . . 134 . 75 THR H H 9.55 . . 135 . 76 THR N N 127.2 . . 136 . 76 THR H H 9.12 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.18 . . 139 . 79 ALA N N 123.1 . . 140 . 79 ALA H H 8.84 . . 141 . 80 ASP N N 113.2 . . 142 . 80 ASP H H 8.01 . . 143 . 81 ALA N N 124.6 . . 144 . 81 ALA H H 7.58 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.38 . . 147 . 84 GLY N N 107.4 . . 148 . 84 GLY H H 8.86 . . 149 . 85 GLU N N 119.8 . . 150 . 85 GLU H H 8.48 . . 151 . 86 TYR N N 125.5 . . 152 . 86 TYR H H 10.17 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.63 . . 155 . 88 PHE N N 126.2 . . 156 . 88 PHE H H 8.58 . . 157 . 89 TYR N N 115.3 . . 158 . 89 TYR H H 8.97 . . 159 . 90 CYS N N 125.1 . . 160 . 90 CYS H H 7.75 . . 161 . 91 GLU N N 125.7 . . 162 . 91 GLU H H 10.03 . . 163 . 93 HIS N N 115.1 . . 164 . 93 HIS H H 8.54 . . 165 . 94 ARG N N 129.1 . . 166 . 94 ARG H H 8.44 . . 167 . 95 GLY N N 107.7 . . 168 . 95 GLY H H 9.10 . . 169 . 96 ALA N N 121.6 . . 170 . 96 ALA H H 7.54 . . 171 . 97 GLY N N 106.4 . . 172 . 97 GLY H H 8.08 . . 173 . 98 MET N N 123.9 . . 174 . 98 MET H H 7.61 . . 175 . 99 VAL N N 126.0 . . 176 . 99 VAL H H 7.96 . . 177 . 100 GLY N N 118.0 . . 178 . 100 GLY H H 8.97 . . 179 . 101 LYS N N 117.6 . . 180 . 101 LYS H H 8.27 . . 181 . 102 ILE N N 127.4 . . 182 . 102 ILE H H 9.47 . . 183 . 103 THR N N 126.0 . . 184 . 103 THR H H 9.27 . . 185 . 104 VAL N N 128.7 . . 186 . 104 VAL H H 9.32 . . 187 . 105 ALA N N 133.7 . . 188 . 105 ALA H H 9.25 . . 189 . 106 GLY N N 113.8 . . 190 . 106 GLY H H 7.81 . . stop_ save_ save_shift_set_8 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_8 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.5 . . 2 . 3 THR H H 8.79 . . 3 . 4 TYR N N 127.1 . . 4 . 4 TYR H H 8.85 . . 5 . 5 THR N N 118.2 . . 6 . 5 THR H H 8.62 . . 7 . 6 VAL N N 129.5 . . 8 . 6 VAL H H 9.29 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.10 . . 11 . 8 LEU N N 121.7 . . 12 . 8 LEU H H 8.86 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.62 . . 15 . 10 SER N N 119.8 . . 16 . 10 SER H H 8.70 . . 17 . 11 ASP N N 120.9 . . 18 . 11 ASP H H 9.46 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.51 . . 21 . 13 GLY N N 108.8 . . 22 . 13 GLY H H 8.31 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.47 . . 25 . 15 LEU N N 125.2 . . 26 . 15 LEU H H 8.50 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.53 . . 29 . 17 PHE N N 120.4 . . 30 . 17 PHE H H 8.73 . . 31 . 18 GLU N N 122.3 . . 32 . 18 GLU H H 9.00 . . 33 . 20 ALA N N 116.9 . . 34 . 20 ALA H H 8.10 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.39 . . 37 . 22 LEU N N 121.5 . . 38 . 22 LEU H H 7.76 . . 39 . 23 THR N N 121.1 . . 40 . 23 THR H H 8.23 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.93 . . 43 . 25 LYS N N 119.6 . . 44 . 25 LYS H H 8.96 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.11 . . 47 . 28 ASP N N 119.8 . . 48 . 28 ASP H H 7.91 . . 49 . 29 THR N N 114.7 . . 50 . 29 THR H H 8.66 . . 51 . 30 VAL N N 126.4 . . 52 . 30 VAL H H 9.16 . . 53 . 31 GLU N N 128.6 . . 54 . 31 GLU H H 9.24 . . 55 . 32 PHE N N 126.0 . . 56 . 32 PHE H H 9.18 . . 57 . 33 LEU N N 125.3 . . 58 . 33 LEU H H 8.96 . . 59 . 34 ASN N N 127.3 . . 60 . 34 ASN H H 9.35 . . 61 . 35 ASN N N 129.6 . . 62 . 35 ASN H H 8.73 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.16 . . 65 . 37 VAL N N 116.0 . . 66 . 37 VAL H H 9.00 . . 67 . 40 HIS N N 112.0 . . 68 . 40 HIS H H 7.27 . . 69 . 41 ASN N N 122.7 . . 70 . 41 ASN H H 9.74 . . 71 . 42 VAL N N 109.1 . . 72 . 42 VAL H H 6.95 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.41 . . 75 . 44 PHE N N 125.6 . . 76 . 44 PHE H H 8.74 . . 77 . 45 ASP N N 124.0 . . 78 . 45 ASP H H 8.40 . . 79 . 46 ALA N N 128.2 . . 80 . 46 ALA H H 8.62 . . 81 . 47 ALA N N 117.6 . . 82 . 47 ALA H H 8.46 . . 83 . 48 LEU N N 123.1 . . 84 . 48 LEU H H 8.66 . . 85 . 49 ASN N N 114.6 . . 86 . 49 ASN H H 8.06 . . 87 . 51 ALA N N 115.5 . . 88 . 51 ALA H H 7.00 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 7.96 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.22 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.19 . . 95 . 55 ASP N N 120.0 . . 96 . 55 ASP H H 8.42 . . 97 . 56 LEU N N 123.7 . . 98 . 56 LEU H H 8.15 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.58 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.55 . . 103 . 59 SER N N 115.4 . . 104 . 59 SER H H 7.74 . . 105 . 60 LEU N N 120.5 . . 106 . 60 LEU H H 6.90 . . 107 . 61 SER N N 111.2 . . 108 . 61 SER H H 6.97 . . 109 . 62 HIS N N 120.4 . . 110 . 62 HIS H H 9.61 . . 111 . 63 LYS N N 123.5 . . 112 . 63 LYS H H 8.82 . . 113 . 64 GLN N N 120.5 . . 114 . 64 GLN H H 8.41 . . 115 . 65 LEU N N 121.8 . . 116 . 65 LEU H H 8.25 . . 117 . 66 LEU N N 124.8 . . 118 . 66 LEU H H 9.44 . . 119 . 67 MET N N 122.0 . . 120 . 67 MET H H 8.13 . . 121 . 68 SER N N 113.9 . . 122 . 68 SER H H 8.38 . . 123 . 70 GLY N N 112.8 . . 124 . 70 GLY H H 9.00 . . 125 . 71 GLN N N 119.8 . . 126 . 71 GLN H H 7.51 . . 127 . 72 SER N N 115.8 . . 128 . 72 SER H H 8.68 . . 129 . 73 THR N N 116.1 . . 130 . 73 THR H H 8.73 . . 131 . 74 SER N N 118.3 . . 132 . 74 SER H H 8.16 . . 133 . 75 THR N N 121.0 . . 134 . 75 THR H H 9.53 . . 135 . 76 THR N N 127.2 . . 136 . 76 THR H H 9.12 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.17 . . 139 . 79 ALA N N 123.2 . . 140 . 79 ALA H H 8.83 . . 141 . 80 ASP N N 113.1 . . 142 . 80 ASP H H 7.99 . . 143 . 81 ALA N N 124.6 . . 144 . 81 ALA H H 7.58 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.38 . . 147 . 84 GLY N N 107.4 . . 148 . 84 GLY H H 8.86 . . 149 . 85 GLU N N 119.7 . . 150 . 85 GLU H H 8.49 . . 151 . 86 TYR N N 125.5 . . 152 . 86 TYR H H 10.17 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.63 . . 155 . 88 PHE N N 126.1 . . 156 . 88 PHE H H 8.58 . . 157 . 89 TYR N N 115.2 . . 158 . 89 TYR H H 8.99 . . 159 . 90 CYS N N 124.8 . . 160 . 90 CYS H H 7.76 . . 161 . 91 GLU N N 125.7 . . 162 . 91 GLU H H 10.03 . . 163 . 94 ARG N N 128.9 . . 164 . 94 ARG H H 8.37 . . 165 . 95 GLY N N 107.7 . . 166 . 95 GLY H H 9.08 . . 167 . 96 ALA N N 121.4 . . 168 . 96 ALA H H 7.50 . . 169 . 97 GLY N N 106.3 . . 170 . 97 GLY H H 8.11 . . 171 . 98 MET N N 123.4 . . 172 . 98 MET H H 7.56 . . 173 . 99 VAL N N 126.2 . . 174 . 99 VAL H H 7.96 . . 175 . 100 GLY N N 117.9 . . 176 . 100 GLY H H 8.95 . . 177 . 101 LYS N N 117.6 . . 178 . 101 LYS H H 8.27 . . 179 . 102 ILE N N 127.4 . . 180 . 102 ILE H H 9.47 . . 181 . 103 THR N N 126.0 . . 182 . 103 THR H H 9.27 . . 183 . 104 VAL N N 128.7 . . 184 . 104 VAL H H 9.33 . . 185 . 105 ALA N N 133.7 . . 186 . 105 ALA H H 9.24 . . 187 . 106 GLY N N 113.7 . . 188 . 106 GLY H H 7.82 . . stop_ save_ save_shift_set_9 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_9 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.4 . . 2 . 3 THR H H 8.78 . . 3 . 4 TYR N N 127.1 . . 4 . 4 TYR H H 8.86 . . 5 . 5 THR N N 118.1 . . 6 . 5 THR H H 8.63 . . 7 . 6 VAL N N 129.4 . . 8 . 6 VAL H H 9.28 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.11 . . 11 . 8 LEU N N 121.6 . . 12 . 8 LEU H H 8.87 . . 13 . 9 GLY N N 114.8 . . 14 . 9 GLY H H 7.59 . . 15 . 10 SER N N 119.8 . . 16 . 10 SER H H 8.72 . . 17 . 11 ASP N N 120.9 . . 18 . 11 ASP H H 9.42 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.50 . . 21 . 13 GLY N N 108.7 . . 22 . 13 GLY H H 8.30 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.48 . . 25 . 15 LEU N N 125.4 . . 26 . 15 LEU H H 8.57 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.56 . . 29 . 17 PHE N N 120.8 . . 30 . 17 PHE H H 8.78 . . 31 . 18 GLU N N 122.4 . . 32 . 18 GLU H H 9.00 . . 33 . 20 ALA N N 116.6 . . 34 . 20 ALA H H 8.04 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.39 . . 37 . 22 LEU N N 121.5 . . 38 . 22 LEU H H 7.75 . . 39 . 23 THR N N 121.2 . . 40 . 23 THR H H 8.23 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.93 . . 43 . 25 LYS N N 119.5 . . 44 . 25 LYS H H 8.94 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.11 . . 47 . 28 ASP N N 119.8 . . 48 . 28 ASP H H 7.91 . . 49 . 29 THR N N 114.7 . . 50 . 29 THR H H 8.64 . . 51 . 30 VAL N N 126.4 . . 52 . 30 VAL H H 9.18 . . 53 . 31 GLU N N 128.5 . . 54 . 31 GLU H H 9.25 . . 55 . 32 PHE N N 126.1 . . 56 . 32 PHE H H 9.20 . . 57 . 33 LEU N N 125.2 . . 58 . 33 LEU H H 8.95 . . 59 . 34 ASN N N 127.2 . . 60 . 34 ASN H H 9.36 . . 61 . 35 ASN N N 129.6 . . 62 . 35 ASN H H 8.68 . . 63 . 36 LYS N N 116.9 . . 64 . 36 LYS H H 8.13 . . 65 . 37 VAL N N 116.3 . . 66 . 37 VAL H H 9.04 . . 67 . 40 HIS N N 111.7 . . 68 . 40 HIS H H 7.33 . . 69 . 41 ASN N N 122.5 . . 70 . 41 ASN H H 9.65 . . 71 . 42 VAL N N 109.2 . . 72 . 42 VAL H H 6.96 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.38 . . 75 . 44 PHE N N 125.7 . . 76 . 44 PHE H H 8.76 . . 77 . 45 ASP N N 124.1 . . 78 . 45 ASP H H 8.40 . . 79 . 46 ALA N N 128.3 . . 80 . 46 ALA H H 8.62 . . 81 . 47 ALA N N 117.5 . . 82 . 47 ALA H H 8.47 . . 83 . 48 LEU N N 123.1 . . 84 . 48 LEU H H 8.65 . . 85 . 49 ASN N N 114.6 . . 86 . 49 ASN H H 8.06 . . 87 . 51 ALA N N 115.5 . . 88 . 51 ALA H H 7.01 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 7.96 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.22 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.19 . . 95 . 55 ASP N N 120.0 . . 96 . 55 ASP H H 8.43 . . 97 . 56 LEU N N 123.8 . . 