data_17771 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Resonance Assignments of Calmodulin Complexed with the Calmodulin-Binding Domain of Olfactory Nucleotide Gated Ion Channel ; _BMRB_accession_number 17771 _BMRB_flat_file_name bmr17771.str _Entry_type original _Submission_date 2011-07-08 _Accession_date 2011-07-08 _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 Deli Irene . . 2 Chyan 'Chia Lin' . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 4 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 1946 "13C chemical shifts" 1371 "15N chemical shifts" 348 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-10-07 update author 'update reference citation' 2013-03-27 update author 'update chemical shifts, etc.' 2012-09-20 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 19689 'a phytocystatin from Sesamum indicum L.' stop_ save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'Binding orientation and specificity of calmodulin to rat olfactory cyclic nucleotide-gated ion channel.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22877078 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Irene Deli . . 2 Huang Jian-Wen . . 3 Chung Tse-Yu . . 4 Li Feng-Yin . . 5 Tzen 'Jason T-C' . . 6 Lin Ta-Hsien . . 7 Chyan Chia-Lin . . stop_ _Journal_abbreviation 'J. Biomol. Struct. Dyn.' _Journal_name_full 'Journal of biomolecular structure & dynamics' _Journal_volume 31 _Journal_issue 4 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 414 _Page_last 425 _Year 2013 _Details . save_ ####################################### # Cited references within the entry # ####################################### save_Sesame_Cystatin _Saveframe_category citation _Citation_full . _Citation_title 'Resonance assignments and secondary structure of calmodulin in complex with its target sequence in rat olfactory cyclic nucleotide-gated ion channel.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 23315338 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Irene Deli . . 2 Sung Fu-Hsing . . 3 Huang Jian-Wen . . 4 Lin Ta-Hsien . . 5 Chen Yi-Chen . . 6 Chyan Chia-Lin . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular NMR assignments' _Journal_volume 8 _Journal_issue 1 _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 97 _Page_last 102 _Year 2014 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'CaM-OLFp complex' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Chain 1' $Calmodulin 'Chain 2' $OLFp 'Calcium ion' $CA stop_ _System_molecular_weight 21000 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Calmodulin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Calmodulin _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 148 _Mol_residue_sequence ; ADQLTEEQIAEFKEAFSLFD KDGDGTITTKELGTVMRSLG QNPTEAELQDMINEVDADGN GTIDFPEFLTMMARKMKDTD SEEEIREAFRVFDKDGNGYI SAAELRHVMTNLGEKLTDEE VDEMIREADIDGDGQVNYEE FVQMMTAK ; loop_ _Residue_seq_code _Residue_label 1 ALA 2 ASP 3 GLN 4 LEU 5 THR 6 GLU 7 GLU 8 GLN 9 ILE 10 ALA 11 GLU 12 PHE 13 LYS 14 GLU 15 ALA 16 PHE 17 SER 18 LEU 19 PHE 20 ASP 21 LYS 22 ASP 23 GLY 24 ASP 25 GLY 26 THR 27 ILE 28 THR 29 THR 30 LYS 31 GLU 32 LEU 33 GLY 34 THR 35 VAL 36 MET 37 ARG 38 SER 39 LEU 40 GLY 41 GLN 42 ASN 43 PRO 44 THR 45 GLU 46 ALA 47 GLU 48 LEU 49 GLN 50 ASP 51 MET 52 ILE 53 ASN 54 GLU 55 VAL 56 ASP 57 ALA 58 ASP 59 GLY 60 ASN 61 GLY 62 THR 63 ILE 64 ASP 65 PHE 66 PRO 67 GLU 68 PHE 69 LEU 70 THR 71 MET 72 MET 73 ALA 74 ARG 75 LYS 76 MET 77 LYS 78 ASP 79 THR 80 ASP 81 SER 82 GLU 83 GLU 84 GLU 85 ILE 86 ARG 87 GLU 88 ALA 89 PHE 90 ARG 91 VAL 92 PHE 93 ASP 94 LYS 95 ASP 96 GLY 97 ASN 98 GLY 99 TYR 100 ILE 101 SER 102 ALA 103 ALA 104 GLU 105 LEU 106 ARG 107 HIS 108 VAL 109 MET 110 THR 111 ASN 112 LEU 113 GLY 114 GLU 115 LYS 116 LEU 117 THR 118 ASP 119 GLU 120 GLU 121 VAL 122 ASP 123 GLU 124 MET 125 ILE 126 ARG 127 GLU 128 ALA 129 ASP 130 ILE 131 ASP 132 GLY 133 ASP 134 GLY 135 GLN 136 VAL 137 ASN 138 TYR 139 GLU 140 GLU 141 PHE 142 VAL 143 GLN 144 MET 145 MET 146 THR 147 ALA 148 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-10-14 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 15184 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 15185 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 15186 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 15187 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 15188 calmodulin 100.00 148 99.32 100.00 9.33e-100 BMRB 15191 Calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 15470 calmodulin 100.00 148 99.32 100.00 1.92e-99 BMRB 15624 Calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 15650 calmodulin 100.00 148 99.32 100.00 3.17e-99 BMRB 15852 calmodulin 100.00 148 99.32 100.00 3.17e-99 BMRB 1634 calmodulin 100.00 148 97.30 99.32 2.42e-97 BMRB 16418 apoCaM 100.00 148 100.00 100.00 4.69e-100 BMRB 16465 entity_1 100.00 148 100.00 100.00 4.69e-100 BMRB 1648 calmodulin 100.00 148 97.30 99.32 2.42e-97 BMRB 16764 CALMODULIN 100.00 150 100.00 100.00 5.01e-100 BMRB 17264 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 17360 entity_1 100.00 148 100.00 100.00 4.69e-100 BMRB 17807 Calmodulin 99.32 147 100.00 100.00 2.44e-99 BMRB 18027 CaM 100.00 148 100.00 100.00 4.69e-100 BMRB 18028 CaM 100.00 148 100.00 100.00 4.69e-100 BMRB 18556 Calmodulin 100.00 148 98.65 99.32 2.53e-98 BMRB 19036 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 19238 Calmodulin_prototypical_calcium_sensor 100.00 148 100.00 100.00 4.69e-100 BMRB 19586 entity_1 100.00 148 100.00 100.00 4.69e-100 BMRB 19604 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 25253 CaM 100.00 148 98.65 99.32 1.17e-97 BMRB 25257 CaM 100.00 148 98.65 99.32 1.17e-97 BMRB 26503 Calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 26626 CaM 100.00 148 100.00 100.00 4.69e-100 BMRB 26627 CaM 100.00 148 100.00 100.00 4.69e-100 BMRB 4056 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 4270 calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 4284 Calmodulin 100.00 148 100.00 100.00 4.69e-100 BMRB 4310 calmodulin 100.00 148 100.00 100.00 4.69e-100 PDB 1A29 "Calmodulin Complexed With Trifluoperazine (1:2 Complex)" 100.00 148 100.00 100.00 4.69e-100 PDB 1CFC "Calcium-Free Calmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 1CFD "Calcium-Free Calmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 1CFF "Nmr Solution Structure Of A Complex Of Calmodulin With A Binding Peptide Of The Ca2+-Pump" 100.00 148 100.00 100.00 4.69e-100 PDB 1CKK "CalmodulinRAT CA2+CALMODULIN DEPENDENT PROTEIN KINASE Fragment" 100.00 148 100.00 100.00 4.69e-100 PDB 1CLL "Calmodulin Structure Refined At 1.7 Angstroms Resolution" 100.00 148 100.00 100.00 4.69e-100 PDB 1CM1 "Motions Of Calmodulin-Single-Conformer Refinement" 100.00 148 100.00 100.00 4.69e-100 PDB 1CM4 "Motions Of Calmodulin-four-conformer Refinement" 100.00 148 100.00 100.00 4.69e-100 PDB 1CTR "Drug Binding By Calmodulin: Crystal Structure Of A Calmodulin-Trifluoperazine Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 1DMO "Calmodulin, Nmr, 30 Structures" 100.00 148 99.32 100.00 1.92e-99 PDB 1G4Y "1.60 A Crystal Structure Of The Gating Domain From Small Conductance Potassium Channel Complexed With Calcium-Calmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 1IQ5 "CalmodulinNEMATODE CA2+CALMODULIN DEPENDENT KINASE KINASE Fragment" 100.00 149 100.00 100.00 4.90e-100 PDB 1IWQ "Crystal Structure Of Marcks Calmodulin Binding Domain Peptide Complexed With Ca2+CALMODULIN" 100.00 148 100.00 100.00 4.69e-100 PDB 1K90 "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" 100.00 148 100.00 100.00 4.69e-100 PDB 1K93 "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin" 97.30 144 100.00 100.00 4.22e-97 PDB 1L7Z "Crystal Structure Of Ca2+/calmodulin Complexed With Myristoylated Cap-23/nap-22 Peptide" 100.00 148 100.00 100.00 4.69e-100 PDB 1LIN "Calmodulin Complexed With Trifluoperazine (1:4 Complex)" 100.00 148 100.00 100.00 4.69e-100 PDB 1LVC "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 2' Deoxy, 3' Anthr" 100.00 149 100.00 100.00 4.90e-100 PDB 1MUX "Solution Nmr Structure Of CalmodulinW-7 Complex: The Basis Of Diversity In Molecular Recognition, 30 Structures" 100.00 148 100.00 100.00 4.69e-100 PDB 1MXE "Structure Of The Complex Of Calmodulin With The Target Sequence Of Camki" 100.00 148 97.97 99.32 6.47e-98 PDB 1NWD "Solution Structure Of Ca2+CALMODULIN BOUND TO THE C- Terminal Domain Of Petunia Glutamate Decarboxylase" 100.00 148 100.00 100.00 4.69e-100 PDB 1OOJ "Structural Genomics Of Caenorhabditis Elegans : Calmodulin" 100.00 149 97.97 98.65 1.22e-97 PDB 1PRW "Crystal Structure Of Bovine Brain Ca++ Calmodulin In A Compact Form" 100.00 149 99.32 99.32 4.08e-99 PDB 1QIV "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd), 1:2 Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 1QIW "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd)" 100.00 148 100.00 100.00 4.69e-100 PDB 1QX5 "Crystal Structure Of Apocalmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 1S26 "Structure Of Anthrax Edema Factor-calmodulin-alpha,beta- Methyleneadenosine 5'-triphosphate Complex Reveals An Alternative Mode" 100.00 148 100.00 100.00 4.69e-100 PDB 1SK6 "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin, 3',5' Cyclic Amp (Cam" 100.00 148 100.00 100.00 4.69e-100 PDB 1SY9 "Structure Of Calmodulin Complexed With A Fragment Of The Olfactory Cng Channel" 100.00 148 100.00 100.00 4.69e-100 PDB 1UP5 "Chicken Calmodulin" 100.00 148 99.32 99.32 3.95e-99 PDB 1WRZ "Calmodulin Complexed With A Peptide From A Human Death-Associated Protein Kinase" 100.00 149 100.00 100.00 4.90e-100 PDB 1X02 "Solution Structure Of Stereo Array Isotope Labeled (Sail) Calmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 1XA5 "Structure Of Calmodulin In Complex With Kar-2, A Bis-Indol Alkaloid" 100.00 148 100.00 100.00 4.69e-100 PDB 1XFU "Crystal Structure Of Anthrax Edema Factor (ef) Truncation Mutant, Ef-delta 64 In Complex With Calmodulin" 100.00 149 99.32 100.00 1.16e-99 PDB 1XFV "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" 100.00 149 99.32 100.00 1.16e-99 PDB 1XFW "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3'5' Cyclic Amp (Camp)" 100.00 149 99.32 100.00 1.16e-99 PDB 1XFY "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin" 100.00 149 99.32 100.00 1.16e-99 PDB 1XFZ "Crystal Structure Of Anthrax Edema Factor (ef) In Complex With Calmodulin In The Presence Of 1 Millimolar Exogenously Added Cal" 100.00 149 99.32 100.00 1.16e-99 PDB 1Y0V "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And Pyrophosphate" 97.30 146 100.00 100.00 3.63e-97 PDB 1YR5 "1.7-A Structure Of Calmodulin Bound To A Peptide From Dap Kinase" 100.00 148 100.00 100.00 4.69e-100 PDB 2BBM "Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr" 100.00 148 97.97 99.32 6.47e-98 PDB 2BBN "Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr" 100.00 148 97.97 99.32 6.47e-98 PDB 2BCX "Crystal Structure Of Calmodulin In Complex With A Ryanodine Receptor Peptide" 100.00 148 100.00 100.00 4.69e-100 PDB 2BKH "Myosin Vi Nucleotide-Free (Mdinsert2) Crystal Structure" 100.00 149 97.97 99.32 4.92e-98 PDB 2BKI "Myosin Vi Nucleotide-free (mdinsert2-iq) Crystal Structure" 100.00 149 100.00 100.00 4.90e-100 PDB 2DFS "3-D Structure Of Myosin-V Inhibited State" 100.00 148 100.00 100.00 4.69e-100 PDB 2F2O "Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode" 100.00 179 100.00 100.00 7.55e-100 PDB 2F2P "Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode" 100.00 179 100.00 100.00 7.55e-100 PDB 2F3Y "CalmodulinIQ DOMAIN COMPLEX" 100.00 148 100.00 100.00 4.69e-100 PDB 2F3Z "CalmodulinIQ-Aa Domain Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 2FOT "Crystal Structure Of The Complex Between Calmodulin And Alphaii-Spectrin" 100.00 148 100.00 100.00 4.69e-100 PDB 2HQW "Crystal Structure Of Ca2+CALMODULIN BOUND TO NMDA RECEPTOR NR1C1 Peptide" 100.00 148 100.00 100.00 4.69e-100 PDB 2JZI "Structure Of Calmodulin Complexed With The Calmodulin Binding Domain Of Calcineurin" 100.00 148 100.00 100.00 4.69e-100 PDB 2K0E "A Coupled Equilibrium Shift Mechanism In Calmodulin- Mediated Signal Transduction" 100.00 148 100.00 100.00 4.69e-100 PDB 2K0F "Calmodulin Complexed With Calmodulin-Binding Peptide From Smooth Muscle Myosin Light Chain Kinase" 100.00 148 100.00 100.00 4.69e-100 PDB 2K0J "Solution Structure Of Cam Complexed To Drp1p" 100.00 148 99.32 100.00 3.17e-99 PDB 2K61 "Solution Structure Of Cam Complexed To Dapk Peptide" 100.00 148 99.32 100.00 3.17e-99 PDB 2KDU "Structural Basis Of The Munc13-1CA2+-Calmodulin Interaction: A Novel 1-26 Calmodulin Binding Motif With A Bipartite Binding Mod" 100.00 148 100.00 100.00 4.69e-100 PDB 2KNE "Calmodulin Wraps Around Its Binding Domain In The Plasma Membrane Ca2+ Pump Anchored By A Novel 18-1 Motif" 100.00 148 100.00 100.00 4.69e-100 PDB 2L53 "Solution Nmr Structure Of Apo-Calmodulin In Complex With The Iq Motif Of Human Cardiac Sodium Channel Nav1.5" 100.00 148 100.00 100.00 4.69e-100 PDB 2L7L "Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of Calmodulin Kinase I" 100.00 148 100.00 100.00 4.69e-100 PDB 2LGF "Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of L-Selectin" 98.65 146 100.00 100.00 1.02e-98 PDB 2LL6 "Solution Nmr Structure Of Cam Bound To Inos Cam Binding Domain Peptide" 100.00 148 100.00 100.00 4.69e-100 PDB 2LL7 "Solution Nmr Structure Of Cam Bound To The Enos Cam Binding Domain Peptide" 100.00 148 100.00 100.00 4.69e-100 PDB 2LV6 "The Complex Between Ca-calmodulin And Skeletal Muscle Myosin Light Chain Kinase From Combination Of Nmr And Aqueous And Contras" 100.00 148 98.65 99.32 2.53e-98 PDB 2M0J "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Olfactory Cyclic Nucleotide-gated Ion Channel Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 2M0K "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Rat Olfactory Cyclic Nucleotide-gated Ion Channel" 100.00 148 100.00 100.00 4.69e-100 PDB 2M55 "Nmr Structure Of The Complex Of An N-terminally Acetylated Alpha- Synuclein Peptide With Calmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 2MG5 "Solution Structure Of Calmodulin Bound To The Target Peptide Of Endothelial Nitrogen Oxide Synthase Phosphorylated At Thr495" 100.00 148 100.00 100.00 4.69e-100 PDB 2MGU "Structure Of The Complex Between Calmodulin And The Binding Domain Of Hiv-1 Matrix Protein" 100.00 148 100.00 100.00 4.69e-100 PDB 2O5G "Calmodulin-Smooth Muscle Light Chain Kinase Peptide Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 2O60 "Calmodulin Bound To Peptide From Neuronal Nitric Oxide Synthase" 100.00 148 100.00 100.00 4.69e-100 PDB 2R28 "The Complex Structure Of Calmodulin Bound To A Calcineurin Peptide" 100.00 149 100.00 100.00 4.90e-100 PDB 2V01 "Recombinant Vertebrate Calmodulin Complexed With Pb" 100.00 149 100.00 100.00 4.90e-100 PDB 2V02 "Recombinant Vertebrate Calmodulin Complexed With Ba" 100.00 149 100.00 100.00 4.90e-100 PDB 2VAS "Myosin Vi (Md-Insert2-Cam, Delta-Insert1) Post-Rigor State" 100.00 149 97.97 99.32 4.92e-98 PDB 2VAY "Calmodulin Complexed With Cav1.1 Iq Peptide" 98.65 146 100.00 100.00 1.02e-98 PDB 2VB6 "Myosin Vi (Md-Insert2-Cam, Delta Insert1) Post-Rigor State ( Crystal Form 2)" 100.00 149 97.30 99.32 1.19e-97 PDB 2W73 "High-Resolution Structure Of The Complex Between Calmodulin And A Peptide From Calcineurin A" 100.00 149 100.00 100.00 4.90e-100 PDB 2WEL "Crystal Structure Of Su6656-Bound CalciumCALMODULIN- Dependent Protein Kinase Ii Delta In Complex With Calmodulin" 100.00 150 100.00 100.00 4.54e-100 PDB 2X0G "X-ray Structure Of A Dap-kinase Calmodulin Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 2X51 "M6 Delta Insert1" 100.00 149 97.97 99.32 4.92e-98 PDB 2Y4V "Crystal Structure Of Human Calmodulin In Complex With A Dap Kinase-1 Mutant (W305y) Peptide" 100.00 149 100.00 100.00 4.90e-100 PDB 2YGG "Complex Of Cambr And Cam" 100.00 150 100.00 100.00 5.35e-100 PDB 3BXK "Crystal Structure Of The PQ-Type Calcium Channel (Cav2.1) Iq Domain And Ca2+calmodulin Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 3BXL "Crystal Structure Of The R-Type Calcium Channel (Cav2.3) Iq Domain And Ca2+calmodulin Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 3BYA "Structure Of A Calmodulin Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 3CLN "Structure Of Calmodulin Refined At 2.2 Angstroms Resolution" 100.00 148 99.32 100.00 1.92e-99 PDB 3DVE "Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 3DVJ "Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain (Without Cloning Artifact, Hm To Tv) Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 3DVK "Crystal Structure Of Ca2+CAM-Cav2.3 Iq Domain Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 3DVM "Crystal Structure Of Ca2+CAM-Cav2.1 Iq Domain Complex" 100.00 148 100.00 100.00 4.69e-100 PDB 3EK4 "Calcium-saturated Gcamp2 Monomer" 99.32 449 100.00 100.00 8.97e-96 PDB 3EK7 "Calcium-Saturated Gcamp2 Dimer" 99.32 449 100.00 100.00 8.97e-96 PDB 3EK8 "Calcium-Saturated Gcamp2 T116vG87R MUTANT MONOMER" 99.32 449 100.00 100.00 1.27e-95 PDB 3EKH "Calcium-Saturated Gcamp2 T116vK378W MUTANT MONOMER" 99.32 449 99.32 99.32 8.68e-95 PDB 3EVU "Crystal Structure Of Calcium Bound Dimeric Gcamp2, (#1)" 99.32 449 100.00 100.00 8.97e-96 PDB 3EVV "Crystal Structure Of Calcium Bound Dimeric Gcamp2 (#2)" 99.32 449 100.00 100.00 8.97e-96 PDB 3EWT "Crystal Structure Of Calmodulin Complexed With