98 . 56 LEU H H 8.15 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.59 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.55 . . 103 . 59 SER N N 115.4 . . 104 . 59 SER H H 7.75 . . 105 . 60 LEU N N 120.5 . . 106 . 60 LEU H H 6.90 . . 107 . 61 SER N N 111.2 . . 108 . 61 SER H H 6.98 . . 109 . 62 HIS N N 120.3 . . 110 . 62 HIS H H 9.59 . . 111 . 63 LYS N N 123.6 . . 112 . 63 LYS H H 8.85 . . 113 . 64 GLN N N 120.6 . . 114 . 64 GLN H H 8.44 . . 115 . 65 LEU N N 121.8 . . 116 . 65 LEU H H 8.27 . . 117 . 66 LEU N N 124.7 . . 118 . 66 LEU H H 9.41 . . 119 . 67 MET N N 122.0 . . 120 . 67 MET H H 8.16 . . 121 . 68 SER N N 114.2 . . 122 . 68 SER H H 8.41 . . 123 . 70 GLY N N 112.7 . . 124 . 70 GLY H H 8.98 . . 125 . 71 GLN N N 119.8 . . 126 . 71 GLN H H 7.51 . . 127 . 72 SER N N 115.7 . . 128 . 72 SER H H 8.68 . . 129 . 73 THR N N 115.8 . . 130 . 73 THR H H 8.74 . . 131 . 74 SER N N 118.4 . . 132 . 74 SER H H 8.16 . . 133 . 75 THR N N 121.0 . . 134 . 75 THR H H 9.51 . . 135 . 76 THR N N 127.2 . . 136 . 76 THR H H 9.13 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.17 . . 139 . 79 ALA N N 123.2 . . 140 . 79 ALA H H 8.83 . . 141 . 80 ASP N N 113.0 . . 142 . 80 ASP H H 7.98 . . 143 . 81 ALA N N 124.7 . . 144 . 81 ALA H H 7.59 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.39 . . 147 . 84 GLY N N 107.3 . . 148 . 84 GLY H H 8.86 . . 149 . 85 GLU N N 119.7 . . 150 . 85 GLU H H 8.49 . . 151 . 86 TYR N N 125.5 . . 152 . 86 TYR H H 10.17 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.64 . . 155 . 88 PHE N N 126.0 . . 156 . 88 PHE H H 8.57 . . 157 . 89 TYR N N 115.2 . . 158 . 89 TYR H H 9.03 . . 159 . 90 CYS N N 124.5 . . 160 . 90 CYS H H 7.77 . . 161 . 91 GLU N N 125.8 . . 162 . 91 GLU H H 10.04 . . 163 . 93 HIS N N 113.4 . . 164 . 93 HIS H H 8.32 . . 165 . 94 ARG N N 128.7 . . 166 . 94 ARG H H 8.29 . . 167 . 95 GLY N N 107.8 . . 168 . 95 GLY H H 9.07 . . 169 . 96 ALA N N 121.3 . . 170 . 96 ALA H H 7.46 . . 171 . 97 GLY N N 106.2 . . 172 . 97 GLY H H 8.13 . . 173 . 98 MET N N 122.9 . . 174 . 98 MET H H 7.51 . . 175 . 99 VAL N N 126.4 . . 176 . 99 VAL H H 7.98 . . 177 . 100 GLY N N 117.8 . . 178 . 100 GLY H H 8.94 . . 179 . 101 LYS N N 117.7 . . 180 . 101 LYS H H 8.27 . . 181 . 102 ILE N N 127.4 . . 182 . 102 ILE H H 9.47 . . 183 . 103 THR N N 126.0 . . 184 . 103 THR H H 9.26 . . 185 . 104 VAL N N 128.7 . . 186 . 104 VAL H H 9.33 . . 187 . 105 ALA N N 133.7 . . 188 . 105 ALA H H 9.24 . . 189 . 106 GLY N N 113.5 . . 190 . 106 GLY H H 7.84 . . stop_ save_ save_shift_set_10 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_10 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.2 . . 2 . 3 THR H H 8.76 . . 3 . 4 TYR N N 127.1 . . 4 . 4 TYR H H 8.87 . . 5 . 5 THR N N 117.9 . . 6 . 5 THR H H 8.64 . . 7 . 6 VAL N N 129.3 . . 8 . 6 VAL H H 9.27 . . 9 . 7 LYS N N 126.7 . . 10 . 7 LYS H H 9.12 . . 11 . 8 LEU N N 121.5 . . 12 . 8 LEU H H 8.87 . . 13 . 9 GLY N N 114.8 . . 14 . 9 GLY H H 7.54 . . 15 . 10 SER N N 119.8 . . 16 . 10 SER H H 8.75 . . 17 . 11 ASP N N 120.8 . . 18 . 11 ASP H H 9.35 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.50 . . 21 . 13 GLY N N 108.6 . . 22 . 13 GLY H H 8.28 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.49 . . 25 . 15 LEU N N 125.5 . . 26 . 15 LEU H H 8.63 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.59 . . 29 . 17 PHE N N 121.0 . . 30 . 17 PHE H H 8.83 . . 31 . 18 GLU N N 122.5 . . 32 . 18 GLU H H 9.00 . . 33 . 20 ALA N N 116.5 . . 34 . 20 ALA H H 8.00 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.39 . . 37 . 22 LEU N N 121.5 . . 38 . 22 LEU H H 7.74 . . 39 . 23 THR N N 121.2 . . 40 . 23 THR H H 8.23 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.93 . . 43 . 25 LYS N N 119.5 . . 44 . 25 LYS H H 8.90 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.12 . . 47 . 28 ASP N N 119.8 . . 48 . 28 ASP H H 7.91 . . 49 . 29 THR N N 114.7 . . 50 . 29 THR H H 8.61 . . 51 . 30 VAL N N 126.4 . . 52 . 30 VAL H H 9.18 . . 53 . 31 GLU N N 128.3 . . 54 . 31 GLU H H 9.25 . . 55 . 32 PHE N N 126.3 . . 56 . 32 PHE H H 9.22 . . 57 . 33 LEU N N 125.2 . . 58 . 33 LEU H H 8.94 . . 59 . 34 ASN N N 127.2 . . 60 . 34 ASN H H 9.37 . . 61 . 35 ASN N N 129.5 . . 62 . 35 ASN H H 8.63 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.13 . . 65 . 37 VAL N N 116.6 . . 66 . 37 VAL H H 9.08 . . 67 . 40 HIS N N 111.4 . . 68 . 40 HIS H H 7.38 . . 69 . 41 ASN N N 122.2 . . 70 . 41 ASN H H 9.56 . . 71 . 42 VAL N N 109.4 . . 72 . 42 VAL H H 6.97 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.36 . . 75 . 44 PHE N N 125.7 . . 76 . 44 PHE H H 8.78 . . 77 . 45 ASP N N 124.1 . . 78 . 45 ASP H H 8.41 . . 79 . 46 ALA N N 128.4 . . 80 . 46 ALA H H 8.62 . . 81 . 47 ALA N N 117.5 . . 82 . 47 ALA H H 8.47 . . 83 . 48 LEU N N 123.1 . . 84 . 48 LEU H H 8.63 . . 85 . 49 ASN N N 114.6 . . 86 . 49 ASN H H 8.06 . . 87 . 51 ALA N N 115.5 . . 88 . 51 ALA H H 7.00 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 7.96 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.22 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.19 . . 95 . 55 ASP N N 120.0 . . 96 . 55 ASP H H 8.44 . . 97 . 56 LEU N N 123.8 . . 98 . 56 LEU H H 8.15 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.58 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.55 . . 103 . 59 SER N N 115.3 . . 104 . 59 SER H H 7.75 . . 105 . 60 LEU N N 120.5 . . 106 . 60 LEU H H 6.90 . . 107 . 61 SER N N 111.3 . . 108 . 61 SER H H 6.98 . . 109 . 62 HIS N N 120.2 . . 110 . 62 HIS H H 9.57 . . 111 . 63 LYS N N 123.7 . . 112 . 63 LYS H H 8.87 . . 113 . 64 GLN N N 120.7 . . 114 . 64 GLN H H 8.46 . . 115 . 65 LEU N N 121.7 . . 116 . 65 LEU H H 8.28 . . 117 . 66 LEU N N 124.6 . . 118 . 66 LEU H H 9.37 . . 119 . 67 MET N N 122.0 . . 120 . 67 MET H H 8.18 . . 121 . 68 SER N N 114.2 . . 122 . 68 SER H H 8.41 . . 123 . 70 GLY N N 112.7 . . 124 . 70 GLY H H 8.97 . . 125 . 71 GLN N N 119.8 . . 126 . 71 GLN H H 7.51 . . 127 . 72 SER N N 115.7 . . 128 . 72 SER H H 8.70 . . 129 . 73 THR N N 115.6 . . 130 . 73 THR H H 8.73 . . 131 . 74 SER N N 118.4 . . 132 . 74 SER H H 8.16 . . 133 . 75 THR N N 120.9 . . 134 . 75 THR H H 9.50 . . 135 . 76 THR N N 127.2 . . 136 . 76 THR H H 9.13 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.16 . . 139 . 79 ALA N N 123.2 . . 140 . 79 ALA H H 8.82 . . 141 . 80 ASP N N 112.8 . . 142 . 80 ASP H H 7.94 . . 143 . 81 ALA N N 124.7 . . 144 . 81 ALA H H 7.60 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.39 . . 147 . 84 GLY N N 107.3 . . 148 . 84 GLY H H 8.86 . . 149 . 85 GLU N N 119.7 . . 150 . 85 GLU H H 8.49 . . 151 . 86 TYR N N 125.4 . . 152 . 86 TYR H H 10.16 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.64 . . 155 . 88 PHE N N 125.9 . . 156 . 88 PHE H H 8.57 . . 157 . 89 TYR N N 115.2 . . 158 . 89 TYR H H 9.06 . . 159 . 90 CYS N N 124.3 . . 160 . 90 CYS H H 7.77 . . 161 . 91 GLU N N 125.9 . . 162 . 91 GLU H H 10.04 . . 163 . 93 HIS N N 112.6 . . 164 . 93 HIS H H 8.21 . . 165 . 94 ARG N N 128.4 . . 166 . 94 ARG H H 8.22 . . 167 . 95 GLY N N 108.0 . . 168 . 95 GLY H H 9.06 . . 169 . 96 ALA N N 121.1 . . 170 . 96 ALA H H 7.42 . . 171 . 97 GLY N N 106.1 . . 172 . 97 GLY H H 8.15 . . 173 . 98 MET N N 122.4 . . 174 . 98 MET H H 7.46 . . 175 . 99 VAL N N 126.5 . . 176 . 99 VAL H H 7.99 . . 177 . 100 GLY N N 117.7 . . 178 . 100 GLY H H 8.92 . . 179 . 101 LYS N N 117.7 . . 180 . 101 LYS H H 8.27 . . 181 . 102 ILE N N 127.3 . . 182 . 102 ILE H H 9.46 . . 183 . 103 THR N N 126.0 . . 184 . 103 THR H H 9.26 . . 185 . 104 VAL N N 128.7 . . 186 . 104 VAL H H 9.33 . . 187 . 105 ALA N N 133.6 . . 188 . 105 ALA H H 9.24 . . 189 . 106 GLY N N 113.1 . . 190 . 106 GLY H H 7.89 . . stop_ save_ save_shift_set_11 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_11 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 124.9 . . 2 . 3 THR H H 8.74 . . 3 . 4 TYR N N 127.1 . . 4 . 4 TYR H H 8.87 . . 5 . 5 THR N N 117.8 . . 6 . 5 THR H H 8.65 . . 7 . 6 VAL N N 129.2 . . 8 . 6 VAL H H 9.26 . . 9 . 7 LYS N N 126.7 . . 10 . 7 LYS H H 9.12 . . 11 . 8 LEU N N 121.2 . . 12 . 8 LEU H H 8.86 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.50 . . 15 . 10 SER N N 119.9 . . 16 . 10 SER H H 8.77 . . 17 . 11 ASP N N 120.6 . . 18 . 11 ASP H H 9.22 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.50 . . 21 . 13 GLY N N 108.6 . . 22 . 13 GLY H H 8.27 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.50 . . 25 . 15 LEU N N 125.6 . . 26 . 15 LEU H H 8.67 . . 27 . 16 VAL N N 112.7 . . 28 . 16 VAL H H 7.62 . . 29 . 17 PHE N N 121.5 . . 30 . 17 PHE H H 8.88 . . 31 . 18 GLU N N 122.5 . . 32 . 18 GLU H H 9.00 . . 33 . 20 ALA N N 116.4 . . 34 . 20 ALA H H 7.98 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.39 . . 37 . 22 LEU N N 121.5 . . 38 . 22 LEU H H 7.73 . . 39 . 23 THR N N 121.2 . . 40 . 23 THR H H 8.23 . . 41 . 24 ILE N N 120.7 . . 42 . 24 ILE H H 8.93 . . 43 . 25 LYS N N 119.4 . . 44 . 25 LYS H H 8.86 . . 45 . 27 GLY N N 114.5 . . 46 . 27 GLY H H 7.14 . . 47 . 28 ASP N N 119.7 . . 48 . 28 ASP H H 7.91 . . 49 . 29 THR N N 114.8 . . 50 . 29 THR H H 8.59 . . 51 . 30 VAL N N 126.4 . . 52 . 30 VAL H H 9.18 . . 53 . 31 GLU N N 128.2 . . 54 . 31 GLU H H 9.26 . . 55 . 32 PHE N N 126.4 . . 56 . 32 PHE H H 9.23 . . 57 . 33 LEU N N 125.2 . . 58 . 33 LEU H H 8.93 . . 59 . 34 ASN N N 127.2 . . 60 . 34 ASN H H 9.38 . . 61 . 35 ASN N N 129.5 . . 62 . 35 ASN H H 8.60 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.13 . . 65 . 37 VAL N N 116.8 . . 66 . 37 VAL H H 9.11 . . 67 . 40 HIS N N 111.1 . . 68 . 40 HIS H H 7.42 . . 69 . 41 ASN N N 122.1 . . 70 . 41 ASN H H 9.50 . . 71 . 42 VAL N N 109.5 . . 72 . 42 VAL H H 6.97 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.35 . . 75 . 44 PHE N N 125.8 . . 76 . 44 PHE H H 8.79 . . 77 . 45 ASP N N 124.1 . . 78 . 45 ASP H H 8.41 . . 79 . 46 ALA N N 128.4 . . 80 . 46 ALA H H 8.62 . . 81 . 47 ALA N N 117.5 . . 82 . 47 ALA H H 8.46 . . 83 . 48 LEU N N 123.0 . . 84 . 48 LEU H H 8.62 . . 85 . 49 ASN N N 114.6 . . 86 . 49 ASN H H 8.05 . . 87 . 51 ALA N N 115.5 . . 88 . 51 ALA H H 7.00 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 7.96 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.22 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.19 . . 95 . 55 ASP N N 119.9 . . 96 . 55 ASP H H 8.46 . . 97 . 56 LEU N N 123.8 . . 98 . 56 LEU H H 8.15 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.58 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.55 . . 103 . 59 SER N N 115.3 . . 104 . 59 SER H H 7.75 . . 105 . 60 LEU N N 120.5 . . 106 . 60 LEU H H 6.90 . . 107 . 61 SER N N 111.3 . . 108 . 61 SER H H 6.98 . . 109 . 62 HIS N N 120.1 . . 110 . 62 HIS H H 9.56 . . 111 . 63 LYS N N 123.8 . . 112 . 63 LYS H H 8.89 . . 113 . 64 GLN N N 120.8 . . 114 . 64 GLN H H 8.48 . . 115 . 65 LEU N N 121.7 . . 116 . 65 LEU H H 8.29 . . 117 . 66 LEU N N 124.5 . . 118 . 66 LEU H H 9.34 . . 119 . 67 MET N N 122.0 . . 120 . 67 MET H H 8.20 . . 121 . 68 SER N N 114.2 . . 122 . 68 SER H H 8.42 . . 123 . 70 GLY N N 112.6 . . 124 . 70 GLY H H 8.96 . . 125 . 71 GLN N N 119.8 . . 126 . 71 GLN H H 7.51 . . 127 . 72 SER N N 115.4 . . 128 . 72 SER H H 8.73 . . 129 . 73 THR N N 115.7 . . 130 . 73 THR H H 8.71 . . 131 . 74 SER N N 118.4 . . 132 . 74 SER H H 8.17 . . 133 . 75 THR N N 120.9 . . 134 . 75 THR H H 9.48 . . 135 . 76 THR N N 127.3 . . 136 . 76 THR H H 9.13 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.15 . . 139 . 79 ALA N N 123.2 . . 140 . 79 ALA H H 8.81 . . 141 . 80 ASP N N 112.5 . . 142 . 80 ASP H H 7.90 . . 143 . 81 ALA N N 124.8 . . 144 . 81 ALA H H 7.62 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.39 . . 147 . 84 GLY N N 107.3 . . 148 . 84 GLY H H 8.86 . . 149 . 85 GLU N N 119.7 . . 150 . 85 GLU H H 8.50 . . 151 . 86 TYR N N 125.3 . . 152 . 86 TYR H H 10.16 . . 153 . 87 THR N N 121.6 . . 154 . 87 THR H H 8.64 . . 155 . 88 PHE N N 125.9 . . 156 . 88 PHE H H 8.56 . . 157 . 89 TYR N N 115.1 . . 158 . 89 TYR H H 9.07 . . 159 . 90 CYS N N 124.1 . . 160 . 90 CYS H H 7.78 . . 161 . 91 GLU N N 126.0 . . 162 . 91 GLU H H 10.04 . . 163 . 93 HIS N N 112.1 . . 164 . 93 HIS H H 8.13 . . 165 . 94 ARG N N 128.2 . . 166 . 94 ARG H H 8.17 . . 167 . 95 GLY N N 108.0 . . 168 . 95 GLY H H 9.06 . . 169 . 96 ALA N N 121.0 . . 170 . 96 ALA H H 7.39 . . 171 . 97 GLY N N 106.0 . . 172 . 97 GLY H H 8.16 . . 173 . 98 MET N N 122.1 . . 174 . 98 MET H H 7.43 . . 175 . 99 VAL N N 126.6 . . 176 . 99 VAL H H 7.99 . . 177 . 100 GLY N N 117.6 . . 178 . 100 GLY H H 8.91 . . 179 . 101 LYS N N 117.7 . . 180 . 101 LYS H H 8.27 . . 181 . 102 ILE N N 127.3 . . 182 . 102 ILE H H 9.46 . . 183 . 103 THR N N 126.0 . . 184 . 103 THR H H 9.26 . . 185 . 104 VAL N N 128.7 . . 186 . 104 VAL H H 9.33 . . 187 . 105 ALA N N 133.6 . . 188 . 105 ALA H H 9.24 . . 189 . 106 GLY N N 112.6 . . 190 . 106 GLY H H 7.94 . . stop_ save_ save_shift_set_12 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_12 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.5 . . 2 . 3 THR H H 8.74 . . 3 . 4 TYR N N 127.1 . . 4 . 4 TYR H H 8.81 . . 5 . 5 THR N N 118.4 . . 6 . 5 THR H H 8.60 . . 7 . 6 VAL N N 129.7 . . 8 . 6 VAL H H 9.28 . . 9 . 7 LYS N N 126.6 . . 10 . 7 LYS H H 9.04 . . 11 . 8 LEU N N 121.8 . . 12 . 8 LEU H H 8.82 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.61 . . 15 . 10 SER N N 119.7 . . 16 . 10 SER H H 8.65 . . 17 . 11 ASP N N 120.9 . . 18 . 11 ASP H H 9.45 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.46 . . 21 . 13 GLY N N 108.9 . . 22 . 13 GLY H H 8.28 . . 23 . 14 LEU N N 117.4 . . 24 . 14 LEU H H 7.44 . . 25 . 15 LEU N N 125.0 . . 26 . 15 LEU H H 8.41 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.46 . . 29 . 17 PHE N N 120.2 . . 30 . 17 PHE H H 8.67 . . 31 . 18 GLU N N 122.1 . . 32 . 18 GLU H H 8.97 . . 33 . 20 ALA N N 116.8 . . 34 . 20 ALA H H 8.06 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.35 . . 37 . 22 LEU N N 121.4 . . 38 . 22 LEU H H 7.71 . . 39 . 23 THR N N 121.1 . . 40 . 23 THR H H 8.21 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.89 . . 43 . 25 LYS N N 119.5 . . 44 . 25 LYS H H 8.93 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.05 . . 47 . 28 ASP N N 119.8 . . 48 . 28 ASP H H 7.87 . . 49 . 29 THR N N 114.7 . . 50 . 29 THR H H 8.63 . . 51 . 30 VAL N N 126.4 . . 52 . 30 VAL H H 9.12 . . 53 . 31 GLU N N 128.7 . . 54 . 31 GLU H H 9.19 . . 55 . 32 PHE N N 126.0 . . 56 . 32 PHE H H 9.13 . . 57 . 33 LEU N N 125.3 . . 58 . 33 LEU H H 8.92 . . 59 . 34 ASN N N 127.3 . . 60 . 34 ASN H H 9.30 . . 61 . 35 ASN N N 129.7 . . 62 . 35 ASN H H 8.74 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.10 . . 65 . 37 VAL N N 115.5 . . 66 . 37 VAL H H 8.94 . . 67 . 40 HIS N N 112.3 . . 68 . 40 HIS H H 7.17 . . 69 . 41 ASN N N 122.8 . . 70 . 41 ASN H H 9.78 . . 71 . 42 VAL N N 108.9 . . 72 . 42 VAL H H 6.89 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.39 . . 75 . 44 PHE N N 125.5 . . 76 . 44 PHE H H 8.69 . . 77 . 45 ASP N N 124.0 . . 78 . 45 ASP H H 8.36 . . 79 . 46 ALA N N 128.2 . . 80 . 46 ALA H H 8.60 . . 81 . 47 ALA N N 117.6 . . 82 . 47 ALA H H 8.41 . . 83 . 48 LEU N N 123.2 . . 84 . 48 LEU H H 8.63 . . 85 . 49 ASN N N 114.5 . . 86 . 49 ASN H H 8.02 . . 87 . 51 ALA N N 115.4 . . 88 . 51 ALA H H 6.95 . . 89 . 52 LYS N N 120.6 . . 90 . 52 LYS H H 7.92 . . 91 . 53 SER N N 109.7 . . 92 . 53 SER H H 8.19 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.16 . . 95 . 55 ASP N N 120.1 . . 96 . 55 ASP H H 8.41 . . 97 . 56 LEU N N 123.8 . . 98 . 56 LEU H H 8.12 . . 99 . 57 ALA N N 119.7 . . 100 . 57 ALA H H 7.54 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.50 . . 103 . 59 SER N N 115.3 . . 104 . 59 SER H H 7.70 . . 105 . 60 LEU N N 120.6 . . 106 . 60 LEU H H 6.84 . . 107 . 61 SER N N 111.2 . . 108 . 61 SER H H 6.91 . . 109 . 62 HIS N N 120.5 . . 110 . 62 HIS H H 9.58 . . 111 . 63 LYS N N 123.3 . . 112 . 63 LYS H H 8.77 . . 113 . 64 GLN N N 120.4 . . 114 . 64 GLN H H 8.37 . . 115 . 65 LEU N N 121.9 . . 116 . 65 LEU H H 8.21 . . 117 . 66 LEU N N 124.9 . . 118 . 66 LEU H H 9.44 . . 119 . 67 MET N N 121.9 . . 120 . 67 MET H H 8.07 . . 121 . 68 SER N N 113.7 . . 122 . 68 SER H H 8.34 . . 123 . 70 GLY N N 112.8 . . 124 . 70 GLY H H 8.97 . . 125 . 71 GLN N N 119.8 . . 126 . 71 GLN H H 7.47 . . 127 . 72 SER N N 115.8 . . 128 . 72 SER H H 8.65 . . 129 . 73 THR N N 116.3 . . 130 . 73 THR H H 8.70 . . 131 . 74 SER N N 118.3 . . 132 . 74 SER H H 8.12 . . 133 . 75 THR N N 121.0 . . 134 . 75 THR H H 9.51 . . 135 . 76 THR N N 127.2 . . 136 . 76 THR H H 9.11 . . 137 . 77 PHE N N 131.7 . . 138 . 77 PHE H H 9.15 . . 139 . 79 ALA N N 123.1 . . 140 . 79 ALA H H 8.81 . . 141 . 80 ASP N N 113.1 . . 142 . 80 ASP H H 7.95 . . 143 . 81 ALA N N 124.6 . . 144 . 81 ALA H H 7.54 . . 145 . 83 ALA N N 124.5 . . 146 . 83 ALA H H 8.36 . . 147 . 84 GLY N N 107.4 . . 148 . 84 GLY H H 8.82 . . 149 . 85 GLU N N 119.7 . . 150 . 85 GLU H H 8.46 . . 151 . 86 TYR N N 125.4 . . 152 . 86 TYR H H 10.13 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.59 . . 155 . 88 PHE N N 126.2 . . 156 . 88 PHE H H 8.54 . . 157 . 89 TYR N N 115.2 . . 158 . 89 TYR H H 8.91 . . 159 . 90 CYS N N 125.0 . . 160 . 90 CYS H H 7.71 . . 161 . 91 GLU N N 125.5 . . 162 . 91 GLU H H 9.99 . . 163 . 93 HIS N N 115.1 . . 164 . 93 HIS H H 8.49 . . 165 . 94 ARG N N 129.2 . . 166 . 94 ARG H H 8.39 . . 167 . 95 GLY N N 107.7 . . 168 . 95 GLY H H 9.06 . . 169 . 96 ALA N N 121.5 . . 170 . 96 ALA H H 7.49 . . 171 . 97 GLY N N 106.4 . . 172 . 97 GLY H H 8.05 . . 173 . 98 MET N N 123.9 . . 174 . 98 MET H H 7.57 . . 175 . 99 VAL N N 125.9 . . 176 . 99 VAL H H 7.91 . . 177 . 100 GLY N N 118.1 . . 178 . 100 GLY H H 8.93 . . 179 . 101 LYS N N 117.5 . . 180 . 101 LYS H H 8.22 . . 181 . 102 ILE N N 127.6 . . 182 . 102 ILE H H 9.44 . . 183 . 103 THR N N 126.0 . . 184 . 103 THR H H 9.23 . . 185 . 104 VAL N N 128.6 . . 186 . 104 VAL H H 9.29 . . 187 . 105 ALA N N 133.7 . . 188 . 105 ALA H H 9.22 . . 189 . 106 GLY N N 113.7 . . 190 . 106 GLY H H 7.80 . . stop_ save_ save_shift_set_13 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_13 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.7 . . 2 . 3 THR H H 8.84 . . 3 . 4 TYR N N 127.0 . . 4 . 4 TYR H H 8.87 . . 5 . 5 THR N N 118.4 . . 6 . 5 THR H H 8.64 . . 7 . 6 VAL N N 129.7 . . 8 . 6 VAL H H 9.35 . . 9 . 7 LYS N N 126.7 . . 10 . 7 LYS H H 9.14 . . 11 . 8 LEU N N 122.0 . . 12 . 8 LEU H H 8.91 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.71 . . 15 . 10 SER N N 119.7 . . 16 . 10 SER H H 8.73 . . 17 . 11 ASP N N 121.0 . . 18 . 11 ASP H H 9.49 . . 19 . 12 LYS N N 115.9 . . 20 . 12 LYS H H 7.56 . . 21 . 13 GLY N N 108.8 . . 22 . 13 GLY H H 8.37 . . 