A Peptide" 100.00 154 100.00 100.00 1.97e-100 PDB 3EWV "Crystal Structure Of Calmodulin Complexed With A Peptide" 100.00 154 100.00 100.00 1.97e-100 PDB 3G43 "Crystal Structure Of The Calmodulin-Bound Cav1.2 C-Terminal Regulatory Domain Dimer" 100.00 148 100.00 100.00 4.69e-100 PDB 3GN4 "Myosin Lever Arm" 100.00 149 97.97 99.32 4.92e-98 PDB 3GOF "Calmodulin Bound To Peptide From Macrophage Nitric Oxide Synthase" 100.00 148 100.00 100.00 4.69e-100 PDB 3HR4 "Human Inos Reductase And Calmodulin Complex" 100.00 149 100.00 100.00 4.90e-100 PDB 3IF7 "Structure Of Calmodulin Complexed With Its First Endogenous Inhibitor, Sphingosylphosphorylcholine" 100.00 148 100.00 100.00 4.69e-100 PDB 3J41 "Pseudo-atomic Model Of The Aquaporin-0/calmodulin Complex Derived From Electron Microscopy" 100.00 149 100.00 100.00 4.90e-100 PDB 3L9I "Myosin Vi Nucleotide-Free (Mdinsert2) L310g Mutant Crystal Structure" 100.00 149 97.97 99.32 4.92e-98 PDB 3O77 "The Structure Of Ca2+ Sensor (Case-16)" 99.32 415 100.00 100.00 4.03e-96 PDB 3O78 "The Structure Of Ca2+ Sensor (Case-12)" 99.32 415 100.00 100.00 4.44e-96 PDB 3OXQ "Crystal Structure Of Ca2+CAM-Cav1.2 Pre-IqIQ DOMAIN COMPLEX" 100.00 149 100.00 100.00 4.90e-100 PDB 3SG2 "Crystal Structure Of Gcamp2-t116v,d381y" 99.32 449 99.32 99.32 1.28e-94 PDB 3SG3 "Crystal Structure Of Gcamp3-d380y" 99.32 449 98.64 99.32 1.62e-93 PDB 3SG4 "Crystal Structure Of Gcamp3-d380y, Lp(linker 2)" 100.00 448 97.97 98.65 1.12e-93 PDB 3SG5 "Crystal Structure Of Dimeric Gcamp3-d380y, Qp(linker 1), Lp(linker 2)" 100.00 448 97.97 98.65 9.19e-94 PDB 3SG6 "Crystal Structure Of Dimeric Gcamp2-lia(linker 1)" 99.32 450 100.00 100.00 1.15e-95 PDB 3SG7 "Crystal Structure Of Gcamp3-kf(linker 1)" 99.32 448 99.32 100.00 7.66e-95 PDB 3SJQ "Crystal Structure Of A Small Conductance Potassium Channel Splice Variant Complexed With Calcium-Calmodulin" 100.00 149 100.00 100.00 4.90e-100 PDB 3SUI "Crystal Structure Of Ca2+-Calmodulin In Complex With A Trpv1 C- Terminal Peptide" 100.00 149 100.00 100.00 4.90e-100 PDB 3U0K "Crystal Structure Of The Genetically Encoded Calcium Indicator Rcamp" 99.32 440 98.64 99.32 2.74e-94 PDB 3WFN "Crystal Structure Of Nav1.6 Iq Motif In Complex With Apo-cam" 100.00 182 100.00 100.00 5.64e-100 PDB 4ANJ "Myosin Vi (Mdinsert2-Gfp Fusion) Pre-Powerstroke State (Mg.Adp.Alf4)" 100.00 149 97.97 99.32 4.92e-98 PDB 4BW7 "Calmodulin In Complex With Strontium" 100.00 149 100.00 100.00 4.90e-100 PDB 4BW8 "Calmodulin With Small Bend In Central Helix" 100.00 149 100.00 100.00 4.90e-100 PDB 4BYF "Crystal Structure Of Human Myosin 1c In Complex With Calmodulin In The Pre-power Stroke State" 100.00 149 100.00 100.00 4.90e-100 PDB 4CLN "Structure Of A Recombinant Calmodulin From Drosophila Melanogaster Refined At 2.2-Angstroms Resolution" 100.00 148 97.97 99.32 6.47e-98 PDB 4DBP "Myosin Vi Nucleotide-free (mdinsert2) D179y Crystal Structure" 100.00 149 97.97 99.32 4.92e-98 PDB 4DBQ "Myosin Vi D179y (md-insert2-cam, Delta-insert1) Post-rigor State" 100.00 149 97.97 99.32 4.92e-98 PDB 4DCK "Crystal Structure Of The C-Terminus Of Voltage-Gated Sodium Channel In Complex With Fgf13 And Cam" 100.00 149 100.00 100.00 4.90e-100 PDB 4DJC "1.35 A Crystal Structure Of The Nav1.5 Diii-Iv-CaCAM COMPLEX" 100.00 152 100.00 100.00 3.43e-100 PDB 4E50 "Calmodulin And Ng Peptide Complex" 100.00 185 100.00 100.00 2.55e-100 PDB 4EHQ "Crystal Structure Of Calmodulin Binding Domain Of Orai1 In Complex With Ca2+CALMODULIN DISPLAYS A UNIQUE BINDING MODE" 100.00 148 100.00 100.00 4.69e-100 PDB 4G27 "Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And P" 100.00 149 100.00 100.00 4.90e-100 PDB 4G28 "Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And E" 100.00 149 100.00 100.00 4.90e-100 PDB 4HEX "A Novel Conformation Of Calmodulin" 100.00 156 100.00 100.00 2.10e-100 PDB 4IK1 "High Resolution Structure Of Gcampj At Ph 8.5" 99.32 448 98.64 99.32 1.40e-93 PDB 4IK3 "High Resolution Structure Of Gcamp3 At Ph 8.5" 99.32 448 99.32 100.00 9.10e-95 PDB 4IK4 "High Resolution Structure Of Gcamp3 At Ph 5.0" 99.32 448 99.32 100.00 9.10e-95 PDB 4IK5 "High Resolution Structure Of Delta-rest-gcamp3" 99.32 414 99.32 100.00 3.56e-95 PDB 4IK8 "High Resolution Structure Of Gcamp3 Dimer Form 1 At Ph 7.5" 99.32 448 99.32 100.00 9.10e-95 PDB 4IK9 "High Resolution Structure Of Gcamp3 Dimer Form 2 At Ph 7.5" 99.32 448 99.32 100.00 9.10e-95 PDB 4J9Y "Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant" 100.00 149 100.00 100.00 4.90e-100 PDB 4J9Z "Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And N" 100.00 149 100.00 100.00 4.90e-100 PDB 4JPZ "Voltage-gated Sodium Channel 1.2 C-terminal Domain In Complex With Fgf13u And Ca2+/calmodulin" 100.00 149 100.00 100.00 4.90e-100 PDB 4JQ0 "Voltage-gated Sodium Channel 1.5 C-terminal Domain In Complex With Fgf12b And Ca2+/calmodulin" 100.00 149 100.00 100.00 4.90e-100 PDB 4L79 "Crystal Structure Of Nucleotide-free Myosin 1b Residues 1-728 With Bound Calmodulin" 100.00 149 100.00 100.00 4.90e-100 PDB 4LZX "Complex Of Iqcg And Ca2+-free Cam" 100.00 148 100.00 100.00 4.69e-100 PDB 4M1L "Complex Of Iqcg And Ca2+-bound Cam" 100.00 148 100.00 100.00 4.69e-100 PDB 4PJJ "Myosin Vi (md-insert2-cam, Delta-insert1) Post-rigor State - Long Soaking With Po4" 100.00 149 97.30 99.32 1.19e-97 PDB 4Q5U "Structure Of Calmodulin Bound To Its Recognition Site From Calcineurin" 100.00 149 100.00 100.00 4.90e-100 PDB 4QNH "Calcium-calmodulin (t79d) Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Sk2-a" 100.00 149 99.32 99.32 5.98e-99 PDB 4R8G "Crystal Structure Of Myosin-1c Tail In Complex With Calmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 4UMO "Crystal Structure Of The Kv7.1 Proximal C-terminal Domain In Complex With Calmodulin" 100.00 149 100.00 100.00 4.90e-100 PDB 4UPU "Crystal Structure Of Ip3 3-k Calmodulin Binding Region In Complex With Calmodulin" 100.00 148 100.00 100.00 4.69e-100 PDB 4V0C "Crystal Structure Of The Kv7.1 Proximal C-terminal Domain In Complex With Calmodulin" 100.00 149 100.00 100.00 4.90e-100 DBJ BAA08302 "calmodulin [Homo sapiens]" 100.00 149 100.00 100.00 4.90e-100 DBJ BAA11896 "calmodulin [Anas platyrhynchos]" 100.00 149 100.00 100.00 4.90e-100 DBJ BAA19786 "calmodulin [Branchiostoma lanceolatum]" 100.00 149 97.97 99.32 4.92e-98 DBJ BAA19787 "calmodulin [Branchiostoma floridae]" 100.00 149 97.97 99.32 4.92e-98 DBJ BAA19788 "calmodulin [Halocynthia roretzi]" 100.00 149 97.97 99.32 4.92e-98 EMBL CAA10601 "calmodulin [Caenorhabditis elegans]" 100.00 149 97.97 98.65 1.22e-97 EMBL CAA32050 "calmodulin [Rattus norvegicus]" 100.00 149 100.00 100.00 4.90e-100 EMBL CAA32062 "calmodulin II [Rattus norvegicus]" 100.00 149 100.00 100.00 4.90e-100 EMBL CAA32119 "calmodulin [Rattus norvegicus]" 100.00 149 100.00 100.00 4.90e-100 EMBL CAA32120 "calmodulin [Rattus norvegicus]" 100.00 149 100.00 100.00 4.90e-100 GB AAA35635 "calmodulin [Homo sapiens]" 100.00 149 100.00 100.00 4.90e-100 GB AAA35641 "calmodulin [Homo sapiens]" 100.00 149 100.00 100.00 4.90e-100 GB AAA37365 "calmodulin synthesis [Mus musculus]" 100.00 149 100.00 100.00 4.90e-100 GB AAA40862 "calmodulin [Rattus norvegicus]" 100.00 149 100.00 100.00 4.90e-100 GB AAA40863 "calmodulin [Rattus norvegicus]" 100.00 149 100.00 100.00 4.90e-100 PIR JC1305 "calmodulin - Japanese medaka" 100.00 149 100.00 100.00 4.90e-100 PIR MCON "calmodulin - salmon" 100.00 148 100.00 100.00 4.69e-100 PRF 0409298A "troponin C-like protein" 100.00 148 97.30 100.00 2.42e-98 PRF 0608335A calmodulin 100.00 148 97.97 99.32 3.33e-97 REF NP_001008160 "calmodulin [Xenopus (Silurana) tropicalis]" 100.00 149 100.00 100.00 4.90e-100 REF NP_001009759 "calmodulin [Ovis aries]" 100.00 149 100.00 100.00 4.90e-100 REF NP_001027633 "calmodulin [Ciona intestinalis]" 100.00 149 97.30 98.65 3.19e-97 REF NP_001039714 "calmodulin [Bos taurus]" 100.00 149 100.00 100.00 4.90e-100 REF NP_001040234 "calmodulin [Bombyx mori]" 100.00 149 97.97 99.32 4.92e-98 SP O02367 "RecName: Full=Calmodulin; Short=CaM; AltName: Full=Ci-CaM" 100.00 149 97.30 98.65 3.19e-97 SP O16305 "RecName: Full=Calmodulin; Short=CaM" 100.00 149 97.97 98.65 1.22e-97 SP O96081 "RecName: Full=Calmodulin-B; Short=CaM B" 100.00 149 97.30 98.65 3.60e-97 SP P02594 "RecName: Full=Calmodulin; Short=CaM" 100.00 149 99.32 100.00 1.58e-99 SP P05932 "RecName: Full=Calmodulin-beta; Short=Cam B" 93.24 138 97.10 99.28 5.02e-90 TPG DAA13808 "TPA: calmodulin 2-like [Bos taurus]" 100.00 216 98.65 98.65 2.38e-98 TPG DAA18029 "TPA: calmodulin [Bos taurus]" 100.00 149 98.65 99.32 7.20e-99 TPG DAA19590 "TPA: calmodulin 3 [Bos taurus]" 100.00 149 100.00 100.00 4.90e-100 TPG DAA24777 "TPA: calmodulin 2-like [Bos taurus]" 100.00 149 100.00 100.00 4.90e-100 TPG DAA24988 "TPA: calmodulin 2-like isoform 1 [Bos taurus]" 100.00 149 100.00 100.00 4.90e-100 stop_ save_ save_OLFp _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common OLFp _Molecular_mass . _Mol_thiol_state 'not present' _Details . _Residue_count 28 _Mol_residue_sequence ; TPRRGRGGFQRIVRLVGVIR DWANKNFR ; loop_ _Residue_seq_code _Residue_label 1 THR 2 PRO 3 ARG 4 ARG 5 GLY 6 ARG 7 GLY 8 GLY 9 PHE 10 GLN 11 ARG 12 ILE 13 VAL 14 ARG 15 LEU 16 VAL 17 GLY 18 VAL 19 ILE 20 ARG 21 ASP 22 TRP 23 ALA 24 ASN 25 LYS 26 ASN 27 PHE 28 ARG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-30 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 2M0J "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Olfactory Cyclic Nucleotide-gated Ion Channel Complex" 100.00 28 100.00 100.00 1.72e-09 PDB 2M0K "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Rat Olfactory Cyclic Nucleotide-gated Ion Channel" 100.00 28 100.00 100.00 1.72e-09 EMBL CAA39135 "olfactory channel [Rattus norvegicus]" 100.00 664 100.00 100.00 7.26e-11 EMBL CAQ34767 "cyclic nucleotide gated channel alpha 2 [Sus scrofa]" 57.14 16 100.00 100.00 1.20e+00 GB AAD41473 "olfactory cyclic nucleotide-gated ion channel alpha subunit [Rattus norvegicus]" 100.00 664 100.00 100.00 7.26e-11 PRF 1614345A "olfactory ion channel protein" 100.00 664 100.00 100.00 7.26e-11 REF NP_037060 "cyclic nucleotide-gated olfactory channel [Rattus norvegicus]" 100.00 664 100.00 100.00 7.26e-11 REF XP_008756353 "PREDICTED: cyclic nucleotide-gated olfactory channel isoform X1 [Rattus norvegicus]" 100.00 664 100.00 100.00 6.92e-11 SP Q00195 "RecName: Full=Cyclic nucleotide-gated olfactory channel; AltName: Full=Cyclic nucleotide-gated cation channel 2; AltName: Full=" 100.00 664 100.00 100.00 7.26e-11 stop_ save_ ############# # Ligands # ############# save_CA _Saveframe_category ligand _Mol_type non-polymer _Name_common "CA (CALCIUM ION)" _BMRB_code . _PDB_code CA _Molecular_mass 40.078 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Jul 8 10:39:58 2011 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons CA CA CA . 2 . ? 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 $Calmodulin Rat 10116 Eukaryota Metazoa Rattus norvegicus $OLFp Rat 10116 Eukaryota Metazoa Rattus norvegicus stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $Calmodulin 'recombinant technology' . Escherichia coli . pET29c $OLFp 'recombinant technology' . Escherichia coli . pET29c stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_CaM-OLFp _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Calmodulin 1 mM '[U-99% 13C; U-99% 15N]' $OLFp 1 mM '[U-99% 13C; U-99% 15N]' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_AURELIA _Saveframe_category software _Name AURELIA _Version . loop_ _Vendor _Address _Electronic_address 'Neidig, Geyer, Gorler, Antz, Saffrich, Beneicke, Kalbitzer' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $CaM-OLFp save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $CaM-OLFp save_ save_2D_1H-1H_TOCSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $CaM-OLFp save_ save_2D_DQF-COSY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D DQF-COSY' _Sample_label $CaM-OLFp save_ save_2D_1H-1H_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $CaM-OLFp save_ save_3D_HNCA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $CaM-OLFp save_ save_3D_HN(CO)CA_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $CaM-OLFp save_ save_3D_HNCO_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $CaM-OLFp save_ save_3D_HN(CA)CO_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $CaM-OLFp save_ save_3D_HNCACB_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $CaM-OLFp save_ save_3D_C(CO)NH_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $CaM-OLFp save_ save_3D_HBHA(CO)NH_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $CaM-OLFp save_ save_3D_H(CCO)NH_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $CaM-OLFp save_ save_3D_HCCH-TOCSY_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $CaM-OLFp save_ save_3D_HCCH-COSY_15 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $CaM-OLFp save_ save_3D_1H-15N-edited_TOCSY_HSQC_16 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N-edited TOCSY HSQC' _Sample_label $CaM-OLFp save_ save_3D_simultaneous_1H-13C/15N-edited_NOESY-HSQC_17 _Saveframe_category NMR_applied_experiment _Experiment_name '3D simultaneous 1H-13C/15N-edited NOESY-HSQC' _Sample_label $CaM-OLFp save_ ####################### # Sample conditions # ####################### save_sample_conditions _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.7 0.05 pH temperature 310 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 _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D simultaneous 1H-13C/15N-edited NOESY-HSQC' stop_ loop_ _Sample_label $CaM-OLFp stop_ _Sample_conditions_label $sample_conditions _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Chain 1' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 2 ASP HA H 4.635 0.005 1 2 2 2 ASP HB2 H 2.675 0.005 2 3 2 2 ASP HB3 H 2.529 0.005 2 4 2 2 ASP C C 175.584 0.01 1 5 2 2 ASP CA C 54.646 0.01 1 6 2 2 ASP CB C 41.319 0.01 1 7 3 3 GLN H H 8.340 0.005 1 8 3 3 GLN HA H 4.372 0.005 1 9 3 3 GLN HB2 H 2.093 0.005 2 10 3 3 GLN HB3 H 1.974 0.005 2 11 3 3 GLN HG2 H 2.353 0.005 2 12 3 3 GLN HG3 H 2.353 0.005 2 13 3 3 GLN C C 175.570 0.01 1 14 3 3 GLN CA C 55.609 0.01 1 15 3 3 GLN CB C 29.573 0.01 1 16 3 3 GLN CG C 33.604 0.01 1 17 3 3 GLN N N 120.207 0.01 1 18 4 4 LEU H H 8.236 0.005 1 19 4 4 LEU HA H 4.667 0.005 1 20 4 4 LEU HB2 H 1.713 0.005 2 21 4 4 LEU HB3 H 1.483 0.005 2 22 4 4 LEU HG H 0.930 0.005 1 23 4 4 LEU HD1 H 0.908 0.005 2 24 4 4 LEU HD2 H 0.930 0.005 2 25 4 4 LEU C C 177.610 0.01 1 26 4 4 LEU CA C 54.395 0.01 1 27 4 4 LEU CB C 43.488 0.01 1 28 4 4 LEU CG C 26.485 0.01 1 29 4 4 LEU CD1 C 23.686 0.01 1 30 4 4 LEU N N 123.420 0.01 1 31 5 5 THR H H 8.597 0.005 1 32 5 5 THR HA H 4.484 0.005 1 33 5 5 THR HB H 4.755 0.005 1 34 5 5 THR HG2 H 1.333 0.005 1 35 5 5 THR C C 175.445 0.01 1 36 5 5 THR CA C 60.470 0.01 1 37 5 5 THR CB C 71.172 0.01 1 38 5 5 THR CG2 C 21.710 0.01 1 39 5 5 THR N N 113.063 0.01 1 40 6 6 GLU H H 9.000 0.005 1 41 6 6 GLU HA H 3.983 0.005 1 42 6 6 GLU HB2 H 2.054 0.005 2 43 6 6 GLU HB3 H 2.054 0.005 2 44 6 6 GLU HG2 H 2.378 0.005 2 45 6 6 GLU HG3 H 2.378 0.005 2 46 6 6 GLU C C 179.457 0.01 1 47 6 6 GLU CA C 60.179 0.01 1 48 6 6 GLU CB C 29.021 0.01 1 49 6 6 GLU CG C 34.698 0.01 1 50 6 6 GLU N N 120.549 0.01 1 51 7 7 GLU H H 8.668 0.005 1 52 7 7 GLU HA H 4.063 0.005 1 53 7 7 GLU HB2 H 2.029 0.005 2 54 7 7 GLU HB3 H 1.915 0.005 2 55 7 7 GLU HG2 H 2.307 0.005 2 56 7 7 GLU HG3 H 2.307 0.005 2 57 7 7 GLU C C 179.173 0.01 1 58 7 7 GLU CA C 59.965 0.01 1 59 7 7 GLU CB C 28.975 0.01 1 60 7 7 GLU CG C 36.399 0.01 1 61 7 7 GLU N N 119.504 0.01 1 62 8 8 GLN H H 7.656 0.005 1 63 8 8 GLN HA H 3.776 0.005 1 64 8 8 GLN HB2 H 2.291 0.005 2 65 8 8 GLN HB3 H 1.553 0.005 2 66 8 8 GLN HG2 H 2.236 0.005 2 67 8 8 GLN HG3 H 2.236 0.005 2 68 8 8 GLN C C 177.820 0.01 1 69 8 8 GLN CA C 58.711 0.01 1 70 8 8 GLN CB C 28.893 0.01 1 71 8 8 GLN CG C 34.971 0.01 1 72 8 8 GLN N N 120.344 0.01 1 73 9 9 ILE H H 8.236 0.005 1 74 9 9 ILE HA H 3.606 0.005 1 75 9 9 ILE HB H 1.925 0.005 1 76 9 9 ILE HG12 H 1.761 0.005 2 77 9 9 ILE HG13 H 1.090 0.005 2 78 9 9 ILE HG2 H 1.096 0.005 1 79 9 9 ILE HD1 H 0.853 0.005 1 80 9 9 ILE C C 177.862 0.01 1 81 9 9 ILE CA C 66.125 0.01 1 82 9 9 ILE CB C 37.525 0.01 1 83 9 9 ILE CG1 C 29.913 0.01 1 84 9 9 ILE CG2 C 17.199 0.01 1 85 9 9 ILE CD1 C 12.828 0.01 1 86 9 9 ILE N N 118.976 0.01 1 87 10 10 ALA H H 7.986 0.005 1 88 10 10 ALA HA H 4.121 0.005 1 89 10 10 ALA HB H 1.529 0.005 1 90 10 10 ALA C C 180.976 0.01 1 91 10 10 ALA CA C 55.451 0.01 1 92 10 10 ALA CB C 17.577 0.01 1 93 10 10 ALA N N 121.164 0.01 1 94 11 11 GLU H H 7.785 0.005 1 95 11 11 GLU HA H 4.090 0.005 1 96 11 11 GLU HB2 H 1.962 0.005 2 97 11 11 GLU HB3 H 2.075 0.005 2 98 11 11 GLU HG2 H 2.323 0.005 2 99 11 11 GLU HG3 H 2.323 0.005 2 100 11 11 GLU C C 180.253 0.01 1 101 11 11 GLU CA C 59.470 0.01 1 102 11 11 GLU CB C 29.088 0.01 1 103 11 11 GLU CG C 36.254 0.01 1 104 11 11 GLU N N 119.797 0.01 1 105 12 12 PHE H H 8.627 0.005 1 106 12 12 PHE HA H 5.025 0.005 1 107 12 12 PHE HB2 H 3.579 0.005 2 108 12 12 PHE HB3 H 3.449 0.005 2 109 12 12 PHE HD1 H 6.761 0.005 1 110 12 12 PHE HD2 H 6.761 0.005 1 111 12 12 PHE HE1 H 7.200 0.005 1 112 12 12 PHE HE2 H 7.200 0.005 1 113 12 12 PHE HZ H 7.310 0.005 1 114 12 12 PHE C C 178.889 0.01 1 115 12 12 PHE CA C 58.530 0.01 1 116 12 12 PHE CB C 37.084 0.01 1 117 12 12 PHE N N 120.651 0.01 1 118 13 13 LYS H H 9.213 0.005 1 119 13 13 LYS HA H 4.058 0.005 1 120 13 13 LYS HB2 H 