23 . 14 LEU N N 117.5 . . 24 . 14 LEU H H 7.48 . . 25 . 15 LEU N N 125.1 . . 26 . 15 LEU H H 8.47 . . 27 . 16 VAL N N 112.6 . . 28 . 16 VAL H H 7.54 . . 29 . 17 PHE N N 120.2 . . 30 . 17 PHE H H 8.70 . . 31 . 18 GLU N N 122.2 . . 32 . 18 GLU H H 9.04 . . 33 . 20 ALA N N 117.0 . . 34 . 20 ALA H H 8.14 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.43 . . 37 . 22 LEU N N 121.6 . . 38 . 22 LEU H H 7.83 . . 39 . 23 THR N N 121.1 . . 40 . 23 THR H H 8.25 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 8.97 . . 43 . 25 LYS N N 119.7 . . 44 . 25 LYS H H 9.02 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.16 . . 47 . 28 ASP N N 119.9 . . 48 . 28 ASP H H 7.95 . . 49 . 29 THR N N 114.8 . . 50 . 29 THR H H 8.70 . . 51 . 30 VAL N N 126.5 . . 52 . 30 VAL H H 9.20 . . 53 . 31 GLU N N 128.8 . . 54 . 31 GLU H H 9.27 . . 55 . 32 PHE N N 125.9 . . 56 . 32 PHE H H 9.20 . . 57 . 33 LEU N N 125.3 . . 58 . 33 LEU H H 9.02 . . 59 . 34 ASN N N 127.4 . . 60 . 34 ASN H H 9.38 . . 61 . 35 ASN N N 129.7 . . 62 . 35 ASN H H 8.81 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.20 . . 65 . 37 VAL N N 115.8 . . 66 . 37 VAL H H 8.99 . . 67 . 40 HIS N N 112.3 . . 68 . 40 HIS H H 7.27 . . 69 . 41 ASN N N 122.9 . . 70 . 41 ASN H H 9.88 . . 71 . 42 VAL N N 109.0 . . 72 . 42 VAL H H 7.00 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.47 . . 75 . 44 PHE N N 125.5 . . 76 . 44 PHE H H 8.76 . . 77 . 45 ASP N N 124.1 . . 78 . 45 ASP H H 8.43 . . 79 . 46 ALA N N 128.3 . . 80 . 46 ALA H H 8.65 . . 81 . 47 ALA N N 117.6 . . 82 . 47 ALA H H 8.51 . . 83 . 48 LEU N N 123.1 . . 84 . 48 LEU H H 8.69 . . 85 . 49 ASN N N 114.6 . . 86 . 49 ASN H H 8.10 . . 87 . 51 ALA N N 115.6 . . 88 . 51 ALA H H 7.06 . . 89 . 52 LYS N N 120.5 . . 90 . 52 LYS H H 8.00 . . 91 . 53 SER N N 109.8 . . 92 . 53 SER H H 8.25 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.22 . . 95 . 55 ASP N N 120.0 . . 96 . 55 ASP H H 8.43 . . 97 . 56 LEU N N 123.7 . . 98 . 56 LEU H H 8.17 . . 99 . 57 ALA N N 119.6 . . 100 . 57 ALA H H 7.61 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.59 . . 103 . 59 SER N N 115.4 . . 104 . 59 SER H H 7.79 . . 105 . 60 LEU N N 120.4 . . 106 . 60 LEU H H 6.96 . . 107 . 61 SER N N 111.2 . . 108 . 61 SER H H 7.02 . . 109 . 62 HIS N N 120.7 . . 110 . 62 HIS H H 9.67 . . 111 . 63 LYS N N 123.3 . . 112 . 63 LYS H H 8.81 . . 113 . 64 GLN N N 120.3 . . 114 . 64 GLN H H 8.40 . . 115 . 65 LEU N N 121.8 . . 116 . 65 LEU H H 8.25 . . 117 . 66 LEU N N 124.9 . . 118 . 66 LEU H H 9.52 . . 119 . 67 MET N N 121.9 . . 120 . 67 MET H H 8.15 . . 121 . 68 SER N N 113.8 . . 122 . 68 SER H H 8.39 . . 123 . 70 GLY N N 112.8 . . 124 . 70 GLY H H 9.06 . . 125 . 71 GLN N N 119.9 . . 126 . 71 GLN H H 7.58 . . 127 . 72 SER N N 115.9 . . 128 . 72 SER H H 8.68 . . 129 . 73 THR N N 116.2 . . 130 . 73 THR H H 8.78 . . 131 . 74 SER N N 118.4 . . 132 . 74 SER H H 8.20 . . 133 . 75 THR N N 121.1 . . 134 . 75 THR H H 9.59 . . 135 . 76 THR N N 127.1 . . 136 . 76 THR H H 9.12 . . 137 . 77 PHE N N 131.6 . . 138 . 77 PHE H H 9.21 . . 139 . 79 ALA N N 123.1 . . 140 . 79 ALA H H 8.84 . . 141 . 80 ASP N N 113.2 . . 142 . 80 ASP H H 8.06 . . 143 . 81 ALA N N 124.6 . . 144 . 81 ALA H H 7.62 . . 145 . 83 ALA N N 124.6 . . 146 . 83 ALA H H 8.40 . . 147 . 84 GLY N N 107.4 . . 148 . 84 GLY H H 8.90 . . 149 . 85 GLU N N 119.8 . . 150 . 85 GLU H H 8.51 . . 151 . 86 TYR N N 125.6 . . 152 . 86 TYR H H 10.21 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.67 . . 155 . 88 PHE N N 126.3 . . 156 . 88 PHE H H 8.63 . . 157 . 89 TYR N N 115.3 . . 158 . 89 TYR H H 9.01 . . 159 . 90 CYS N N 125.1 . . 160 . 90 CYS H H 7.80 . . 161 . 91 GLU N N 125.7 . . 162 . 91 GLU H H 10.06 . . 163 . 93 HIS N N 115.2 . . 164 . 93 HIS H H 8.60 . . 165 . 94 ARG N N 129.1 . . 166 . 94 ARG H H 8.49 . . 167 . 95 GLY N N 107.6 . . 168 . 95 GLY H H 9.12 . . 169 . 96 ALA N N 121.6 . . 170 . 96 ALA H H 7.60 . . 171 . 97 GLY N N 106.3 . . 172 . 97 GLY H H 8.13 . . 173 . 98 MET N N 124.0 . . 174 . 98 MET H H 7.65 . . 175 . 99 VAL N N 126.0 . . 176 . 99 VAL H H 8.00 . . 177 . 100 GLY N N 118.0 . . 178 . 100 GLY H H 9.01 . . 179 . 101 LYS N N 117.6 . . 180 . 101 LYS H H 8.32 . . 181 . 102 ILE N N 127.3 . . 182 . 102 ILE H H 9.51 . . 183 . 103 THR N N 126.1 . . 184 . 103 THR H H 9.31 . . 185 . 104 VAL N N 128.7 . . 186 . 104 VAL H H 9.36 . . 187 . 105 ALA N N 133.7 . . 188 . 105 ALA H H 9.28 . . 189 . 106 GLY N N 113.8 . . 190 . 106 GLY H H 7.82 . . stop_ save_ save_shift_set_14 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_14 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'plastocyanin monomer' _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 . 3 THR N N 125.8 . . 2 . 3 THR H H 8.89 . . 3 . 4 TYR N N 126.9 . . 4 . 4 TYR H H 8.90 . . 5 . 5 THR N N 118.5 . . 6 . 5 THR H H 8.65 . . 7 . 6 VAL N N 129.6 . . 8 . 6 VAL H H 9.38 . . 9 . 7 LYS N N 126.7 . . 10 . 7 LYS H H 9.19 . . 11 . 8 LEU N N 122.1 . . 12 . 8 LEU H H 8.96 . . 13 . 9 GLY N N 114.9 . . 14 . 9 GLY H H 7.75 . . 15 . 10 SER N N 119.8 . . 16 . 10 SER H H 8.76 . . 17 . 11 ASP N N 121.1 . . 18 . 11 ASP H H 9.50 . . 19 . 12 LYS N N 116.0 . . 20 . 12 LYS H H 7.60 . . 21 . 13 GLY N N 108.8 . . 22 . 13 GLY H H 8.41 . . 23 . 14 LEU N N 117.5 . . 24 . 14 LEU H H 7.50 . . 25 . 15 LEU N N 125.2 . . 26 . 15 LEU H H 8.50 . . 27 . 16 VAL N N 112.7 . . 28 . 16 VAL H H 7.58 . . 29 . 17 PHE N N 120.2 . . 30 . 17 PHE H H 8.71 . . 31 . 18 GLU N N 122.2 . . 32 . 18 GLU H H 9.08 . . 33 . 20 ALA N N 117.1 . . 34 . 20 ALA H H 8.21 . . 35 . 21 LYS N N 115.9 . . 36 . 21 LYS H H 7.47 . . 37 . 22 LEU N N 121.7 . . 38 . 22 LEU H H 7.89 . . 39 . 23 THR N N 121.1 . . 40 . 23 THR H H 8.27 . . 41 . 24 ILE N N 120.8 . . 42 . 24 ILE H H 9.00 . . 43 . 25 LYS N N 119.8 . . 44 . 25 LYS H H 9.07 . . 45 . 27 GLY N N 114.6 . . 46 . 27 GLY H H 7.21 . . 47 . 28 ASP N N 119.9 . . 48 . 28 ASP H H 7.99 . . 49 . 29 THR N N 114.8 . . 50 . 29 THR H H 8.73 . . 51 . 30 VAL N N 126.5 . . 52 . 30 VAL H H 9.24 . . 53 . 31 GLU N N 128.8 . . 54 . 31 GLU H H 9.31 . . 55 . 32 PHE N N 125.9 . . 56 . 32 PHE H H 9.24 . . 57 . 33 LEU N N 125.4 . . 58 . 33 LEU H H 9.07 . . 59 . 34 ASN N N 127.4 . . 60 . 34 ASN H H 9.41 . . 61 . 35 ASN N N 129.8 . . 62 . 35 ASN H H 8.85 . . 63 . 36 LYS N N 116.8 . . 64 . 36 LYS H H 8.18 . . 65 . 37 VAL N N 115.9 . . 66 . 37 VAL H H 9.01 . . 67 . 40 HIS N N 112.3 . . 68 . 40 HIS H H 7.31 . . 69 . 41 ASN N N 123.0 . . 70 . 41 ASN H H 9.92 . . 71 . 42 VAL N N 109.1 . . 72 . 42 VAL H H 7.06 . . 73 . 43 VAL N N 128.5 . . 74 . 43 VAL H H 9.51 . . 75 . 44 PHE N N 125.6 . . 76 . 44 PHE H H 8.79 . . 77 . 45 ASP N N 124.1 . . 78 . 45 ASP H H 8.46 . . 79 . 46 ALA N N 128.3 . . 80 . 46 ALA H H 8.67 . . 81 . 47 ALA N N 117.6 . . 82 . 47 ALA H H 8.55 . . 83 . 48 LEU N N 123.0 . . 84 . 48 LEU H H 8.72 . . 85 . 49 ASN N N 114.7 . . 86 . 49 ASN H H 8.13 . . 87 . 51 ALA N N 115.7 . . 88 . 51 ALA H H 7.12 . . 89 . 52 LYS N N 120.4 . . 90 . 52 LYS H H 8.05 . . 91 . 53 SER N N 109.9 . . 92 . 53 SER H H 8.28 . . 93 . 54 ALA N N 134.0 . . 94 . 54 ALA H H 9.24 . . 95 . 55 ASP N N 119.9 . . 96 . 55 ASP H H 8.44 . . 97 . 56 LEU N N 123.6 . . 98 . 56 LEU H H 8.19 . . 99 . 57 ALA N N 119.6 . . 100 . 57 ALA H H 7.64 . . 101 . 58 LYS N N 120.9 . . 102 . 58 LYS H H 8.62 . . 103 . 59 SER N N 115.4 . . 104 . 59 SER H H 7.83 . . 105 . 60 LEU N N 120.4 . . 106 . 60 LEU H H 7.02 . . 107 . 61 SER N N 111.2 . . 108 . 61 SER H H 7.07 . . 109 . 62 HIS N N 120.8 . . 110 . 62 HIS H H 9.71 . . 111 . 63 LYS N N 123.3 . . 112 . 63 LYS H H 8.83 . . 113 . 64 GLN N N 120.3 . . 114 . 64 GLN H H 8.42 . . 115 . 65 LEU N N 121.8 . . 116 . 65 LEU H H 8.26 . . 117 . 66 LEU N N 124.9 . . 118 . 66 LEU H H 9.55 . . 119 . 67 MET N N 122.0 . . 120 . 67 MET H H 8.19 . . 121 . 68 SER N N 113.8 . . 122 . 68 SER H H 8.41 . . 123 . 70 GLY N N 112.8 . . 124 . 70 GLY H H 9.11 . . 125 . 71 GLN N N 119.9 . . 126 . 71 GLN H H 7.62 . . 127 . 72 SER N N 116.0 . . 128 . 72 SER H H 8.70 . . 129 . 73 THR N N 116.2 . . 130 . 73 THR H H 8.82 . . 131 . 74 SER N N 118.4 . . 132 . 74 SER H H 8.23 . . 133 . 75 THR N N 121.1 . . 134 . 75 THR H H 9.62 . . 135 . 76 THR N N 127.1 . . 136 . 76 THR H H 9.13 . . 137 . 77 PHE N N 131.5 . . 138 . 77 PHE H H 9.24 . . 139 . 79 ALA N N 123.2 . . 140 . 79 ALA H H 8.86 . . 141 . 80 ASP N N 113.2 . . 142 . 80 ASP H H 8.11 . . 143 . 81 ALA N N 124.6 . . 144 . 81 ALA H H 7.66 . . 145 . 83 ALA N N 124.7 . . 146 . 83 ALA H H 8.42 . . 147 . 84 GLY N N 107.4 . . 148 . 84 GLY H H 8.93 . . 149 . 85 GLU N N 119.9 . . 150 . 85 GLU H H 8.54 . . 151 . 86 TYR N N 125.6 . . 152 . 86 TYR H H 10.25 . . 153 . 87 THR N N 121.5 . . 154 . 87 THR H H 8.70 . . 155 . 88 PHE N N 126.3 . . 156 . 88 PHE H H 8.67 . . 157 . 89 TYR N N 115.3 . . 158 . 89 TYR H H 9.06 . . 159 . 90 CYS N N 125.2 . . 160 . 90 CYS H H 7.84 . . 161 . 91 GLU N N 125.8 . . 162 . 91 GLU H H 10.09 . . 163 . 93 HIS N N 115.2 . . 164 . 93 HIS H H 8.65 . . 165 . 94 ARG N N 129.1 . . 166 . 94 ARG H H 8.54 . . 167 . 95 GLY N N 107.6 . . 168 . 95 GLY H H 9.15 . . 169 . 96 ALA N N 121.7 . . 170 . 96 ALA H H 7.65 . . 171 . 97 GLY N N 106.2 . . 172 . 97 GLY H H 8.16 . . 173 . 98 MET N N 124.0 . . 174 . 98 MET H H 7.69 . . 175 . 99 VAL N N 126.0 . . 176 . 99 VAL H H 8.04 . . 177 . 100 GLY N N 118.0 . . 178 . 100 GLY H H 9.05 . . 179 . 101 LYS N N 117.7 . . 180 . 101 LYS H H 8.37 . . 181 . 102 ILE N N 127.1 . . 182 . 102 ILE H H 9.54 . . 183 . 103 THR N N 126.1 . . 184 . 103 THR H H 9.34 . . 185 . 104 VAL N N 128.8 . . 186 . 104 VAL H H 9.40 . . 187 . 105 ALA N N 133.7 . . 188 . 105 ALA H H 9.30 . . 189 . 106 GLY N N 113.8 . . 190 . 106 GLY H H 7.83 . . stop_ save_ save_relax_1_1 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_1 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 4 TYR N 1.349 0.020 2 5 THR N 1.278 0.009 3 6 VAL N 1.344 0.021 4 7 LYS N 1.382 0.015 5 8 LEU N 1.373 0.017 6 9 GLY N 1.220 0.017 7 10 SER N 1.468 0.012 8 13 GLY N 1.445 0.018 9 14 LEU N 1.436 0.014 10 15 LEU N 1.346 0.006 11 16 VAL N 1.302 0.026 12 17 PHE N 1.400 0.008 13 18 GLU N 1.379 0.018 14 20 ALA N 1.171 0.012 15 21 LYS N 1.289 0.017 16 22 LEU N 1.325 0.008 17 23 THR N 1.317 0.021 18 24 ILE N 1.395 0.012 19 25 LYS N 1.359 0.015 20 27 GLY N 1.384 0.012 21 28 ASP N 1.483 0.014 22 29 THR N 1.349 0.017 23 30 VAL N 1.366 0.012 24 31 GLU N 1.400 0.015 25 32 PHE N 1.336 0.019 26 33 LEU N 1.369 0.008 27 34 ASN N 1.448 0.014 28 35 ASN N 1.385 0.020 29 36 LYS N 1.345 0.008 30 37 VAL N 1.349 0.016 31 40 HIS N 1.319 0.021 32 41 ASN N 1.384 0.010 33 42 VAL N 1.317 0.022 34 43 VAL N 1.323 0.021 35 44 PHE N 1.409 0.008 36 45 ASP N 1.467 0.009 37 46 ALA N 1.576 0.222 38 47 ALA N 1.318 0.009 39 48 LEU N 1.179 0.011 40 49 ASN N 1.326 0.007 41 51 ALA N 1.340 0.008 42 52 LYS N 1.503 0.007 43 53 SER N 1.451 0.007 44 56 LEU N 1.430 0.031 45 57 ALA N 1.372 0.016 46 58 LYS N 1.400 0.009 47 59 SER N 1.374 0.023 48 60 LEU N 1.482 0.009 49 61 SER N 1.280 0.020 50 62 HIS N 1.403 0.019 51 63 LYS N 1.091 0.142 52 64 GLN N 1.413 0.029 53 65 LEU N 1.349 0.014 54 66 LEU N 1.370 0.013 55 67 MET N 1.322 0.024 56 68 SER N 1.229 0.032 57 70 GLY N 1.317 0.020 58 71 GLN N 1.368 0.011 59 72 SER N 1.431 0.014 60 73 THR N 1.408 0.013 61 75 THR N 1.338 0.011 62 76 THR N 1.349 0.027 63 77 PHE N 1.389 0.015 64 79 ALA N 1.651 0.135 65 80 ASP N 1.422 0.016 66 81 ALA N 1.414 0.015 67 83 ALA N 1.304 0.008 68 84 GLY N 1.369 0.019 69 85 GLU N 1.360 0.009 70 86 TYR N 1.351 0.009 71 87 THR N 1.285 0.011 72 88 PHE N 1.506 0.015 73 89 TYR N 1.383 0.012 74 90 CYS N 1.471 0.035 75 91 GLU N 1.468 0.014 76 93 HIS N 1.307 0.017 77 94 ARG N 1.478 0.020 78 96 ALA N 1.416 0.010 79 97 GLY N 1.455 0.023 80 98 MET N 1.412 0.017 81 99 VAL N 1.314 0.011 82 100 GLY N 1.420 0.020 83 101 LYS N 1.368 0.011 84 102 ILE N 1.365 0.011 85 103 THR N 1.317 0.018 86 104 VAL N 1.358 0.019 87 105 ALA N 1.398 0.013 88 106 GLY N 0.810 0.007 stop_ save_ save_relax_1_2 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_2 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 4 TYR N 1.352 0.011 2 5 THR N 1.276 0.009 3 6 VAL N 1.371 0.013 4 7 LYS N 1.399 0.012 5 8 LEU N 1.396 0.008 6 9 GLY N 1.249 0.010 7 10 SER N 1.493 0.009 8 11 ASP N 1.412 0.077 9 13 GLY N 1.437 0.006 10 14 LEU N 1.434 0.015 11 15 LEU N 1.335 0.007 12 16 VAL N 1.339 0.019 13 17 PHE N 1.432 0.009 14 18 GLU N 1.395 0.010 15 20 ALA N 1.177 0.009 16 21 LYS N 1.300 0.012 17 22 LEU N 1.329 0.016 18 23 THR N 1.326 0.023 19 24 ILE N 1.420 0.011 20 25 LYS N 1.389 0.013 21 27 GLY N 1.399 0.013 22 28 ASP N 1.486 0.012 23 29 THR N 1.382 0.011 24 30 VAL N 1.379 0.012 25 31 GLU N 1.404 0.016 26 32 PHE N 1.347 0.013 27 33 LEU N 1.383 0.013 28 34 ASN N 1.459 0.010 29 35 ASN N 1.420 0.011 30 36 LYS N 1.337 0.007 31 37 VAL N 1.376 0.010 32 40 HIS N 1.328 0.014 33 41 ASN N 1.409 0.010 34 42 VAL N 1.346 0.017 35 43 VAL N 1.354 0.013 36 44 PHE N 1.424 0.011 37 45 ASP N 1.493 0.009 38 46 ALA N 1.324 0.022 39 47 ALA N 1.328 0.006 40 48 LEU N 1.184 0.006 41 49 ASN N 1.343 0.012 42 51 ALA N 1.349 0.013 43 52 LYS N 1.513 0.011 44 53 SER N 1.444 0.011 45 56 LEU N 1.505 0.016 46 57 ALA N 1.393 0.011 47 58 LYS N 1.424 0.010 48 59 SER N 1.404 0.013 49 60 LEU N 1.494 0.009 50 61 SER N 1.325 0.009 51 62 HIS N 1.392 0.020 52 63 LYS N 1.263 0.070 53 64 GLN N 1.435 0.021 54 65 LEU N 1.381 0.008 55 66 LEU N 1.387 0.007 56 67 MET N 1.331 0.007 57 68 SER N 1.263 0.015 58 70 GLY N 1.379 0.014 59 71 GLN N 1.358 0.013 60 72 SER N 1.429 0.009 61 73 THR N 1.449 0.009 62 74 SER N 1.298 0.021 63 75 THR N 1.351 0.015 64 76 THR N 1.360 0.014 65 77 PHE N 1.428 0.011 66 79 ALA N 1.375 0.021 67 80 ASP N 1.442 0.010 68 81 ALA N 1.407 0.016 69 83 ALA N 1.303 0.010 70 84 GLY N 1.380 0.013 71 85 GLU N 1.350 0.007 72 86 TYR N 1.374 0.009 73 87 THR N 1.286 0.012 74 88 PHE N 1.541 0.011 75 89 TYR N 1.379 0.011 76 90 CYS N 1.407 0.059 77 91 GLU N 1.490 0.013 78 93 HIS N 1.307 0.013 79 94 ARG N 1.533 0.010 80 96 ALA N 1.414 0.008 81 97 GLY N 1.477 0.014 82 98 MET N 1.429 0.013 83 99 VAL N 1.333 0.007 84 100 GLY N 1.446 0.014 85 101 LYS N 1.389 0.008 86 102 ILE N 1.369 0.007 87 103 THR N 1.326 0.011 88 104 VAL N 1.381 0.022 89 105 ALA N 1.408 0.007 90 106 GLY N 0.799 0.007 stop_ save_ save_relax_1_3 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_3 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 3 THR N 1.291 0.064 2 4 TYR N 1.347 0.014 3 5 THR N 1.269 0.014 4 6 VAL N 1.371 0.022 5 7 LYS N 1.387 0.018 6 8 LEU N 1.399 0.019 7 9 GLY N 1.242 0.017 8 10 SER N 1.478 0.010 9 11 ASP N 1.387 0.036 10 13 GLY N 1.406 0.009 11 14 LEU N 1.443 0.017 12 15 LEU N 1.334 0.012 13 16 VAL N 1.325 0.020 14 17 PHE N 1.427 0.012 15 18 GLU N 1.404 0.019 16 20 ALA N 1.180 0.012 17 21 LYS N 1.291 0.023 18 22 LEU N 1.317 0.018 19 23 THR N 1.334 0.010 20 24 ILE N 1.418 0.018 21 25 LYS N 1.374 0.018 22 27 GLY N 1.410 0.018 23 28 ASP N 1.508 0.013 24 29 THR N 1.378 0.010 25 30 VAL N 1.376 0.014 26 31 GLU N 1.405 0.022 27 32 PHE N 1.363 0.018 28 33 LEU N 1.377 0.012 29 34 ASN N 1.470 0.012 30 35 ASN N 1.408 0.013 31 36 LYS N 1.327 0.013 32 37 VAL N 1.380 0.014 33 40 HIS N 1.328 0.018 34 41 ASN N 1.420 0.014 35 42 VAL N 1.349 0.024 36 43 VAL N 1.370 0.018 37 44 PHE N 1.433 0.013 38 45 ASP N 1.480 0.009 39 46 ALA N 1.347 0.022 40 47 ALA N 1.328 0.007 41 48 LEU N 1.181 0.010 42 49 ASN N 1.338 0.012 43 51 ALA N 1.339 0.015 44 52 LYS N 1.509 0.014 45 53 SER N 1.435 0.009 46 56 LEU N 1.521 0.015 47 57 ALA N 1.383 0.014 48 58 LYS N 1.410 0.012 49 59 SER N 1.406 0.012 50 60 LEU N 1.486 0.014 51 61 SER N 1.313 0.012 52 62 HIS N 1.393 0.021 53 63 LYS N 1.344 0.055 54 64 GLN N 1.427 0.016 55 65 LEU N 1.384 0.009 56 66 LEU N 1.404 0.009 57 67 MET N 1.313 0.008 58 68 SER N 1.289 0.019 59 70 GLY N 1.376 0.011 60 71 GLN N 1.362 0.018 61 72 SER N 1.431 0.012 62 73 THR N 1.460 0.012 63 74 SER N 1.360 0.025 64 75 THR N 1.358 0.014 65 76 THR N 1.361 0.015 66 77 PHE N 1.419 0.010 67 79 ALA N 1.363 0.030 68 80 ASP N 1.423 0.011 69 81 ALA N 1.406 0.023 70 83 ALA N 1.309 0.011 71 84 GLY N 1.371 0.018 72 85 GLU N 1.366 0.010 73 86 TYR N 1.358 0.011 74 87 THR N 1.287 0.014 75 88 PHE N 1.542 0.014 76 89 TYR N 1.382 0.016 77 90 CYS N 1.406 0.046 78 91 GLU N 1.486 0.016 79 93 HIS N 1.319 0.020 80 94 ARG N 1.513 0.014 81 96 ALA N 1.404 0.014 82 97 GLY N 1.482 0.011 83 98 MET N 1.432 0.017 84 99 VAL N 1.312 0.011 85 100 GLY N 1.440 0.020 86 101 LYS N 1.388 0.009 87 102 ILE N 1.364 0.015 88 103 THR N 1.341 0.017 89 104 VAL N 1.358 0.021 90 105 ALA N 1.408 0.016 91 106 GLY N 0.794 0.010 stop_ save_ save_relax_1_4 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_4 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 3 THR N 1.378 0.027 2 4 TYR N 1.370 0.013 3 5 THR N 1.251 0.014 4 6 VAL N 1.402 0.014 5 7 LYS N 1.417 0.014 6 8 LEU N 1.418 0.011 7 9 GLY N 1.251 0.013 8 10 SER N 1.494 0.014 9 11 ASP N 1.398 0.026 10 13 GLY N 1.439 0.007 11 14 LEU N 1.445 0.013 12 15 LEU N 1.338 0.011 13 16 VAL N 1.362 0.012 14 17 PHE N 1.438 0.010 15 18 GLU N 1.432 0.015 16 20 ALA N 1.199 0.011 17 21 LYS N 1.334 0.018 18 22 LEU N 1.338 0.021 19 23 THR N 1.330 0.006 20 24 ILE N 1.436 0.010 21 25 LYS N 1.397 0.013 22 27 GLY N 1.409 0.009 23 28 ASP N 1.513 0.019 24 29 THR N 1.411 0.010 25 30 VAL N 1.388 0.013 26 31 GLU N 1.419 0.022 27 32 PHE N 1.357 0.019 28 33 LEU N 1.394 0.015 29 34 ASN N 1.481 0.011 30 35 ASN N 1.426 0.008 31 36 LYS N 1.327 0.012 32 37 VAL N 1.406 0.011 33 40 HIS N 1.355 0.017 34 41 ASN N 1.436 0.011 35 42 VAL N 1.358 0.012 36 43 VAL N 1.373 0.014 37 44 PHE N 1.451 0.017 38 45 ASP N 1.511 0.009 39 46 ALA N 1.385 0.016 40 47 ALA N 1.343 0.009 41 48 LEU N 1.205 0.008 42 49 ASN N 1.363 0.007 43 51 ALA N 1.352 0.009 44 52 LYS N 1.502 0.009 45 53 SER N 1.468 0.019 46 54 ALA N 1.377 0.052 47 55 ASP N 1.387 0.029 48 56 LEU N 1.516 0.015 49 57 ALA N 1.425 0.021 50 58 LYS N 1.441 0.006 51 59 SER N 1.422 0.009 52 60 LEU N 1.512 0.009 53 61 SER N 1.326 0.009 54 62 HIS N 1.407 0.024 55 63 LYS N 1.302 0.068 56 64 GLN N 1.444 0.012 57 65 LEU N 1.386 0.008 58 66 LEU N 1.431 0.008 59 67 MET N 1.303 0.013 60 68 SER N 1.298 0.008 61 70 GLY N 1.369 0.013 62 71 GLN N 1.376 0.017 63 72 SER N 1.404 0.025 64 73 THR N 1.438 0.014 65 74 SER N 1.420 0.025 66 75 THR N 1.374 0.013 67 76 THR N 1.385 0.017 68 77 PHE N 1.463 0.011 69 79 ALA N 1.408 0.029 70 80 ASP N 1.418 0.018 71 81 ALA N 1.419 0.027 72 83 ALA N 1.293 0.015 73 84 GLY N 1.394 0.018 74 85 GLU N 1.348 0.011 75 86 TYR N 1.381 0.009 76 87 THR N 1.330 0.016 77 88 PHE N 1.551 0.010 78 89 TYR N 1.389 0.010 79 90 CYS N 1.518 0.041 80 91 GLU N 1.506 0.016 81 93 HIS N 1.342 0.025 82 94 ARG N 1.526 0.012 83 95 GLY N 1.545 0.079 84 96 ALA N 1.415 0.011 