1.927 0.005 2 121 13 13 LYS HB3 H 1.927 0.005 2 122 13 13 LYS HG2 H 1.035 0.005 2 123 13 13 LYS HG3 H 1.250 0.005 2 124 13 13 LYS HD2 H 1.381 0.005 2 125 13 13 LYS HD3 H 1.234 0.005 2 126 13 13 LYS HE2 H 2.594 0.005 2 127 13 13 LYS HE3 H 2.594 0.005 2 128 13 13 LYS C C 179.309 0.01 1 129 13 13 LYS CA C 60.186 0.01 1 130 13 13 LYS CB C 31.767 0.01 1 131 13 13 LYS CG C 25.675 0.01 1 132 13 13 LYS CD C 28.819 0.01 1 133 13 13 LYS CE C 43.311 0.01 1 134 13 13 LYS N N 123.625 0.01 1 135 14 14 GLU H H 7.949 0.005 1 136 14 14 GLU HA H 4.163 0.005 1 137 14 14 GLU HB2 H 2.214 0.005 2 138 14 14 GLU HB3 H 2.215 0.005 2 139 14 14 GLU HG2 H 2.309 0.005 2 140 14 14 GLU HG3 H 2.309 0.005 2 141 14 14 GLU C C 179.813 0.01 1 142 14 14 GLU CA C 59.499 0.01 1 143 14 14 GLU CB C 29.095 0.01 1 144 14 14 GLU CG C 36.202 0.01 1 145 14 14 GLU N N 120.514 0.01 1 146 15 15 ALA H H 7.992 0.005 1 147 15 15 ALA HA H 4.280 0.005 1 148 15 15 ALA HB H 2.070 0.005 1 149 15 15 ALA C C 178.532 0.01 1 150 15 15 ALA CA C 55.335 0.01 1 151 15 15 ALA CB C 18.252 0.01 1 152 15 15 ALA N N 121.882 0.01 1 153 16 16 PHE H H 8.719 0.005 1 154 16 16 PHE HA H 3.324 0.005 1 155 16 16 PHE HB2 H 3.253 0.005 2 156 16 16 PHE HB3 H 3.049 0.005 2 157 16 16 PHE HD1 H 6.800 0.005 1 158 16 16 PHE HD2 H 6.800 0.005 1 159 16 16 PHE HE1 H 7.123 0.005 1 160 16 16 PHE HE2 H 7.123 0.005 1 161 16 16 PHE HZ H 7.056 0.005 1 162 16 16 PHE C C 177.922 0.01 1 163 16 16 PHE CA C 62.210 0.01 1 164 16 16 PHE CB C 39.637 0.01 1 165 16 16 PHE N N 118.634 0.01 1 166 17 17 SER H H 8.133 0.005 1 167 17 17 SER HA H 4.141 0.005 1 168 17 17 SER HB2 H 4.063 0.005 2 169 17 17 SER HB3 H 4.063 0.005 2 170 17 17 SER C C 174.602 0.01 1 171 17 17 SER CA C 61.589 0.01 1 172 17 17 SER CB C 63.352 0.01 1 173 17 17 SER N N 113.302 0.01 1 174 18 18 LEU H H 7.406 0.005 1 175 18 18 LEU HA H 4.026 0.005 1 176 18 18 LEU HB2 H 1.824 0.005 2 177 18 18 LEU HB3 H 1.505 0.005 2 178 18 18 LEU HG H 1.647 0.005 1 179 18 18 LEU HD1 H 0.837 0.005 2 180 18 18 LEU HD2 H 0.672 0.005 2 181 18 18 LEU C C 177.523 0.01 1 182 18 18 LEU CA C 57.364 0.01 1 183 18 18 LEU CB C 41.267 0.01 1 184 18 18 LEU CG C 26.495 0.01 1 185 18 18 LEU CD1 C 25.402 0.01 1 186 18 18 LEU CD2 C 23.761 0.01 1 187 18 18 LEU N N 120.617 0.01 1 188 19 19 PHE H H 7.143 0.005 1 189 19 19 PHE HA H 4.209 0.005 1 190 19 19 PHE HB2 H 2.722 0.005 2 191 19 19 PHE HB3 H 2.679 0.005 2 192 19 19 PHE HD1 H 7.321 0.005 1 193 19 19 PHE HD2 H 7.321 0.005 1 194 19 19 PHE HE1 H 7.371 0.005 1 195 19 19 PHE HE2 H 7.371 0.005 1 196 19 19 PHE HZ H 7.371 0.005 1 197 19 19 PHE C C 176.803 0.01 1 198 19 19 PHE CA C 59.221 0.01 1 199 19 19 PHE CB C 41.600 0.01 1 200 19 19 PHE N N 113.234 0.01 1 201 20 20 ASP H H 7.778 0.005 1 202 20 20 ASP HA H 4.600 0.005 1 203 20 20 ASP HB2 H 2.333 0.005 2 204 20 20 ASP HB3 H 1.497 0.005 2 205 20 20 ASP C C 177.189 0.01 1 206 20 20 ASP CA C 52.457 0.01 1 207 20 20 ASP CB C 39.017 0.01 1 208 20 20 ASP N N 116.618 0.01 1 209 21 21 LYS H H 7.791 0.005 1 210 21 21 LYS HA H 4.019 0.005 1 211 21 21 LYS HB2 H 1.911 0.005 2 212 21 21 LYS HB3 H 1.911 0.005 2 213 21 21 LYS HG2 H 1.506 0.005 2 214 21 21 LYS HG3 H 1.506 0.005 2 215 21 21 LYS HD2 H 1.688 0.005 2 216 21 21 LYS HD3 H 1.688 0.005 2 217 21 21 LYS HE2 H 3.041 0.005 2 218 21 21 LYS HE3 H 3.041 0.005 2 219 21 21 LYS C C 178.310 0.01 1 220 21 21 LYS CA C 58.116 0.01 1 221 21 21 LYS CB C 32.507 0.01 1 222 21 21 LYS CG C 24.066 0.01 1 223 21 21 LYS CD C 27.925 0.01 1 224 21 21 LYS CE C 42.183 0.01 1 225 21 21 LYS N N 124.138 0.01 1 226 22 22 ASP H H 8.078 0.005 1 227 22 22 ASP HA H 4.624 0.005 1 228 22 22 ASP HB2 H 3.084 0.005 2 229 22 22 ASP HB3 H 2.642 0.005 2 230 22 22 ASP C C 177.740 0.01 1 231 22 22 ASP CA C 52.822 0.01 1 232 22 22 ASP CB C 39.498 0.01 1 233 22 22 ASP N N 114.157 0.01 1 234 23 23 GLY H H 7.681 0.005 1 235 23 23 GLY HA2 H 3.892 0.005 2 236 23 23 GLY HA3 H 3.892 0.005 2 237 23 23 GLY C C 175.183 0.01 1 238 23 23 GLY CA C 47.187 0.01 1 239 23 23 GLY N N 109.303 0.01 1 240 24 24 ASP H H 8.474 0.005 1 241 24 24 ASP HA H 4.545 0.005 1 242 24 24 ASP HB2 H 3.077 0.005 2 243 24 24 ASP HB3 H 2.471 0.005 2 244 24 24 ASP C C 177.428 0.01 1 245 24 24 ASP CA C 53.685 0.01 1 246 24 24 ASP CB C 40.338 0.01 1 247 24 24 ASP N N 120.959 0.01 1 248 25 25 GLY H H 10.563 0.005 1 249 25 25 GLY HA2 H 4.391 0.005 2 250 25 25 GLY HA3 H 3.738 0.005 2 251 25 25 GLY C C 173.894 0.01 1 252 25 25 GLY CA C 45.377 0.01 1 253 25 25 GLY N N 112.858 0.01 1 254 26 26 THR H H 8.230 0.005 1 255 26 26 THR HA H 5.456 0.005 1 256 26 26 THR HB H 3.873 0.005 1 257 26 26 THR HG2 H 1.068 0.005 1 258 26 26 THR C C 173.168 0.01 1 259 26 26 THR CA C 59.644 0.01 1 260 26 26 THR CB C 72.817 0.01 1 261 26 26 THR CG2 C 22.121 0.01 1 262 26 26 THR N N 112.072 0.01 1 263 27 27 ILE H H 9.940 0.005 1 264 27 27 ILE HA H 4.849 0.005 1 265 27 27 ILE HB H 1.810 0.005 1 266 27 27 ILE HG12 H 1.330 0.005 2 267 27 27 ILE HG13 H 0.210 0.005 2 268 27 27 ILE HG2 H 0.972 0.005 1 269 27 27 ILE HD1 H 0.315 0.005 1 270 27 27 ILE C C 176.205 0.01 1 271 27 27 ILE CA C 61.200 0.01 1 272 27 27 ILE CB C 39.920 0.01 1 273 27 27 ILE CG1 C 26.632 0.01 1 274 27 27 ILE CG2 C 17.199 0.01 1 275 27 27 ILE CD1 C 15.285 0.01 1 276 27 27 ILE N N 126.462 0.01 1 277 28 28 THR H H 8.371 0.005 1 278 28 28 THR HA H 4.933 0.005 1 279 28 28 THR HB H 4.821 0.005 1 280 28 28 THR HG2 H 1.304 0.005 1 281 28 28 THR C C 176.711 0.01 1 282 28 28 THR CA C 59.352 0.01 1 283 28 28 THR CB C 72.635 0.01 1 284 28 28 THR CG2 C 21.847 0.01 1 285 28 28 THR N N 116.276 0.01 1 286 29 29 THR H H 9.140 0.005 1 287 29 29 THR HA H 3.750 0.005 1 288 29 29 THR HB H 4.191 0.005 1 289 29 29 THR HG2 H 1.281 0.005 1 290 29 29 THR C C 177.156 0.01 1 291 29 29 THR CA C 66.436 0.01 1 292 29 29 THR CB C 67.731 0.01 1 293 29 29 THR CG2 C 23.214 0.01 1 294 29 29 THR N N 112.721 0.01 1 295 30 30 LYS H H 7.601 0.005 1 296 30 30 LYS HA H 4.114 0.005 1 297 30 30 LYS HB2 H 1.848 0.005 2 298 30 30 LYS HB3 H 1.848 0.005 2 299 30 30 LYS HG2 H 1.407 0.005 2 300 30 30 LYS HG3 H 1.511 0.005 2 301 30 30 LYS HD2 H 1.694 0.005 2 302 30 30 LYS HD3 H 1.694 0.005 2 303 30 30 LYS HE2 H 2.994 0.005 2 304 30 30 LYS HE3 H 2.994 0.005 2 305 30 30 LYS C C 179.977 0.01 1 306 30 30 LYS CA C 59.212 0.01 1 307 30 30 LYS CB C 32.397 0.01 1 308 30 30 LYS CG C 25.104 0.01 1 309 30 30 LYS CD C 29.259 0.01 1 310 30 30 LYS CE C 42.446 0.01 1 311 30 30 LYS N N 120.720 0.01 1 312 31 31 GLU H H 7.687 0.005 1 313 31 31 GLU HA H 4.029 0.005 1 314 31 31 GLU HB2 H 2.790 0.005 2 315 31 31 GLU HB3 H 2.380 0.005 2 316 31 31 GLU HG2 H 2.565 0.005 2 317 31 31 GLU HG3 H 2.340 0.005 2 318 31 31 GLU C C 179.329 0.01 1 319 31 31 GLU CA C 59.567 0.01 1 320 31 31 GLU CB C 29.434 0.01 1 321 31 31 GLU CG C 38.252 0.01 1 322 31 31 GLU N N 121.916 0.01 1 323 32 32 LEU H H 8.597 0.005 1 324 32 32 LEU HA H 4.157 0.005 1 325 32 32 LEU HB2 H 1.832 0.005 2 326 32 32 LEU HB3 H 1.320 0.005 2 327 32 32 LEU HG H 1.302 0.005 1 328 32 32 LEU HD1 H 0.553 0.005 2 329 32 32 LEU HD2 H 0.449 0.005 2 330 32 32 LEU C C 178.894 0.01 1 331 32 32 LEU CA C 58.298 0.01 1 332 32 32 LEU CB C 42.416 0.01 1 333 32 32 LEU CG C 26.508 0.01 1 334 32 32 LEU CD1 C 23.351 0.01 1 335 32 32 LEU CD2 C 25.812 0.01 1 336 32 32 LEU N N 120.754 0.01 1 337 33 33 GLY H H 8.744 0.005 1 338 33 33 GLY HA2 H 3.943 0.005 2 339 33 33 GLY HA3 H 3.523 0.005 2 340 33 33 GLY C C 175.051 0.01 1 341 33 33 GLY CA C 48.431 0.01 1 342 33 33 GLY N N 105.850 0.01 1 343 34 34 THR H H 8.102 0.005 1 344 34 34 THR HA H 3.942 0.005 1 345 34 34 THR HB H 4.394 0.005 1 346 34 34 THR HG2 H 1.284 0.005 1 347 34 34 THR C C 176.804 0.01 1 348 34 34 THR CA C 67.194 0.01 1 349 34 34 THR CB C 68.710 0.01 1 350 34 34 THR CG2 C 21.437 0.01 1 351 34 34 THR N N 118.395 0.01 1 352 35 35 VAL H H 7.589 0.005 1 353 35 35 VAL HA H 3.581 0.005 1 354 35 35 VAL HB H 2.041 0.005 1 355 35 35 VAL HG1 H 0.780 0.005 2 356 35 35 VAL HG2 H 0.514 0.005 2 357 35 35 VAL C C 178.232 0.01 1 358 35 35 VAL CA C 66.428 0.01 1 359 35 35 VAL CB C 31.274 0.01 1 360 35 35 VAL CG1 C 23.214 0.01 1 361 35 35 VAL CG2 C 20.343 0.01 1 362 35 35 VAL N N 122.600 0.01 1 363 36 36 MET H H 8.310 0.005 1 364 36 36 MET HA H 3.943 0.005 1 365 36 36 MET HB2 H 2.039 0.005 2 366 36 36 MET HB3 H 2.039 0.005 2 367 36 36 MET HG2 H 2.483 0.005 2 368 36 36 MET HG3 H 2.370 0.005 2 369 36 36 MET C C 179.123 0.01 1 370 36 36 MET CA C 59.204 0.01 1 371 36 36 MET CB C 31.226 0.01 1 372 36 36 MET CG C 32.921 0.01 1 373 36 36 MET N N 117.028 0.01 1 374 37 37 ARG H H 8.597 0.005 1 375 37 37 ARG HA H 4.734 0.005 1 376 37 37 ARG HB2 H 1.921 0.005 2 377 37 37 ARG HB3 H 1.921 0.005 2 378 37 37 ARG HG2 H 1.869 0.005 2 379 37 37 ARG HG3 H 1.869 0.005 2 380 37 37 ARG HD2 H 3.302 0.005 2 381 37 37 ARG HD3 H 3.123 0.005 2 382 37 37 ARG C C 181.372 0.01 1 383 37 37 ARG CA C 59.110 0.01 1 384 37 37 ARG CB C 29.980 0.01 1 385 37 37 ARG CG C 29.336 0.01 1 386 37 37 ARG CD C 41.943 0.01 1 387 37 37 ARG N N 119.010 0.01 1 388 38 38 SER H H 8.041 0.005 1 389 38 38 SER HA H 4.296 0.005 1 390 38 38 SER HB2 H 3.806 0.005 2 391 38 38 SER HB3 H 4.106 0.005 2 392 38 38 SER C C 174.599 0.01 1 393 38 38 SER CA C 61.993 0.01 1 394 38 38 SER CB C 62.857 0.01 1 395 38 38 SER N N 119.079 0.01 1 396 39 39 LEU H H 7.235 0.005 1 397 39 39 LEU HA H 4.346 0.005 1 398 39 39 LEU HB2 H 1.770 0.005 2 399 39 39 LEU HB3 H 1.770 0.005 2 400 39 39 LEU HG H 0.828 0.005 1 401 39 39 LEU HD1 H 0.786 0.005 2 402 39 39 LEU HD2 H 0.694 0.005 2 403 39 39 LEU C C 176.954 0.01 1 404 39 39 LEU CA C 54.030 0.01 1 405 39 39 LEU CB C 41.719 0.01 1 406 39 39 LEU CG C 26.222 0.01 1 407 39 39 LEU CD1 C 23.488 0.01 1 408 39 39 LEU CD2 C 22.667 0.01 1 409 39 39 LEU N N 119.079 0.01 1 410 40 40 GLY H H 7.803 0.005 1 411 40 40 GLY HA2 H 4.202 0.005 2 412 40 40 GLY HA3 H 3.779 0.005 2 413 40 40 GLY C C 174.418 0.01 1 414 40 40 GLY CA C 45.632 0.01 1 415 40 40 GLY N N 106.705 0.01 1 416 41 41 GLN H H 7.778 0.005 1 417 41 41 GLN HA H 4.393 0.005 1 418 41 41 GLN HB2 H 2.102 0.005 2 419 41 41 GLN HB3 H 1.506 0.005 2 420 41 41 GLN HG2 H 1.828 0.005 2 421 41 41 GLN HG3 H 1.828 0.005 2 422 41 41 GLN C C 174.011 0.01 1 423 41 41 GLN CA C 53.782 0.01 1 424 41 41 GLN CB C 29.956 0.01 1 425 41 41 GLN CG C 33.316 0.01 1 426 41 41 GLN N N 117.814 0.01 1 427 42 42 ASN H H 8.606 0.005 1 428 42 42 ASN HA H 5.172 0.005 1 429 42 42 ASN HB2 H 2.770 0.005 2 430 42 42 ASN HB3 H 2.496 0.005 2 431 42 42 ASN CA C 51.201 0.01 1 432 42 42 ASN CB C 39.218 0.01 1 433 42 42 ASN N N 116.306 0.01 1 434 43 43 PRO HA H 4.747 0.005 1 435 43 43 PRO HB2 H 2.171 0.005 2 436 43 43 PRO HB3 H 1.905 0.005 2 437 43 43 PRO HG2 H 1.885 0.005 2 438 43 43 PRO HG3 H 1.885 0.005 2 439 43 43 PRO HD2 H 3.580 0.005 2 440 43 43 PRO HD3 H 3.216 0.005 2 441 43 43 PRO C C 177.621 0.01 1 442 43 43 PRO CA C 62.177 0.01 1 443 43 43 PRO CB C 31.932 0.01 1 444 43 43 PRO CG C 30.050 0.01 1 445 43 43 PRO CD C 49.736 0.01 1 446 44 44 THR H H 8.755 0.005 1 447 44 44 THR HA H 4.487 0.005 1 448 44 44 THR HB H 4.749 0.005 1 449 44 44 THR HG2 H 1.330 0.005 1 450 44 44 THR C C 175.248 0.01 1 451 44 44 THR CA C 60.440 0.01 1 452 44 44 THR CB C 71.131 0.01 1 453 44 44 THR CG2 C 21.969 0.01 1 454 44 44 THR N N 112.721 0.01 1 455 45 45 GLU H H 8.774 0.005 1 456 45 45 GLU HA H 3.985 0.005 1 457 45 45 GLU HB2 H 2.055 0.005 2 458 45 45 GLU HB3 H 2.162 0.005 2 459 45 45 GLU HG2 H 2.333 0.005 2 460 45 45 GLU HG3 H 2.333 0.005 2 461 45 45 GLU C C 178.936 0.01 1 462 45 45 GLU CA C 60.126 0.01 1 463 45 45 GLU CB C 28.819 0.01 1 464 45 45 GLU CG C 35.655 0.01 1 465 45 45 GLU N N 120.651 0.01 1 466 46 46 ALA H H 8.236 0.005 1 467 46 46 ALA HA H 4.117 0.005 1 468 46 46 ALA HB H 1.406 0.005 1 469 46 46 ALA C C 180.235 0.01 1 470 46 46 ALA CA C 55.046 0.01 1 471 46 46 ALA CB C 18.129 0.01 1 472 46 46 ALA N N 120.651 0.01 1 473 47 47 GLU H H 7.638 0.005 1 474 47 47 GLU HA H 3.982 0.005 1 475 47 47 GLU HB2 H 1.847 0.005 2 476 47 47 GLU HB3 H 1.847 0.005 2 477 47 47 GLU HG2 H 2.314 0.005 2 478 47 47 GLU HG3 H 2.314 0.005 2 479 47 47 GLU C C 179.984 0.01 1 480 47 47 GLU CA C 59.140 0.01 1 481 47 47 GLU CB C 29.385 0.01 1 482 47 47 GLU CG C 36.602 0.01 1 483 47 47 GLU N N 118.942 0.01 1 484 48 48 LEU H H 8.059 0.005 1 485 48 48 LEU HA H 3.985 0.005 1 486 48 48 LEU HB2 H 2.065 0.005 2 487 48 48 LEU HB3 H 1.150 0.005 2 488 48 48 LEU HG H 1.711 0.005 1 489 48 48 LEU HD1 H 0.815 0.005 2 490 48 48 LEU HD2 H 0.700 0.005 2 491 48 48 LEU C C 178.804 0.01 1 492 48 48 LEU CA C 57.724 0.01 1 493 48 48 LEU CB C 42.356 0.01 1 494 48 48 LEU CG C 26.495 0.01 1 495 48 48 LEU CD1 C 25.812 0.01 1 496 48 48 LEU CD2 C 23.214 0.01 1 497 48 48 LEU N N 119.831 0.01 1 498 49 49 GLN H H 8.287 0.005 1 499 49 49 GLN HA H 3.815 0.005 1 500 49 49 GLN HB2 H 2.222 0.005 2 501 49 49 GLN HB3 H 2.163 0.005 2 502 49 49 GLN HG2 H 2.492 0.005 2 503 49 49 GLN HG3 H 2.438 0.005 2 504 49 49 GLN C C 178.437 0.01 1 505 49 49 GLN CA C 58.735 0.01 1 506 49 49 GLN CB C 27.998 0.01 1 507 49 49 GLN CG C 34.190 0.01 1 508 49 49 GLN N N 118.566 0.01 1 509 50 50 ASP H H 8.004 0.005 1 510 50 50 ASP HA H 4.333 0.005 1 511 50 50 ASP HB2 H 2.761 0.005 2 512 50 50 ASP HB3 H 2.676 0.005 2 513 50 50 ASP C C 179.039 0.01 1 514 50 50 ASP CA C 57.692 0.01 1 515 50 50 ASP CB C 40.373 0.01 1 516 50 50 ASP N N 120.138 0.01 1 517 51 51 MET H H 7.852 0.005 1 518 51 51 MET HA H 4.100 0.005 1 519 51 51 MET HB2 H 1.913 0.005 2 520 51 51 MET HB3 H 1.913 0.005 2 521 51 51 MET C C 179.808 0.01 1 522 51 51 MET CA C 59.059 0.01 1 523 51 51 MET CB C 33.125 0.01 1 524 51 51 MET CG C 32.551 0.01 1 525 51 51 MET N N 119.489 0.01 1 526 52 52 ILE H H 7.968 0.005 1 527 52 52 ILE HA H 3.850 0.005 1 528 52 52 ILE HB H 2.127 0.005 1 529 52 52 ILE HG12 H 1.599 0.005 2 530 52 52 ILE HG13 H 1.391 0.005 2 531 52 52 ILE HG2 H 0.809 0.005 1 532 52 52 ILE HD1 H 0.728 0.005 1 533 52 52 ILE C C 178.088 0.01 1 534 52 52 ILE CA C 64.263 0.01 1 535 52 52 ILE CB C 36.303 0.01 1 536 52 52 ILE CG1 C 28.819 0.01 1 537 52 52 ILE CG2 C 16.242 0.01 1 538 52 52 ILE CD1 C 11.320 0.01 1 539 52 52 ILE N N 119.933 0.01 1 540 53 53 ASN H H 8.780 0.005 1 541 53 53 ASN HA H 4.460 0.005 1 542 53 53 ASN HB2 H 3.068 0.005 2 543 53 53 ASN HB3 H 2.952 0.005 2 544 53 53 ASN C C 177.236 0.01 1 545 53 53 ASN CA C 56.081 0.01 1 546 53 53 ASN CB C 37.958 0.01 1 547 53 53 ASN N N 118.156 0.01 1 548 54 54 GLU H H 7.669 0.005 1 549 54 54 GLU HA H 4.108 0.005 1 550 54 54 GLU HB2 H 2.344 0.005 2 551 54 54 GLU HB3 H 2.194 0.005 2 552 54 54 GLU HG2 H 2.477 0.005 2 553 54 54 GLU HG3 H 2.477 0.005 2 554 54 54 GLU C C 177.007 0.01 1 555 54 54 GLU CA C 58.874 0.01 1 556 54 54 GLU CB C 30.173 0.01 1 557 54 54 GLU CG C 35.928 0.01 1 558 54 54 GLU N N 116.618 0.01 1 559 55 55 VAL H H 7.174 0.005 1 560 55 55 VAL HA H 4.248 0.005 1 561 55 55 VAL HB H 2.101 0.005 1 562 55 55 VAL HG1 H 0.711 0.005 2 563 55 55 VAL HG2 H 0.803 0.005 2 564 55 55 VAL C C 175.302 0.01 1 565 55 55 VAL CA C 60.840 0.01 1 566 55 55 VAL CB C 33.012 0.01 1 567 55 55 VAL CG1 C 22.394 0.01 1 568 55 55 VAL CG2 C 21.027 0.01 1 569 55 55 VAL N N 111.559 0.01 1 570 56 56 ASP H H 7.748 0.005 1 571 56 56 ASP HA H 4.531 0.005 1 572 56 56 ASP HB2 H 2.773 0.005 2 573 56 56 ASP HB3 H 2.547 0.005 2 574 56 56 ASP C C 175.893 0.01 1 575 56 56 ASP CA C 53.651 0.01 1 576 56 56 ASP CB C 40.482 0.01 1 577 56 56 ASP N N 121.472 0.01 1 578 57 57 ALA H H 8.078 0.005 1 579 57 57 ALA HA H 4.229 0.005 1 580 57 57 ALA HB H 1.547 0.005 1 581 57 57 ALA C C 178.762 0.01 1 582 57 57 ALA CA C 54.488 0.01 1 583 57 57 ALA CB C 19.544 0.01 1 584 57 57 ALA N N 131.624 0.01 1 585 58 58 ASP H H 8.255 0.005 1 586 58 58 ASP HA H 4.653 0.005 1 587 58 58 ASP HB2 H 3.089 0.005 2 588 58 58 ASP HB3 H 2.655 0.005 2 589 58 58 ASP C C 177.990 0.01 1 590 58 58 ASP CA C 52.800 0.01 1 591 58 58 ASP CB C 39.647 0.01 1 592 58 58 ASP N N 114.020 0.01 1 593 59 59 GLY H H 7.595 0.005 1 594 59 59 GLY HA2 H 3.938 0.005 2 595 59 59 GLY HA3 H 3.806 0.005 2 596 59 59 GLY C C 175.035 0.01 1 597 59 59 GLY CA C 47.164 0.01 1 598 59 59 GLY N N 108.585 0.01 1 599 60 60 ASN H H 8.212 0.005 1 600 60 60 ASN HA H 4.627 0.005 1 601 60 60 ASN HB2 H 3.317 0.005 2 602 60 60 ASN HB3 H 2.648 0.005 2 603 60 60 ASN C C 176.861 0.01 1 604 60 60 ASN CA C 52.766 0.01 1 605 60 60 ASN CB C 37.441 0.01 1 606 60 60 ASN N N 118.976 0.01 1 607 61 61 GLY H H 10.587 0.005 1 608 61 61 GLY HA2 H 4.303 0.005 2 609 61 61 GLY HA3 H 3.519 0.005 2 610 61 61 GLY C C 173.302 0.01 1 611 61 61 GLY CA C 45.546 0.01 1 612 61 61 GLY N N 113.507 0.01 1 613 62 62 THR H H 7.662 0.005 1 614 62 62 THR HA H 4.824 0.005 1 615 62 62 THR HB H 4.056 0.005 1 616 62 62 THR HG2 H 1.162 0.005 1 617 62 62 THR C C 173.126 0.01 1 618 62 62 THR CA C 59.390 0.01 1 619 62 62 THR CB C 72.531 0.01 1 620 62 62 THR CG2 C 22.296 0.01 1 621 62 62 THR N N 108.243 0.01 1 622 63 63 ILE H H 8.761 0.005 1 623 63 63 ILE HA H 5.301 0.005 1 624 63 63 ILE HB H 2.189 0.005 1 625 63 63 ILE HG12 H 1.623 0.005 2 626 63 63 ILE HG13 H 1.340 0.005 2 627 63 63 ILE HG2 H 1.286 0.005 1 628 63 63 ILE HD1 H 1.060 0.005 1 629 63 63 ILE C C 175.663 0.01 1 630 63 63 ILE CA C 59.071 0.01 1 631 63 63 ILE CB C 39.256 0.01 1 632 63 63 ILE CG1 C 27.179 0.01 1 633 63 63 ILE CG2 C 18.429 0.01 1 634 63 63 ILE CD1 C 13.330 0.01 1 635 63 63 ILE N N 123.830 0.01 1 636 64 64 ASP H H 8.902 0.005 1 637 64 64 ASP HA H 5.493 0.005 1 638 64 64 ASP HB2 H 3.196 0.005 2 639 64 64 ASP HB3 H 2.845 0.005 2 640 64 64 ASP C C 176.057 0.01 1 641 64 64 ASP CA C 51.975 0.01 1 642 64 64 ASP CB C 42.121 0.01 1 643 