85 97 GLY N 1.489 0.008 86 98 MET N 1.455 0.012 87 99 VAL N 1.336 0.010 88 100 GLY N 1.447 0.018 89 101 LYS N 1.392 0.007 90 102 ILE N 1.376 0.011 91 103 THR N 1.367 0.016 92 104 VAL N 1.396 0.013 93 105 ALA N 1.442 0.016 94 106 GLY N 0.791 0.006 stop_ save_ save_relax_1_5 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_5 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 3 THR N 1.382 0.014 2 4 TYR N 1.354 0.010 3 5 THR N 1.263 0.011 4 6 VAL N 1.419 0.013 5 7 LYS N 1.412 0.022 6 8 LEU N 1.424 0.014 7 9 GLY N 1.270 0.014 8 10 SER N 1.489 0.011 9 11 ASP N 1.438 0.040 10 12 LYS N 1.308 0.157 11 13 GLY N 1.408 0.010 12 14 LEU N 1.455 0.018 13 15 LEU N 1.337 0.012 14 16 VAL N 1.361 0.019 15 17 PHE N 1.422 0.016 16 18 GLU N 1.410 0.018 17 20 ALA N 1.185 0.009 18 21 LYS N 1.299 0.014 19 22 LEU N 1.350 0.015 20 23 THR N 1.305 0.006 21 24 ILE N 1.435 0.013 22 25 LYS N 1.384 0.020 23 27 GLY N 1.402 0.017 24 28 ASP N 1.516 0.010 25 29 THR N 1.384 0.015 26 30 VAL N 1.405 0.015 27 31 GLU N 1.419 0.020 28 32 PHE N 1.371 0.022 29 33 LEU N 1.401 0.016 30 34 ASN N 1.483 0.012 31 35 ASN N 1.428 0.010 32 36 LYS N 1.327 0.014 33 37 VAL N 1.349 0.013 34 40 HIS N 1.360 0.019 35 41 ASN N 1.425 0.014 36 42 VAL N 1.364 0.019 37 43 VAL N 1.404 0.011 38 44 PHE N 1.463 0.017 39 45 ASP N 1.509 0.010 40 46 ALA N 1.407 0.011 41 47 ALA N 1.339 0.008 42 48 LEU N 1.187 0.017 43 49 ASN N 1.320 0.017 44 51 ALA N 1.338 0.012 45 52 LYS N 1.487 0.015 46 53 SER N 1.457 0.014 47 54 ALA N 1.468 0.027 48 55 ASP N 1.403 0.026 49 56 LEU N 1.487 0.009 50 57 ALA N 1.395 0.020 51 58 LYS N 1.436 0.010 52 59 SER N 1.367 0.022 53 60 LEU N 1.497 0.015 54 61 SER N 1.322 0.007 55 62 HIS N 1.438 0.014 56 63 LYS N 1.369 0.028 57 64 GLN N 1.401 0.008 58 65 LEU N 1.364 0.019 59 66 LEU N 1.421 0.010 60 67 MET N 1.307 0.008 61 68 SER N 1.292 0.009 62 70 GLY N 1.365 0.018 63 71 GLN N 1.382 0.017 64 72 SER N 1.409 0.015 65 73 THR N 1.464 0.009 66 74 SER N 1.356 0.013 67 75 THR N 1.365 0.008 68 76 THR N 1.341 0.014 69 77 PHE N 1.454 0.013 70 79 ALA N 1.404 0.008 71 80 ASP N 1.416 0.008 72 81 ALA N 1.441 0.017 73 83 ALA N 1.291 0.014 74 84 GLY N 1.392 0.015 75 85 GLU N 1.344 0.009 76 86 TYR N 1.378 0.012 77 87 THR N 1.300 0.010 78 88 PHE N 1.552 0.009 79 89 TYR N 1.430 0.010 80 90 CYS N 1.458 0.043 81 91 GLU N 1.520 0.014 82 93 HIS N 1.338 0.021 83 94 ARG N 1.565 0.012 84 95 GLY N 1.498 0.029 85 96 ALA N 1.386 0.020 86 97 GLY N 1.427 0.014 87 98 MET N 1.468 0.021 88 99 VAL N 1.348 0.009 89 100 GLY N 1.457 0.028 90 101 LYS N 1.394 0.009 91 102 ILE N 1.404 0.009 92 103 THR N 1.377 0.021 93 104 VAL N 1.398 0.018 94 105 ALA N 1.426 0.019 95 106 GLY N 0.780 0.019 stop_ save_ save_relax_1_6 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_6 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 3 THR N 1.400 0.010 2 4 TYR N 1.374 0.011 3 5 THR N 1.259 0.017 4 6 VAL N 1.392 0.022 5 7 LYS N 1.436 0.011 6 8 LEU N 1.444 0.013 7 9 GLY N 1.247 0.018 8 10 SER N 1.529 0.016 9 11 ASP N 1.387 0.010 10 12 LYS N 1.308 0.023 11 13 GLY N 1.412 0.014 12 14 LEU N 1.475 0.019 13 15 LEU N 1.305 0.009 14 16 VAL N 1.346 0.022 15 17 PHE N 1.469 0.021 16 18 GLU N 1.454 0.012 17 20 ALA N 1.172 0.016 18 21 LYS N 1.316 0.021 19 22 LEU N 1.361 0.011 20 23 THR N 1.287 0.009 21 24 ILE N 1.439 0.014 22 25 LYS N 1.419 0.028 23 27 GLY N 1.429 0.014 24 28 ASP N 1.527 0.012 25 29 THR N 1.399 0.018 26 30 VAL N 1.393 0.014 27 31 GLU N 1.454 0.013 28 32 PHE N 1.368 0.020 29 33 LEU N 1.408 0.027 30 34 ASN N 1.512 0.012 31 35 ASN N 1.446 0.013 32 36 LYS N 1.323 0.011 33 37 VAL N 1.332 0.022 34 40 HIS N 1.382 0.020 35 41 ASN N 1.478 0.026 36 42 VAL N 1.371 0.022 37 43 VAL N 1.400 0.011 38 44 PHE N 1.443 0.014 39 45 ASP N 1.477 0.013 40 46 ALA N 1.383 0.015 41 47 ALA N 1.337 0.011 42 48 LEU N 1.217 0.019 43 49 ASN N 1.342 0.009 44 51 ALA N 1.346 0.031 45 52 LYS N 1.474 0.017 46 53 SER N 1.440 0.015 47 54 ALA N 1.487 0.029 48 55 ASP N 1.476 0.023 49 56 LEU N 1.472 0.009 50 57 ALA N 1.413 0.025 51 58 LYS N 1.446 0.011 52 59 SER N 1.394 0.036 53 60 LEU N 1.517 0.015 54 61 SER N 1.307 0.021 55 62 HIS N 1.411 0.013 56 63 LYS N 1.341 0.023 57 64 GLN N 1.391 0.009 58 65 LEU N 1.418 0.020 59 66 LEU N 1.403 0.021 60 67 MET N 1.281 0.010 61 68 SER N 1.261 0.015 62 70 GLY N 1.350 0.013 63 71 GLN N 1.377 0.020 64 72 SER N 1.417 0.011 65 73 THR N 1.497 0.034 66 74 SER N 1.347 0.014 67 75 THR N 1.381 0.011 68 76 THR N 1.341 0.012 69 77 PHE N 1.504 0.025 70 79 ALA N 1.369 0.022 71 80 ASP N 1.388 0.016 72 81 ALA N 1.431 0.020 73 83 ALA N 1.318 0.010 74 84 GLY N 1.405 0.023 75 85 GLU N 1.334 0.008 76 86 TYR N 1.394 0.012 77 87 THR N 1.321 0.013 78 88 PHE N 1.559 0.010 79 89 TYR N 1.465 0.023 80 90 CYS N 1.521 0.024 81 91 GLU N 1.529 0.014 82 93 HIS N 1.397 0.055 83 94 ARG N 1.516 0.016 84 95 GLY N 1.549 0.047 85 96 ALA N 1.388 0.018 86 97 GLY N 1.474 0.012 87 98 MET N 1.458 0.019 88 99 VAL N 1.320 0.015 89 100 GLY N 1.460 0.020 90 101 LYS N 1.385 0.010 91 102 ILE N 1.396 0.012 92 103 THR N 1.361 0.015 93 104 VAL N 1.399 0.019 94 105 ALA N 1.441 0.014 95 106 GLY N 0.792 0.006 stop_ save_ save_relax_1_7 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_7 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 3 THR N 1.389 0.010 2 4 TYR N 1.371 0.012 3 5 THR N 1.269 0.014 4 6 VAL N 1.398 0.020 5 7 LYS N 1.422 0.029 6 8 LEU N 1.433 0.011 7 9 GLY N 1.262 0.009 8 10 SER N 1.512 0.009 9 11 ASP N 1.353 0.024 10 12 LYS N 1.260 0.016 11 13 GLY N 1.411 0.006 12 14 LEU N 1.461 0.013 13 15 LEU N 1.337 0.022 14 16 VAL N 1.352 0.026 15 17 PHE N 1.439 0.014 16 18 GLU N 1.422 0.007 17 20 ALA N 1.199 0.019 18 21 LYS N 1.323 0.014 19 22 LEU N 1.326 0.034 20 23 THR N 1.298 0.014 21 24 ILE N 1.440 0.012 22 25 LYS N 1.382 0.016 23 27 GLY N 1.434 0.016 24 28 ASP N 1.518 0.012 25 29 THR N 1.398 0.028 26 30 VAL N 1.387 0.020 27 31 GLU N 1.427 0.020 28 32 PHE N 1.385 0.012 29 33 LEU N 1.394 0.015 30 34 ASN N 1.475 0.017 31 35 ASN N 1.448 0.012 32 36 LYS N 1.322 0.036 33 37 VAL N 1.326 0.018 34 40 HIS N 1.346 0.012 35 41 ASN N 1.389 0.023 36 42 VAL N 1.377 0.007 37 43 VAL N 1.402 0.015 38 44 PHE N 1.446 0.014 39 45 ASP N 1.494 0.015 40 46 ALA N 1.366 0.012 41 47 ALA N 1.336 0.015 42 48 LEU N 1.193 0.005 43 49 ASN N 1.365 0.005 44 51 ALA N 1.340 0.007 45 52 LYS N 1.512 0.007 46 53 SER N 1.426 0.010 47 54 ALA N 1.469 0.013 48 55 ASP N 1.448 0.014 49 56 LEU N 1.455 0.011 50 57 ALA N 1.414 0.035 51 58 LYS N 1.432 0.009 52 59 SER N 1.404 0.012 53 60 LEU N 1.517 0.008 54 61 SER N 1.337 0.007 55 62 HIS N 1.424 0.010 56 63 LYS N 1.340 0.011 57 64 GLN N 1.405 0.011 58 65 LEU N 1.403 0.007 59 66 LEU N 1.407 0.010 60 67 MET N 1.302 0.011 61 68 SER N 1.267 0.010 62 70 GLY N 1.345 0.014 63 71 GLN N 1.382 0.010 64 72 SER N 1.405 0.019 65 73 THR N 1.449 0.045 66 74 SER N 1.323 0.009 67 75 THR N 1.382 0.008 68 76 THR N 1.334 0.014 69 77 PHE N 1.445 0.009 70 79 ALA N 1.349 0.033 71 80 ASP N 1.406 0.005 72 81 ALA N 1.408 0.038 73 83 ALA N 1.304 0.008 74 84 GLY N 1.392 0.017 75 85 GLU N 1.345 0.013 76 86 TYR N 1.376 0.010 77 87 THR N 1.310 0.010 78 88 PHE N 1.561 0.018 79 89 TYR N 1.466 0.018 80 90 CYS N 1.486 0.010 81 91 GLU N 1.539 0.011 82 93 HIS N 1.322 0.074 83 94 ARG N 1.552 0.013 84 95 GLY N 1.552 0.020 85 96 ALA N 1.390 0.017 86 97 GLY N 1.440 0.012 87 98 MET N 1.460 0.015 88 99 VAL N 1.352 0.019 89 100 GLY N 1.465 0.023 90 101 LYS N 1.394 0.013 91 102 ILE N 1.381 0.020 92 103 THR N 1.353 0.017 93 104 VAL N 1.381 0.017 94 105 ALA N 1.429 0.019 95 106 GLY N 0.788 0.018 stop_ save_ save_relax_1_8 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_8 _Spectrometer_frequency_1H 800 _T1_coherence_type Nz _T1_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 3 THR N 1.358 0.019 2 4 TYR N 1.369 0.019 3 5 THR N 1.275 0.012 4 6 VAL N 1.389 0.018 5 7 LYS N 1.419 0.013 6 8 LEU N 1.441 0.014 7 9 GLY N 1.261 0.022 8 10 SER N 1.512 0.014 9 11 ASP N 1.385 0.013 10 12 LYS N 1.286 0.011 11 13 GLY N 1.406 0.016 12 14 LEU N 1.450 0.018 13 15 LEU N 1.282 0.014 14 16 VAL N 1.360 0.022 15 17 PHE N 1.442 0.025 16 18 GLU N 1.411 0.016 17 20 ALA N 1.165 0.016 18 21 LYS N 1.334 0.021 19 22 LEU N 1.338 0.020 20 23 THR N 1.266 0.011 21 24 ILE N 1.448 0.013 22 25 LYS N 1.411 0.018 23 27 GLY N 1.417 0.023 24 28 ASP N 1.525 0.014 25 29 THR N 1.404 0.012 26 30 VAL N 1.392 0.017 27 31 GLU N 1.422 0.026 28 32 PHE N 1.394 0.016 29 33 LEU N 1.416 0.011 30 34 ASN N 1.484 0.021 31 35 ASN N 1.503 0.018 32 36 LYS N 1.326 0.007 33 37 VAL N 1.313 0.019 34 40 HIS N 1.375 0.022 35 41 ASN N 1.492 0.058 36 42 VAL N 1.402 0.011 37 43 VAL N 1.370 0.016 38 44 PHE N 1.425 0.022 39 45 ASP N 1.475 0.011 40 46 ALA N 1.359 0.012 41 47 ALA N 1.350 0.009 42 48 LEU N 1.199 0.010 43 49 ASN N 1.259 0.013 44 51 ALA N 1.340 0.012 45 52 LYS N 1.394 0.008 46 53 SER N 1.485 0.029 47 54 ALA N 1.452 0.014 48 55 ASP N 1.422 0.012 49 56 LEU N 1.471 0.009 50 57 ALA N 1.409 0.026 51 58 LYS N 1.438 0.007 52 59 SER N 1.428 0.012 53 60 LEU N 1.497 0.023 54 61 SER N 1.326 0.010 55 62 HIS N 1.392 0.012 56 63 LYS N 1.324 0.014 57 64 GLN N 1.360 0.008 58 65 LEU N 1.392 0.009 59 66 LEU N 1.416 0.017 60 67 MET N 1.262 0.009 61 68 SER N 1.253 0.015 62 70 GLY N 1.346 0.019 63 71 GLN N 1.408 0.016 64 72 SER N 1.430 0.014 65 73 THR N 1.452 0.015 66 74 SER N 1.331 0.012 67 75 THR N 1.383 0.010 68 76 THR N 1.357 0.013 69 77 PHE N 1.470 0.016 70 79 ALA N 1.367 0.012 71 80 ASP N 1.400 0.010 72 81 ALA N 1.424 0.022 73 83 ALA N 1.288 0.010 74 84 GLY N 1.395 0.020 75 85 GLU N 1.348 0.012 76 86 TYR N 1.390 0.011 77 87 THR N 1.336 0.011 78 88 PHE N 1.563 0.010 79 89 TYR N 1.467 0.022 80 90 CYS N 1.455 0.017 81 91 GLU N 1.528 0.015 82 94 ARG N 1.524 0.027 83 95 GLY N 1.539 0.014 84 96 ALA N 1.399 0.015 85 97 GLY N 1.428 0.020 86 98 MET N 1.464 0.043 87 99 VAL N 1.350 0.011 88 100 GLY N 1.474 0.020 89 101 LYS N 1.397 0.011 90 102 ILE N 1.396 0.017 91 103 THR N 1.382 0.013 92 104 VAL N 1.382 0.017 93 105 ALA N 1.415 0.018 94 106 GLY N 0.799 0.011 stop_ save_ save_relax_2_9 _Saveframe_category T2_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_9 _Spectrometer_frequency_1H 800 _T2_coherence_type Ny _T2_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T2_ID _Residue_seq_code _Residue_label _Atom_name _T2_value _T2_value_error _Rex_value _Rex_error 1 3 THR N 7.509 0.378 . . 