64 64 ASP N N 128.411 0.01 1 644 65 65 PHE H H 8.951 0.005 1 645 65 65 PHE HA H 3.997 0.005 1 646 65 65 PHE HB2 H 2.812 0.005 2 647 65 65 PHE HB3 H 2.080 0.005 2 648 65 65 PHE C C 173.634 0.01 1 649 65 65 PHE CA C 63.115 0.01 1 650 65 65 PHE CB C 35.818 0.01 1 651 65 65 PHE N N 118.498 0.01 1 652 66 66 PRO HA H 3.863 0.005 1 653 66 66 PRO HB2 H 2.227 0.005 2 654 66 66 PRO HB3 H 1.906 0.005 2 655 66 66 PRO HG2 H 1.964 0.005 2 656 66 66 PRO HG3 H 1.964 0.005 2 657 66 66 PRO HD2 H 3.766 0.005 2 658 66 66 PRO HD3 H 3.766 0.005 2 659 66 66 PRO C C 179.973 0.01 1 660 66 66 PRO CA C 66.825 0.01 1 661 66 66 PRO CB C 30.460 0.01 1 662 66 66 PRO CG C 27.589 0.01 1 663 66 66 PRO CD C 48.916 0.01 1 664 67 67 GLU H H 8.291 0.005 1 665 67 67 GLU HA H 4.010 0.005 1 666 67 67 GLU HB2 H 2.651 0.005 2 667 67 67 GLU HB3 H 2.108 0.005 2 668 67 67 GLU HG2 H 3.051 0.005 2 669 67 67 GLU HG3 H 2.336 0.005 2 670 67 67 GLU C C 179.459 0.01 1 671 67 67 GLU CA C 59.077 0.01 1 672 67 67 GLU CB C 29.675 0.01 1 673 67 67 GLU CG C 37.432 0.01 1 674 67 67 GLU N N 117.814 0.01 1 675 68 68 PHE H H 8.676 0.005 1 676 68 68 PHE HA H 3.721 0.005 1 677 68 68 PHE HB2 H 3.401 0.005 2 678 68 68 PHE HB3 H 3.138 0.005 2 679 68 68 PHE HD1 H 6.846 0.005 1 680 68 68 PHE HD2 H 6.846 0.005 1 681 68 68 PHE HE1 H 7.200 0.005 1 682 68 68 PHE HE2 H 7.200 0.005 1 683 68 68 PHE HZ H 7.132 0.005 1 684 68 68 PHE C C 176.499 0.01 1 685 68 68 PHE CA C 61.666 0.01 1 686 68 68 PHE CB C 40.559 0.01 1 687 68 68 PHE N N 123.522 0.01 1 688 69 69 LEU H H 8.987 0.005 1 689 69 69 LEU HA H 3.350 0.005 1 690 69 69 LEU HB2 H 1.276 0.005 2 691 69 69 LEU HB3 H 1.160 0.005 2 692 69 69 LEU HG H 1.135 0.005 1 693 69 69 LEU HD1 H 0.696 0.005 2 694 69 69 LEU HD2 H 0.668 0.005 2 695 69 69 LEU C C 178.366 0.01 1 696 69 69 LEU CA C 58.130 0.01 1 697 69 69 LEU CB C 41.195 0.01 1 698 69 69 LEU CG C 26.098 0.01 1 699 69 69 LEU CD1 C 24.533 0.01 1 700 69 69 LEU CD2 C 25.128 0.01 1 701 69 69 LEU N N 120.275 0.01 1 702 70 70 THR H H 7.620 0.005 1 703 70 70 THR HA H 3.750 0.005 1 704 70 70 THR HB H 4.194 0.005 1 705 70 70 THR HG2 H 1.280 0.005 1 706 70 70 THR C C 176.149 0.01 1 707 70 70 THR CA C 66.622 0.01 1 708 70 70 THR CB C 68.357 0.01 1 709 70 70 THR CG2 C 23.214 0.01 1 710 70 70 THR N N 114.840 0.01 1 711 71 71 MET H H 7.064 0.005 1 712 71 71 MET HA H 3.910 0.005 1 713 71 71 MET HB2 H 2.058 0.005 2 714 71 71 MET HB3 H 2.058 0.005 2 715 71 71 MET HG2 H 2.245 0.005 2 716 71 71 MET HG3 H 2.245 0.005 2 717 71 71 MET C C 177.410 0.01 1 718 71 71 MET CA C 58.906 0.01 1 719 71 71 MET CB C 31.000 0.01 1 720 71 71 MET CG C 30.597 0.01 1 721 71 71 MET N N 120.856 0.01 1 722 72 72 MET HA H 3.627 0.005 1 723 72 72 MET HB2 H 0.762 0.005 2 724 72 72 MET HB3 H 1.047 0.005 2 725 72 72 MET HG2 H 1.410 0.005 2 726 72 72 MET HG3 H 1.410 0.005 2 727 72 72 MET C C 178.237 0.01 1 728 72 72 MET CA C 57.129 0.01 1 729 72 72 MET CB C 30.064 0.01 1 730 72 72 MET CG C 32.511 0.01 1 731 73 73 ALA H H 8.267 0.005 1 732 73 73 ALA HA H 4.003 0.005 1 733 73 73 ALA HB H 1.392 0.005 1 734 73 73 ALA C C 179.866 0.01 1 735 73 73 ALA CA C 54.680 0.01 1 736 73 73 ALA CB C 18.204 0.01 1 737 73 73 ALA N N 120.002 0.01 1 738 74 74 ARG H H 7.351 0.005 1 739 74 74 ARG HA H 4.106 0.005 1 740 74 74 ARG HB2 H 1.860 0.005 2 741 74 74 ARG HB3 H 1.860 0.005 2 742 74 74 ARG HG2 H 1.591 0.005 2 743 74 74 ARG HG3 H 1.730 0.005 2 744 74 74 ARG HD2 H 3.115 0.005 2 745 74 74 ARG HD3 H 3.115 0.005 2 746 74 74 ARG C C 178.696 0.01 1 747 74 74 ARG CA C 58.386 0.01 1 748 74 74 ARG CB C 30.318 0.01 1 749 74 74 ARG CG C 27.179 0.01 1 750 74 74 ARG CD C 43.442 0.01 1 751 74 74 ARG N N 115.866 0.01 1 752 75 75 LYS H H 7.931 0.005 1 753 75 75 LYS HA H 4.246 0.005 1 754 75 75 LYS HB2 H 1.862 0.005 2 755 75 75 LYS HB3 H 1.714 0.005 2 756 75 75 LYS HG2 H 1.451 0.005 2 757 75 75 LYS HG3 H 1.367 0.005 2 758 75 75 LYS HD2 H 1.533 0.005 2 759 75 75 LYS HD3 H 1.533 0.005 2 760 75 75 LYS HE2 H 2.753 0.005 2 761 75 75 LYS HE3 H 2.592 0.005 2 762 75 75 LYS C C 178.204 0.01 1 763 75 75 LYS CA C 56.995 0.01 1 764 75 75 LYS CB C 31.834 0.01 1 765 75 75 LYS CG C 24.705 0.01 1 766 75 75 LYS CD C 28.089 0.01 1 767 75 75 LYS CE C 39.619 0.01 1 768 75 75 LYS N N 117.712 0.01 1 769 76 76 MET H H 7.949 0.005 1 770 76 76 MET HA H 4.397 0.005 1 771 76 76 MET HB2 H 2.695 0.005 2 772 76 76 MET HB3 H 2.160 0.005 2 773 76 76 MET C C 176.759 0.01 1 774 76 76 MET CA C 56.978 0.01 1 775 76 76 MET CB C 32.511 0.01 1 776 76 76 MET N N 118.566 0.01 1 777 77 77 LYS H H 7.595 0.005 1 778 77 77 LYS HA H 4.345 0.005 1 779 77 77 LYS HB2 H 1.950 0.005 2 780 77 77 LYS HB3 H 1.828 0.005 2 781 77 77 LYS HG2 H 1.453 0.005 2 782 77 77 LYS HG3 H 1.453 0.005 2 783 77 77 LYS HD2 H 1.694 0.005 2 784 77 77 LYS HD3 H 1.694 0.005 2 785 77 77 LYS HE2 H 3.002 0.005 2 786 77 77 LYS HE3 H 3.002 0.005 2 787 77 77 LYS C C 176.327 0.01 1 788 77 77 LYS CA C 56.518 0.01 1 789 77 77 LYS CB C 32.724 0.01 1 790 77 77 LYS CG C 24.718 0.01 1 791 77 77 LYS CD C 28.945 0.01 1 792 77 77 LYS CE C 41.986 0.01 1 793 77 77 LYS N N 118.464 0.01 1 794 78 78 ASP H H 7.736 0.005 1 795 78 78 ASP HA H 4.615 0.005 1 796 78 78 ASP HB2 H 2.739 0.005 2 797 78 78 ASP HB3 H 2.682 0.005 2 798 78 78 ASP C C 176.009 0.01 1 799 78 78 ASP CA C 53.908 0.01 1 800 78 78 ASP CB C 41.390 0.01 1 801 78 78 ASP N N 119.933 0.01 1 802 79 79 THR H H 8.084 0.005 1 803 79 79 THR HA H 4.342 0.005 1 804 79 79 THR HB H 4.142 0.005 1 805 79 79 THR HG2 H 1.218 0.005 1 806 79 79 THR C C 174.129 0.01 1 807 79 79 THR CA C 61.693 0.01 1 808 79 79 THR CB C 69.978 0.01 1 809 79 79 THR CG2 C 21.459 0.01 1 810 79 79 THR N N 115.592 0.01 1 811 80 80 ASP H H 8.511 0.005 1 812 80 80 ASP HA H 4.890 0.005 1 813 80 80 ASP HB2 H 2.658 0.005 2 814 80 80 ASP HB3 H 2.506 0.005 2 815 80 80 ASP C C 175.576 0.01 1 816 80 80 ASP CA C 53.881 0.01 1 817 80 80 ASP CB C 41.608 0.01 1 818 80 80 ASP N N 125.573 0.01 1 819 81 81 SER H H 8.548 0.005 1 820 81 81 SER HA H 4.560 0.005 1 821 81 81 SER HB2 H 4.279 0.005 2 822 81 81 SER HB3 H 4.019 0.005 2 823 81 81 SER C C 174.874 0.01 1 824 81 81 SER CA C 57.339 0.01 1 825 81 81 SER CB C 65.340 0.01 1 826 81 81 SER N N 117.848 0.01 1 827 82 82 GLU H H 8.877 0.005 1 828 82 82 GLU HA H 4.008 0.005 1 829 82 82 GLU HB2 H 2.142 0.005 2 830 82 82 GLU HB3 H 2.038 0.005 2 831 82 82 GLU HG2 H 2.424 0.005 2 832 82 82 GLU HG3 H 2.323 0.005 2 833 82 82 GLU C C 178.254 0.01 1 834 82 82 GLU CA C 60.180 0.01 1 835 82 82 GLU CB C 29.064 0.01 1 836 82 82 GLU CG C 36.039 0.01 1 837 82 82 GLU N N 122.565 0.01 1 838 83 83 GLU H H 8.523 0.005 1 839 83 83 GLU HA H 4.115 0.005 1 840 83 83 GLU HB2 H 2.054 0.005 2 841 83 83 GLU HB3 H 1.959 0.005 2 842 83 83 GLU HG2 H 2.372 0.005 2 843 83 83 GLU HG3 H 2.372 0.005 2 844 83 83 GLU C C 178.818 0.01 1 845 83 83 GLU CA C 59.955 0.01 1 846 83 83 GLU CB C 29.062 0.01 1 847 83 83 GLU CG C 37.630 0.01 1 848 83 83 GLU N N 117.541 0.01 1 849 84 84 GLU H H 7.700 0.005 1 850 84 84 GLU HA H 3.971 0.005 1 851 84 84 GLU HB2 H 2.340 0.005 2 852 84 84 GLU HB3 H 2.111 0.005 2 853 84 84 GLU HG2 H 2.351 0.005 2 854 84 84 GLU HG3 H 2.351 0.005 2 855 84 84 GLU C C 179.550 0.01 1 856 84 84 GLU CA C 59.466 0.01 1 857 84 84 GLU CB C 29.463 0.01 1 858 84 84 GLU CG C 36.338 0.01 1 859 84 84 GLU N N 120.617 0.01 1 860 85 85 ILE H H 8.181 0.005 1 861 85 85 ILE HA H 3.917 0.005 1 862 85 85 ILE HB H 2.203 0.005 1 863 85 85 ILE HG12 H 1.818 0.005 2 864 85 85 ILE HG13 H 1.077 0.005 2 865 85 85 ILE HG2 H 1.145 0.005 1 866 85 85 ILE HD1 H 0.770 0.005 1 867 85 85 ILE C C 178.459 0.01 1 868 85 85 ILE CA C 65.457 0.01 1 869 85 85 ILE CB C 37.122 0.01 1 870 85 85 ILE CG1 C 29.229 0.01 1 871 85 85 ILE CG2 C 18.976 0.01 1 872 85 85 ILE CD1 C 12.824 0.01 1 873 85 85 ILE N N 122.360 0.01 1 874 86 86 ARG H H 8.621 0.005 1 875 86 86 ARG HA H 4.137 0.005 1 876 86 86 ARG HB2 H 2.079 0.005 2 877 86 86 ARG HB3 H 1.873 0.005 2 878 86 86 ARG HG2 H 1.565 0.005 2 879 86 86 ARG HG3 H 1.565 0.005 2 880 86 86 ARG HD2 H 2.978 0.005 2 881 86 86 ARG HD3 H 2.978 0.005 2 882 86 86 ARG C C 179.239 0.01 1 883 86 86 ARG CA C 60.036 0.01 1 884 86 86 ARG CB C 29.519 0.01 1 885 86 86 ARG CG C 26.915 0.01 1 886 86 86 ARG CD C 43.028 0.01 1 887 86 86 ARG N N 121.335 0.01 1 888 87 87 GLU H H 7.992 0.005 1 889 87 87 GLU HA H 4.095 0.005 1 890 87 87 GLU HB2 H 2.180 0.005 2 891 87 87 GLU HB3 H 2.084 0.005 2 892 87 87 GLU HG2 H 2.428 0.005 2 893 87 87 GLU HG3 H 2.335 0.005 2 894 87 87 GLU C C 179.289 0.01 1 895 87 87 GLU CA C 59.396 0.01 1 896 87 87 GLU CB C 29.200 0.01 1 897 87 87 GLU CG C 36.612 0.01 1 898 87 87 GLU N N 117.951 0.01 1 899 88 88 ALA H H 8.029 0.005 1 900 88 88 ALA HA H 4.200 0.005 1 901 88 88 ALA HB H 1.858 0.005 1 902 88 88 ALA C C 178.932 0.01 1 903 88 88 ALA CA C 55.483 0.01 1 904 88 