2 4 TYR N 7.613 0.077 . . 3 5 THR N 7.141 0.053 . . 4 6 VAL N 7.802 0.060 . . 5 7 LYS N 7.680 0.072 . . 6 8 LEU N 8.698 0.121 . . 7 9 GLY N 7.836 0.121 . . 8 10 SER N 8.828 0.089 . . 9 11 ASP N 8.525 0.051 . . 10 12 LYS N 8.944 0.110 . . 11 13 GLY N 8.893 0.111 . . 12 14 LEU N 8.439 0.104 . . 13 15 LEU N 8.673 0.140 . . 14 16 VAL N 7.640 0.192 . . 15 17 PHE N 12.974 0.129 . . 16 18 GLU N 8.531 0.111 . . 17 20 ALA N 8.756 0.264 . . 18 21 LYS N 7.879 0.204 . . 19 22 LEU N 7.831 0.273 . . 20 23 THR N 7.015 0.047 . . 21 24 ILE N 8.091 0.098 . . 22 25 LYS N 8.226 0.059 . . 23 27 GLY N 7.371 0.065 . . 24 28 ASP N 8.716 0.127 . . 25 29 THR N 7.648 0.087 . . 26 30 VAL N 7.901 0.095 . . 27 31 GLU N 8.241 0.187 . . 28 32 PHE N 7.866 0.136 . . 29 33 LEU N 7.744 0.091 . . 30 34 ASN N 8.468 0.080 . . 31 35 ASN N 8.533 0.076 . . 32 36 LYS N 7.138 0.113 . . 33 37 VAL N 16.085 0.172 . . 34 40 HIS N 14.535 0.198 . . 35 41 ASN N 10.942 0.262 . . 36 42 VAL N 9.826 0.133 . . 37 43 VAL N 8.301 0.058 . . 38 44 PHE N 8.214 0.124 . . 39 45 ASP N 7.904 0.184 . . 40 46 ALA N 8.343 0.073 . . 41 47 ALA N 8.538 0.058 . . 42 48 LEU N 6.888 0.066 . . 43 49 ASN N 7.221 0.080 . . 44 51 ALA N 8.269 0.102 . . 45 52 LYS N 8.370 0.109 . . 46 53 SER N 7.996 0.175 . . 47 54 ALA N 8.524 0.067 . . 48 55 ASP N 8.396 0.088 . . 49 56 LEU N 7.950 0.082 . . 50 57 ALA N 8.650 0.162 . . 51 58 LYS N 8.630 0.243 . . 52 59 SER N 7.959 0.135 . . 53 60 LEU N 8.360 0.125 . . 54 61 SER N 7.937 0.103 . . 55 62 HIS N 8.584 0.075 . . 56 63 LYS N 8.388 0.082 . . 57 64 GLN N 8.978 0.067 . . 58 65 LEU N 7.588 0.065 . . 59 66 LEU N 7.388 0.176 . . 60 67 MET N 7.064 0.080 . . 61 68 SER N 8.701 0.307 . . 62 70 GLY N 6.573 0.271 . . 63 71 GLN N 8.390 0.203 . . 64 72 SER N 7.420 0.114 . . 65 73 THR N 7.923 0.088 . . 66 74 SER N 7.966 0.080 . . 67 75 THR N 8.226 0.164 . . 68 76 THR N 7.345 0.122 . . 69 77 PHE N 8.226 0.169 . . 70 79 ALA N 6.603 0.117 . . 71 80 ASP N 7.041 0.121 . . 72 81 ALA N 7.652 0.105 . . 73 83 ALA N 7.581 0.054 . . 74 84 GLY N 7.717 0.037 . . 75 85 GLU N 7.461 0.057 . . 76 86 TYR N 7.249 0.108 . . 77 87 THR N 8.398 0.093 . . 78 88 PHE N 8.731 0.162 . . 79 89 TYR N 8.258 0.133 . . 80 90 CYS N 12.956 0.090 . . 81 91 GLU N 8.401 0.147 . . 82 93 HIS N 48.208 12.734 . . 83 94 ARG N 12.978 0.232 . . 84 95 GLY N 9.791 0.070 . . 85 96 ALA N 9.371 0.074 . . 86 97 GLY N 8.277 0.154 . . 87 98 MET N 24.395 0.354 . . 88 99 VAL N 10.281 0.138 . . 89 100 GLY N 9.485 0.072 . . 90 101 LYS N 8.211 0.065 . . 91 102 ILE N 7.952 0.159 . . 92 103 THR N 8.073 0.270 . . 93 104 VAL N 7.955 0.039 . . 94 105 ALA N 7.723 0.056 . . 95 106 GLY N 2.446 0.081 . . stop_ save_ save_relax_2_10 _Saveframe_category T2_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_10 _Spectrometer_frequency_1H 800 _T2_coherence_type Ny _T2_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T2_ID _Residue_seq_code _Residue_label _Atom_name _T2_value _T2_value_error _Rex_value _Rex_error 1 3 THR N 6.887 0.071 . . 2 4 TYR N 7.682 0.082 . . 3 5 THR N 7.170 0.083 . . 4 6 VAL N 7.574 0.056 . . 5 7 LYS N 7.722 0.064 . . 6 8 LEU N 8.242 0.072 . . 7 9 GLY N 7.662 0.093 . . 8 10 SER N 8.750 0.127 . . 9 11 ASP N 8.511 0.070 . . 10 12 LYS N 8.276 0.082 . . 11 13 GLY N 8.413 0.098 . . 12 14 LEU N 8.469 0.053 . . 13 15 LEU N 7.919 0.114 . . 14 16 VAL N 7.716 0.128 . . 15 17 PHE N 11.705 0.140 . . 16 18 GLU N 7.945 0.060 . . 17 20 ALA N 8.119 0.111 . . 18 21 LYS N 7.662 0.069 . . 19 22 LEU N 7.685 0.045 . . 20 23 THR N 7.164 0.048 . . 21 24 ILE N 7.915 0.086 . . 22 25 LYS N 8.291 0.065 . . 23 27 GLY N 7.359 0.070 . . 24 28 ASP N 8.618 0.092 . . 25 29 THR N 7.622 0.048 . . 26 30 VAL N 7.783 0.164 . . 27 31 GLU N 8.127 0.059 . . 28 32 PHE N 7.722 0.130 . . 29 33 LEU N 7.565 0.113 . . 30 34 ASN N 8.259 0.098 . . 31 35 ASN N 8.396 0.110 . . 32 36 LYS N 7.217 0.065 . . 33 37 VAL N 13.276 0.146 . . 34 40 HIS N 11.864 0.176 . . 35 41 ASN N 9.738 0.172 . . 36 42 VAL N 8.879 0.107 . . 37 43 VAL N 8.240 0.069 . . 38 44 PHE N 7.822 0.174 . . 39 45 ASP N 7.892 0.090 . . 40 46 ALA N 8.415 0.131 . . 41 47 ALA N 8.513 0.055 . . 42 48 LEU N 6.926 0.086 . . 43 49 ASN N 7.558 0.081 . . 44 51 ALA N 7.966 0.094 . . 45 52 LYS N 8.312 0.061 . . 46 53 SER N 7.912 0.095 . . 47 54 ALA N 8.318 0.098 . . 48 55 ASP N 8.479 0.065 . . 49 56 LEU N 7.915 0.065 . . 50 57 ALA N 8.697 0.098 . . 51 58 LYS N 8.448 0.155 . . 52 59 SER N 8.386 0.119 . . 53 60 LEU N 8.166 0.075 . . 54 61 SER N 7.828 0.045 . . 55 62 HIS N 8.369 0.131 . . 56 63 LYS N 7.974 0.094 . . 57 64 GLN N 8.661 0.060 . . 58 65 LEU N 7.463 0.054 . . 59 66 LEU N 7.154 0.110 . . 60 67 MET N 7.029 0.054 . . 61 68 SER N 8.480 0.070 . . 62 70 GLY N 6.371 0.133 . . 63 71 GLN N 8.314 0.104 . . 64 72 SER N 7.545 0.052 . . 65 73 THR N 7.955 0.045 . . 66 74 SER N 7.773 0.108 . . 67 75 THR N 8.026 0.053 . . 68 76 THR N 7.423 0.071 . . 69 77 PHE N 8.365 0.124 . . 70 79 ALA N 6.610 0.068 . . 71 80 ASP N 7.142 0.089 . . 72 81 ALA N 7.666 0.153 . . 73 83 ALA N 7.719 0.068 . . 74 84 GLY N 7.703 0.056 . . 75 85 GLU N 7.434 0.091 . . 76 86 TYR N 7.426 0.069 . . 77 87 THR N 8.410 0.067 . . 78 88 PHE N 8.119 0.093 . . 79 89 TYR N 8.250 0.169 . . 80 90 CYS N 11.229 0.084 . . 81 91 GLU N 8.275 0.111 . . 82 93 HIS N 36.230 1.710 . . 83 94 ARG N 11.293 0.120 . . 84 95 GLY N 9.073 0.100 . . 85 96 ALA N 8.600 0.216 . . 86 97 GLY N 8.168 0.235 . . 87 98 MET N 18.744 0.219 . . 88 99 VAL N 9.639 0.123 . . 89 100 GLY N 9.019 0.081 . . 90 101 LYS N 8.060 0.068 . . 91 102 ILE N 7.793 0.055 . . 92 103 THR N 7.843 0.129 . . 93 104 VAL N 7.921 0.064 . . 94 105 ALA N 7.816 0.073 . . 95 106 GLY N 2.693 0.054 . . stop_ save_ save_relax_2_11 _Saveframe_category T2_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_11 _Spectrometer_frequency_1H 800 _T2_coherence_type Ny _T2_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T2_ID _Residue_seq_code _Residue_label _Atom_name _T2_value _T2_value_error _Rex_value _Rex_error 1 3 THR N 6.781 0.046 . . 2 4 TYR N 7.434 0.121 . . 3 5 THR N 7.060 0.080 . . 4 6 VAL N 7.696 0.073 . . 5 7 LYS N 7.673 0.090 . . 6 8 LEU N 9.911 0.180 . . 7 9 GLY N 7.753 0.108 . . 8 10 SER N 8.883 0.137 . . 9 11 ASP N 8.823 0.111 . . 10 12 LYS N 8.143 0.159 . . 11 13 GLY N 8.084 0.118 . . 12 14 LEU N 8.259 0.095 . . 13 15 LEU N 7.605 0.101 . . 14 16 VAL N 6.193 2.414 . . 15 17 PHE N 7.717 0.152 . . 16 18 GLU N 7.786 0.101 . . 17 20 ALA N 7.904 0.132 . . 18 21 LYS N 7.646 0.046 . . 19 22 LEU N 7.523 0.192 . . 20 23 THR N 6.519 0.062 . . 21 24 ILE N 7.883 0.137 . . 22 25 LYS N 8.256 0.101 . . 23 27 GLY N 7.342 0.148 . . 24 28 ASP N 8.334 0.081 . . 25 29 THR N 7.523 0.104 . . 26 30 VAL N 7.533 0.290 . . 27 31 GLU N 8.085 0.131 . . 28 32 PHE N 7.790 0.109 . . 29 33 LEU N 7.420 0.084 . . 30 34 ASN N 8.146 0.116 . . 31 35 ASN N 8.624 0.136 . . 32 36 LYS N 6.963 0.071 . . 33 37 VAL N 10.768 0.170 . . 34 40 HIS N 9.604 0.131 . . 35 41 ASN N 8.669 0.177 . . 36 42 VAL N 8.432 0.089 . . 37 43 VAL N 8.357 0.089 . . 38 44 PHE N 7.668 0.211 . . 39 45 ASP N 7.337 0.124 . . 40 46 ALA N 8.187 0.079 . . 41 47 ALA N 8.389 0.096 . . 42 48 LEU N 7.124 0.091 . . 43 49 ASN N 7.291 0.079 . . 44 51 ALA N 8.089 0.157 . . 45 52 LYS N 8.410 0.103 . . 46 53 SER N 7.618 0.072 . . 47 54 ALA N 8.211 0.119 . . 48 55 ASP N 7.988 0.110 . . 49 56 LEU N 7.836 0.074 . . 50 57 ALA N 8.565 0.076 . . 51 58 LYS N 8.664 0.119 . . 52 59 SER N 8.409 0.188 . . 53 60 LEU N 8.425 0.104 . . 54 61 SER N 7.941 0.109 . . 55 62 HIS N 7.974 0.116 . . 56 63 LYS N 7.901 0.099 . . 57 64 GLN N 8.171 0.099 . . 58 65 LEU N 6.900 0.115 . . 59 66 LEU N 7.165 0.151 . . 60 67 MET N 7.109 0.095 . . 61 68 SER N 7.961 0.110 . . 62 70 GLY N 6.489 0.087 . . 63 71 GLN N 8.393 0.102 . . 64 72 SER N 7.883 0.109 . . 65 73 THR N 7.143 0.143 . . 66 74 SER N 7.636 0.081 . . 67 75 THR N 8.129 0.107 . . 68 76 THR N 7.345 0.078 . . 69 77 PHE N 8.335 0.091 . . 70 79 ALA N 6.518 0.080 . . 71 80 ASP N 6.860 0.110 . . 72 81 ALA N 7.544 0.091 . . 73 83 ALA N 7.367 0.073 . . 74 84 GLY N 7.788 0.082 . . 75 85 GLU N 7.145 0.084 . . 76 86 TYR N 7.500 0.086 . . 77 87 THR N 8.316 0.125 . . 78 88 PHE N 7.868 0.101 . . 79 89 TYR N 8.429 0.121 . . 80 90 CYS N 9.794 0.137 . . 81 91 GLU N 8.442 0.135 . . 82 93 HIS N 21.722 0.900 . . 83 94 ARG N 9.578 0.165 . . 84 95 GLY N 8.630 0.110 . . 85 96 ALA N 8.109 0.074 . . 86 97 GLY N 7.962 0.218 . . 87 98 MET N 13.994 0.175 . . 88 99 VAL N 8.429 0.116 . . 89 100 GLY N 8.892 0.137 . . 90 101 LYS N 7.890 0.088 . . 91 102 ILE N 7.998 0.137 . . 92 103 THR N 7.802 0.104 . . 93 104 VAL N 7.805 0.075 . . 94 105 ALA N 7.828 0.117 . . 95 106 GLY N 2.942 0.053 . . stop_ save_ save_relax_2_12 _Saveframe_category T2_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_12 _Spectrometer_frequency_1H 800 _T2_coherence_type Ny _T2_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T2_ID _Residue_seq_code _Residue_label _Atom_name _T2_value _T2_value_error _Rex_value _Rex_error 1 3 THR N 8.253 0.254 . . 2 4 TYR N 8.613 0.093 . . 3 5 THR N 8.174 0.060 . . 4 6 VAL N 8.605 0.054 . . 5 7 LYS N 8.721 0.047 . . 6 8 LEU N 9.368 0.075 . . 7 9 GLY N 8.892 0.075 . . 8 10 SER N 9.880 0.098 . . 9 11 ASP N 9.727 0.134 . . 10 12 LYS N 10.123 0.089 . . 11 13 GLY N 9.874 0.075 . . 12 14 LEU N 9.584 0.075 . . 13 15 LEU N 9.611 0.088 . . 14 16 VAL N 9.062 0.095 . . 15 17 PHE N 15.046 0.181 . . 16 18 GLU N 9.406 0.092 . . 17 20 ALA N 9.373 0.064 . . 18 21 LYS N 8.836 0.057 . . 19 22 LEU N 8.722 0.193 . . 20 23 THR N 8.282 0.083 . . 21 24 ILE N 9.126 0.100 . . 22 25 LYS N 9.503 0.062 . . 23 27 GLY N 8.405 0.093 . . 24 28 ASP N 9.811 0.059 . . 25 29 THR N 8.585 0.046 . . 26 30 VAL N 8.900 0.042 . . 27 31 GLU N 9.229 0.048 . . 28 32 PHE N 8.801 0.081 . . 29 33 LEU N 8.737 0.165 . . 30 34 ASN N 9.417 0.071 . . 31 35 ASN N 9.405 0.148 . . 32 36 LYS N 8.266 0.044 . . 33 37 VAL N 16.694 0.349 . . 34 40 HIS N 16.458 0.167 . . 35 41 ASN N 12.094 0.295 . . 36 42 VAL N 10.689 0.055 . . 37 43 VAL N 9.508 0.053 . . 38 44 PHE N 8.847 0.164 . . 39 45 ASP N 9.080 0.104 . . 40 46 ALA N 9.554 0.060 . . 41 47 ALA N 9.984 0.076 . . 42 48 LEU N 8.075 0.073 . . 43 49 ASN N 8.607 0.087 . . 44 51 ALA N 9.128 0.054 . . 45 52 LYS N 9.597 0.101 . . 46 53 SER N 8.875 0.070 . . 47 54 ALA N 9.794 0.129 . . 48 55 ASP N 9.656 0.091 . . 49 56 LEU N 9.382 0.113 . . 50 57 ALA N 9.878 0.081 . . 51 58 LYS N 9.776 0.066 . . 52 59 SER N 9.308 0.177 . . 53 60 LEU N 9.520 0.054 . . 54 61 SER N 9.112 0.160 . . 55 62 HIS N 11.025 0.075 . . 56 63 LYS N 9.822 0.089 . . 57 64 GLN N 10.354 0.081 . . 58 65 LEU N 9.163 0.076 . . 59 66 LEU N 8.347 0.108 . . 60 67 MET N 8.225 0.144 . . 61 68 SER N 10.667 0.102 . . 62 70 GLY N 7.411 0.070 . . 63 71 GLN N 9.654 0.080 . . 64 72 SER N 8.558 0.059 . . 65 73 THR N 9.210 0.079 . . 66 74 SER N 9.719 0.093 . . 67 75 THR N 9.592 0.054 . . 68 76 THR N 8.309 0.067 . . 69 77 PHE N 9.644 0.158 . . 70 79 ALA N 7.854 0.080 . . 71 80 ASP N 8.312 0.145 . . 72 81 ALA N 8.738 0.121 . . 73 83 ALA N 8.920 0.114 . . 74 84 GLY N 8.667 0.102 . . 75 85 GLU N 8.746 0.052 . . 76 86 TYR N 8.409 0.069 . . 77 87 THR N 9.434 0.067 . . 78 88 PHE N 10.209 0.089 . . 79 89 TYR N 9.662 0.185 . . 80 90 CYS N 14.011 0.104 . . 81 91 GLU N 9.433 0.136 . . 82 93 HIS N 54.000 6.823 . . 83 94 ARG N 13.878 0.166 . . 84 95 GLY N 11.016 0.092 . . 85 96 ALA N 10.586 0.097 . . 86 97 GLY N 9.651 0.178 . . 87 98 MET N 26.981 0.679 . . 88 99 VAL N 11.258 0.083 . . 89 100 GLY N 10.708 0.084 . . 90 101 LYS N 9.357 0.087 . . 91 102 ILE N 8.901 0.058 . . 92 103 THR N 8.956 0.059 . . 93 104 VAL N 9.002 0.079 . . 94 105 ALA N 8.901 0.071 . . 95 106 GLY N 2.819 0.035 . . stop_ save_ save_relax_2_13 _Saveframe_category T2_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_13 _Spectrometer_frequency_1H 800 _T2_coherence_type Ny _T2_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T2_ID _Residue_seq_code _Residue_label _Atom_name _T2_value _T2_value_error _Rex_value _Rex_error 1 3 THR N 7.221 0.078 . . 2 4 TYR N 6.690 0.068 . . 3 5 THR N 6.381 0.054 . . 4 6 VAL N 6.927 0.046 . . 5 7 LYS N 6.837 0.039 . . 6 8 LEU N 7.129 0.047 . . 7 9 GLY N 6.986 0.091 . . 8 10 SER N 7.751 0.076 . . 9 11 ASP N 8.054 0.102 . . 10 12 LYS N 9.103 0.133 . . 11 13 GLY N 7.709 0.143 . . 12 14 LEU N 7.546 0.089 . . 13 15 LEU N 7.155 0.101 . . 14 16 VAL N 6.980 0.068 . . 15 17 PHE N 10.107 0.081 . . 16 18 GLU N 7.221 0.064 . . 17 20 ALA N 6.505 0.226 . . 18 21 LYS N 6.921 0.093 . . 19 22 LEU N 6.875 0.062 . . 20 23 THR N 6.618 0.049 . . 21 24 ILE N 7.109 0.052 . . 22 25 LYS N 7.398 0.090 . . 23 27 GLY N 6.584 0.039 . . 24 28 ASP N 7.791 0.068 . . 25 29 THR N 6.807 0.041 . . 26 30 VAL N 7.002 0.071 . . 27 31 GLU N 7.387 0.089 . . 28 32 PHE N 6.899 0.083 . . 29 33 LEU N 6.634 0.054 . . 30 34 ASN N 7.446 0.061 . . 31 35 ASN N 7.570 0.092 . . 32 36 LYS N 7.328 0.094 . . 33 37 VAL N 11.303 0.133 . . 34 40 HIS N 9.756 0.086 . . 35 41 ASN N 8.494 0.112 . . 36 42 VAL N 8.296 0.090 . . 37 43 VAL N 7.525 0.079 . . 38 44 PHE N 6.957 0.121 . . 39 45 ASP N 7.251 0.066 . . 40 46 ALA N 7.853 0.066 . . 41 47 ALA N 7.693 0.069 . . 42 48 LEU N 6.233 0.066 . . 43 49 ASN N 6.724 0.081 . . 44 51 ALA N 7.285 0.050 . . 45 52 LYS N 7.578 0.046 . . 46 53 SER N 7.209 0.036 . . 47 54 ALA N 8.357 0.095 . . 48 55 ASP N 8.358 0.089 . . 49 56 LEU N 7.456 0.068 . . 50 57 ALA N 7.968 0.070 . . 51 58 LYS N 7.853 0.185 . . 52 59 SER N 6.491 0.480 . . 53 60 LEU N 7.620 0.037 . . 54 61 SER N 7.197 0.039 . . 55 62 HIS N 8.864 0.087 . . 56 63 LYS N 8.031 0.102 . . 57 64 GLN N 7.974 0.087 . . 58 65 LEU N 7.034 0.036 . . 59 66 LEU N 6.581 0.069 . . 60 67 MET N 6.305 0.052 . . 61 68 SER N 7.705 0.058 . . 62 70 GLY N 5.795 0.048 . . 63 71 GLN N 7.405 0.079 . . 64 72 SER N 6.535 0.069 . . 65 73 THR N 7.090 0.080 . . 66 74 SER N 7.916 0.112 . . 67 75 THR N 7.282 0.085 . . 68 76 THR N 6.858 0.071 . . 69 77 PHE N 7.368 0.075 . . 70 79 ALA N 6.367 0.103 . . 71 80 ASP N 6.351 0.098 . . 72 81 ALA N 6.968 0.111 . . 73 83 ALA N 6.902 0.080 . . 74 84 GLY N 6.718 0.061 . . 75 85 GLU N 6.749 0.051 . . 76 86 TYR N 6.723 0.074 . . 77 87 THR N 7.394 0.071 . . 78 88 PHE N 7.713 0.100 . . 79 89 TYR N 7.523 0.046 . . 80 90 CYS N 9.951 0.097 . . 81 91 GLU N 7.340 0.089 . . 82 93 HIS N 28.540 1.228 . . 83 94 ARG N 10.505 0.124 . . 84 95 GLY N 9.551 0.127 . . 85 96 ALA N 8.232 0.147 . . 86 97 GLY N 7.622 0.159 . . 87 98 MET N 16.517 0.171 . . 88 99 VAL N 8.474 0.101 . . 89 100 GLY N 7.973 0.078 . . 90 101 LYS N 7.171 0.050 . . 91 102 ILE N 7.096 0.086 . . 92 103 THR N 7.114 0.033 . . 93 104 VAL N 7.084 0.051 . . 94 105 ALA N 6.905 0.062 . . 95 106 GLY N 2.026 0.055 . . stop_ save_ save_relax_2_14 _Saveframe_category T2_relaxation _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Condition_14 _Spectrometer_frequency_1H 800 _T2_coherence_type Ny _T2_value_units s-1 _Mol_system_component_name 'plastocyanin monomer' _Text_data_format . _Text_data . loop_ _T2_ID _Residue_seq_code _Residue_label _Atom_name _T2_value _T2_value_error _Rex_value _Rex_error 1 3 THR N 7.156 0.161 . . 2 4 TYR N 6.126 0.039 . . 3 5 THR N 5.799 0.045 . . 4 6 VAL N 6.271 0.042 . . 5 7 LYS N 6.251 0.068 . . 6 8 LEU N 6.226 0.097 . . 7 9 GLY N 6.052 0.061 . . 8 10 SER N 7.080 0.044 . . 9 11 ASP N 7.751 0.111 . . 10 12 LYS N 8.866 0.356 . . 11 13 GLY N 7.439 0.116 . . 12 14 LEU N 6.924 0.067 . . 13 15 LEU N 6.255 0.113 . . 14 16 VAL N 6.195 0.062 . . 15 17 PHE N 8.619 0.079 . . 16 18 GLU N 6.323 0.035 . . 17 20 ALA N 6.467 0.043 . . 18 21 LYS N 6.052 0.088 . . 19 22 LEU N 6.097 0.032 . . 20 23 THR N 5.922 0.070 . . 21 24 ILE N 6.334 0.075 . . 22 25 LYS N 6.712 0.041 . . 23 27 GLY N 5.970 0.063 . . 24 28 ASP N 6.880 0.130 . . 25 29 THR N 6.220 0.038 . . 26 30 VAL N 6.465 0.042 . . 27 31 GLU N 6.687 0.041 . . 28 32 PHE N 6.096 0.074 . . 29 33 LEU N 6.033 0.116 . . 30 34 ASN N 6.809 0.068 . . 31 35 ASN N 6.593 0.078 . . 32 36 LYS N 5.796 0.095 . . 33 37 VAL N 9.329 0.110 . . 34 40 HIS N 8.008 0.117 . . 35 41 ASN N 7.242 0.094 . . 36 42 VAL N 7.346 0.068 . . 37 43 VAL N 6.866 0.047 . . 38 44 PHE N 6.361 0.083 . . 39 45 ASP N 6.453 0.060 . . 40 46 ALA N 7.505 0.063 . . 41 47 ALA N 7.037 0.055 . . 42 48 LEU N 5.645 0.050 . . 43 49 ASN N 6.017 0.028 . . 44 51 ALA N 6.658 0.056 . . 45 52 LYS N 6.745 0.092 . . 46 53 SER N 6.656 0.065 . . 47 54 ALA N 8.271 0.200 . . 48 55 ASP N 8.013 0.159 . . 49 56 LEU N 6.761 0.132 . . 50 57 ALA N 7.227 0.055 . . 51 58 LYS N 6.720 0.066 . . 52 59 SER N 6.434 0.130 . . 53 60 LEU N 6.845 0.103 . . 54 61 SER N 6.419 0.047 . . 55 62 HIS N 8.112 0.094 . . 56 63 LYS N 7.771 0.147 . . 57 64 GLN N 7.427 0.066 . . 58 65 LEU N 6.404 0.042 . . 59 66 LEU N 5.637 0.191 . . 60 67 MET N 5.923 0.105 . . 61 68 SER N 6.845 0.043 . . 62 70 GLY N 5.437 0.103 . . 63 71 GLN N 6.699 0.090 . . 64 72 SER N 5.971 0.070 . . 65 73 THR N 6.518 0.055 . . 66 74 SER N 7.455 0.115 . . 67 75 THR N 6.690 0.062 . . 68 76 THR N 6.321 0.106 . . 69 77 PHE N 6.662 0.075 . . 70 79 ALA N 6.230 0.087 . . 71 80 ASP N 5.887 0.044 . . 72 81 ALA N 6.208 0.139 . . 73 83 ALA N 6.116 0.086 . . 74 84 GLY N 6.238 0.064 . . 75 85 GLU N 6.220 0.047 . . 76 86 TYR N 6.026 0.058 . . 77 87 THR N 6.886 0.076 . . 78 88 PHE N 6.973 0.151 . . 79 89 TYR N 6.859 0.129 . . 80 90 CYS N 8.303 0.087 . . 81 91 GLU N 6.565 0.098 . . 82 93 HIS N 21.832 0.481 . . 83 94 ARG N 9.083 0.069 . . 84 95 GLY N 9.087 0.218 . . 85 96 ALA N 7.301 0.064 . . 86 97 GLY N 7.038 0.165 . . 87 98 MET N 13.023 0.140 . . 88 99 VAL N 7.605 0.113 . . 89 100 GLY N 7.056 0.053 . . 90 101 LYS N 6.560 0.059 . . 91 102 ILE N 6.324 0.045 . . 92 103 THR N 6.383 0.064 . . 93 104 VAL N 6.579 0.062 . . 94 105 ALA N 6.303 0.053 . . 95 106 GLY N 1.912 0.023 . . stop_ save_