88 ALA CB C 17.712 0.01 1 905 88 88 ALA N N 121.506 0.01 1 906 89 89 PHE H H 8.584 0.005 1 907 89 89 PHE HA H 3.324 0.005 1 908 89 89 PHE HB2 H 3.324 0.005 2 909 89 89 PHE HB3 H 2.777 0.005 2 910 89 89 PHE HD1 H 6.660 0.005 1 911 89 89 PHE HD2 H 6.660 0.005 1 912 89 89 PHE HE1 H 7.049 0.005 1 913 89 89 PHE HE2 H 7.049 0.005 1 914 89 89 PHE HZ H 7.201 0.005 1 915 89 89 PHE C C 177.597 0.01 1 916 89 89 PHE CA C 62.136 0.01 1 917 89 89 PHE CB C 39.189 0.01 1 918 89 89 PHE N N 118.874 0.01 1 919 90 90 ARG H H 7.833 0.005 1 920 90 90 ARG HA H 3.872 0.005 1 921 90 90 ARG HB2 H 2.000 0.005 2 922 90 90 ARG HB3 H 2.000 0.005 2 923 90 90 ARG HG2 H 1.784 0.005 2 924 90 90 ARG HG3 H 1.784 0.005 2 925 90 90 ARG HD2 H 3.259 0.005 2 926 90 90 ARG HD3 H 3.259 0.005 2 927 90 90 ARG C C 177.285 0.01 1 928 90 90 ARG CA C 58.648 0.01 1 929 90 90 ARG CB C 30.174 0.01 1 930 90 90 ARG CG C 27.722 0.01 1 931 90 90 ARG CD C 43.482 0.01 1 932 90 90 ARG N N 116.276 0.01 1 933 91 91 VAL H H 7.369 0.005 1 934 91 91 VAL HA H 3.476 0.005 1 935 91 91 VAL HB H 2.255 0.005 1 936 91 91 VAL HG1 H 1.059 0.005 2 937 91 91 VAL HG2 H 0.498 0.005 2 938 91 91 VAL C C 176.091 0.01 1 939 91 91 VAL CA C 65.814 0.01 1 940 91 91 VAL CB C 30.908 0.01 1 941 91 91 VAL CG1 C 22.804 0.01 1 942 91 91 VAL CG2 C 20.890 0.01 1 943 91 91 VAL N N 118.224 0.01 1 944 92 92 PHE H H 6.918 0.005 1 945 92 92 PHE HA H 4.210 0.005 1 946 92 92 PHE HB2 H 2.851 0.005 2 947 92 92 PHE HB3 H 2.700 0.005 2 948 92 92 PHE HD1 H 7.283 0.005 1 949 92 92 PHE HD2 H 7.283 0.005 1 950 92 92 PHE HE1 H 7.386 0.005 1 951 92 92 PHE HE2 H 7.386 0.005 1 952 92 92 PHE HZ H 7.521 0.005 1 953 92 92 PHE C C 176.424 0.01 1 954 92 92 PHE CA C 59.900 0.01 1 955 92 92 PHE CB C 41.661 0.01 1 956 92 92 PHE N N 113.370 0.01 1 957 93 93 ASP H H 7.839 0.005 1 958 93 93 ASP HA H 4.640 0.005 1 959 93 93 ASP HB2 H 2.215 0.005 2 960 93 93 ASP HB3 H 1.389 0.005 2 961 93 93 ASP C C 177.421 0.01 1 962 93 93 ASP CA C 52.300 0.01 1 963 93 93 ASP CB C 38.792 0.01 1 964 93 93 ASP N N 116.754 0.01 1 965 94 94 LYS H H 7.693 0.005 1 966 94 94 LYS HA H 3.938 0.005 1 967 94 94 LYS HB2 H 1.843 0.005 2 968 94 94 LYS HB3 H 1.843 0.005 2 969 94 94 LYS HG2 H 1.469 0.005 2 970 94 94 LYS HG3 H 1.469 0.005 2 971 94 94 LYS HD2 H 1.594 0.005 2 972 94 94 LYS HD3 H 1.594 0.005 2 973 94 94 LYS HE2 H 2.891 0.005 2 974 94 94 LYS HE3 H 2.891 0.005 2 975 94 94 LYS C C 178.272 0.01 1 976 94 94 LYS CA C 58.556 0.01 1 977 94 94 LYS CB C 32.135 0.01 1 978 94 94 LYS CG C 23.762 0.01 1 979 94 94 LYS CD C 27.798 0.01 1 980 94 94 LYS CE C 41.520 0.01 1 981 94 94 LYS N N 125.334 0.01 1 982 95 95 ASP H H 8.249 0.005 1 983 95 95 ASP HA H 4.551 0.005 1 984 95 95 ASP HB2 H 3.088 0.005 2 985 95 95 ASP HB3 H 2.650 0.005 2 986 95 95 ASP C C 177.760 0.01 1 987 95 95 ASP CA C 52.963 0.01 1 988 95 95 ASP CB C 39.553 0.01 1 989 95 95 ASP N N 114.293 0.01 1 990 96 96 GLY H H 7.730 0.005 1 991 96 96 GLY HA2 H 3.871 0.005 2 992 96 96 GLY HA3 H 3.871 0.005 2 993 96 96 GLY C C 175.129 0.01 1 994 96 96 GLY CA C 47.115 0.01 1 995 96 96 GLY N N 109.132 0.01 1 996 97 97 ASN H H 8.401 0.005 1 997 97 97 ASN HA H 4.664 0.005 1 998 97 97 ASN HB2 H 3.433 0.005 2 999 97 97 ASN HB3 H 2.688 0.005 2 1000 97 97 ASN C C 176.165 0.01 1 1001 97 97 ASN CA C 52.627 0.01 1 1002 97 97 ASN CB C 38.068 0.01 1 1003 97 97 ASN N N 119.694 0.01 1 1004 98 98 GLY H H 10.508 0.005 1 1005 98 98 GLY HA2 H 4.133 0.005 2 1006 98 98 GLY HA3 H 3.504 0.005 2 1007 98 98 GLY C C 172.792 0.01 1 1008 98 98 GLY CA C 45.036 0.01 1 1009 98 98 GLY N N 112.413 0.01 1 1010 99 99 TYR H H 7.711 0.005 1 1011 99 99 TYR HA H 5.104 0.005 1 1012 99 99 TYR HB2 H 2.608 0.005 2 1013 99 99 TYR HB3 H 2.551 0.005 2 1014 99 99 TYR HD1 H 6.921 0.005 1 1015 99 99 TYR HD2 H 6.921 0.005 1 1016 99 99 TYR HE1 H 6.771 0.005 1 1017 99 99 TYR HE2 H 6.771 0.005 1 1018 99 99 TYR C C 175.006 0.01 1 1019 99 99 TYR CA C 56.241 0.01 1 1020 99 99 TYR CB C 42.663 0.01 1 1021 99 99 TYR N N 116.242 0.01 1 1022 100 100 ILE H H 10.129 0.005 1 1023 100 100 ILE HA H 4.691 0.005 1 1024 100 100 ILE HB H 1.887 0.005 1 1025 100 100 ILE HG12 H 1.349 0.005 2 1026 100 100 ILE HG13 H 0.256 0.005 2 1027 100 100 ILE HG2 H 0.969 0.005 1 1028 100 100 ILE HD1 H 0.561 0.005 1 1029 100 100 ILE C C 175.334 0.01 1 1030 100 100 ILE CA C 61.259 0.01 1 1031 100 100 ILE CB C 39.209 0.01 1 1032 100 100 ILE CG1 C 26.632 0.01 1 1033 100 100 ILE CG2 C 17.199 0.01 1 1034 100 100 ILE CD1 C 16.242 0.01 1 1035 100 100 ILE N N 127.214 0.01 1 1036 101 101 SER H H 9.036 0.005 1 1037 101 101 SER HA H 4.912 0.005 1 1038 101 101 SER HB2 H 4.471 0.005 2 1039 101 101 SER HB3 H 3.980 0.005 2 1040 101 101 SER C C 175.274 0.01 1 1041 101 101 SER CA C 55.689 0.01 1 1042 101 101 SER CB C 66.912 0.01 1 1043 101 101 SER N N 124.001 0.01 1 1044 102 102 ALA H H 9.329 0.005 1 1045 102 102 ALA HA H 3.880 0.005 1 1046 102 102 ALA HB H 1.489 0.005 1 1047 102 102 ALA C C 179.394 0.01 1 1048 102 102 ALA CA C 55.804 0.01 1 1049 102 102 ALA CB C 17.738 0.01 1 1050 102 102 ALA N N 123.215 0.01 1 1051 103 103 ALA H H 8.215 0.005 1 1052 103 103 ALA HA H 4.051 0.005 1 1053 103 103 ALA HB H 1.440 0.005 1 1054 103 103 ALA C C 181.393 0.01 1 1055 103 103 ALA CA C 55.173 0.01 1 1056 103 103 ALA CB C 18.191 0.01 1 1057 103 103 ALA N N 118.293 0.01 1 1058 104 104 GLU H H 7.864 0.005 1 1059 104 104 GLU HA H 4.055 0.005 1 1060 104 104 GLU HB2 H 2.213 0.005 2 1061 104 104 GLU HB3 H 2.053 0.005 2 1062 104 104 GLU HG2 H 2.364 0.005 2 1063 104 104 GLU HG3 H 2.364 0.005 2 1064 104 104 GLU C C 179.324 0.01 1 1065 104 104 GLU CA C 59.590 0.01 1 1066 104 104 GLU CB C 28.903 0.01 1 1067 104 104 GLU CG C 37.965 0.01 1 1068 104 104 GLU N N 120.617 0.01 1 1069 105 105 LEU H H 8.310 0.005 1 1070 105 105 LEU HA H 4.229 0.005 1 1071 105 105 LEU HB2 H 1.842 0.005 2 1072 105 105 LEU HB3 H 1.302 0.005 2 1073 105 105 LEU HG H 1.406 0.005 1 1074 105 105 LEU HD1 H 0.664 0.005 2 1075 105 105 LEU HD2 H 0.524 0.005 2 1076 105 105 LEU C C 178.395 0.01 1 1077 105 105 LEU CA C 58.542 0.01 1 1078 105 105 LEU CB C 41.837 0.01 1 1079 105 105 LEU CG C 24.171 0.01 1 1080 105 105 LEU CD1 C 24.171 0.01 1 1081 105 105 LEU CD2 C 25.657 0.01 1 1082 105 105 LEU N N 120.822 0.01 1 1083 106 106 ARG H H 8.841 0.005 1 1084 106 106 ARG HA H 3.717 0.005 1 1085 106 106 ARG HB2 H 1.990 0.005 2 1086 106 106 ARG HB3 H 1.990 0.005 2 1087 106 106 ARG HG2 H 1.642 0.005 2 1088 106 106 ARG HG3 H 1.642 0.005 2 1089 106 106 ARG HD2 H 3.276 0.005 2 1090 106 106 ARG HD3 H 3.191 0.005 2 1091 106 106 ARG C C 178.689 0.01 1 1092 106 106 ARG CA C 60.122 0.01 1 1093 106 106 ARG CB C 30.218 0.01 1 1094 106 106 ARG CG C 27.726 0.01 1 1095 106 106 ARG CD C 43.462 0.01 1 1096 106 106 ARG N N 118.190 0.01 1 1097 107 107 HIS H H 8.181 0.005 1 1098 107 107 HIS HA H 4.318 0.005 1 1099 107 107 HIS HB2 H 3.314 0.005 2 1100 107 107 HIS HB3 H 3.468 0.005 2 1101 107 107 HIS C C 177.356 0.01 1 1102 107 107 HIS CA C 60.111 0.01 1 1103 107 107 HIS CB C 30.163 0.01 1 1104 107 107 HIS N N 120.412 0.01 1 1105 108 108 VAL H H 7.876 0.005 1 1106 108 108 VAL HA H 3.581 0.005 1 1107 108 108 VAL HB H 2.040 0.005 1 1108 108 108 VAL HG1 H 0.782 0.005 2 1109 108 108 VAL HG2 H 0.511 0.005 2 1110 108 108 VAL C C 177.343 0.01 1 1111 108 108 VAL CA C 66.977 0.01 1 1112 108 108 VAL CB C 31.808 0.01 1 1113 108 108 VAL CG1 C 23.214 0.01 1 1114 108 108 VAL CG2 C 20.753 0.01 1 1115 108 108 VAL N N 118.874 0.01 1 1116 109 109 MET H H 8.230 0.005 1 1117 109 109 MET HA H 4.259 0.005 1 1118 109 109 MET HB2 H 2.023 0.005 2 1119 109 109 MET HB3 H 2.143 0.005 2 1120 109 109 MET HG2 H 2.556 0.005 2 1121 109 109 MET HG3 H 2.752 0.005 2 1122 109 109 MET C C 178.934 0.01 1 1123 109 109 MET CA C 57.794 0.01 1 1124 109 109 MET CB C 30.202 0.01 1 1125 109 109 MET CG C 32.045 0.01 1 1126 109 109 MET N N 115.114 0.01 1 1127 110 110 THR H H 8.633 0.005 1 1128 110 110 THR HA H 4.087 0.005 1 1129 110 110 THR HB H 4.295 0.005 1 1130 110 110 THR HG2 H 1.252 0.005 1 1131 110 110 THR C C 178.501 0.01 1 1132 110 110 THR CA C 66.530 0.01 1 1133 110 110 THR CB C 68.559 0.01 1 1134 110 110 THR CG2 C 21.437 0.01 1 1135 110 110 THR N N 116.105 0.01 1 1136 111 111 ASN H H 8.017 0.005 1 1137 111 111 ASN HA H 4.422 0.005 1 1138 111 111 ASN HB2 H 2.960 0.005 2 1139 111 111 ASN HB3 H 2.754 0.005 2 1140 111 111 ASN C C 177.162 0.01 1 1141 111 111 ASN CA C 55.977 0.01 1 1142 111 111 ASN CB C 37.389 0.01 1 1143 111 111 ASN N N 123.522 0.01 1 1144 112 112 LEU H H 7.791 0.005 1 1145 112 112 LEU HA H 4.196 0.005 1 1146 112 112 LEU HB2 H 1.928 0.005 2 1147 112 112 LEU HB3 H 1.633 0.005 2 1148 112 112 LEU HG H 1.745 0.005 1 1149 112 112 LEU HD1 H 0.801 0.005 2 1150 112 112 LEU HD2 H 0.762 0.005 2 1151 112 112 LEU C C 176.407 0.01 1 1152 112 112 LEU CA C 55.935 0.01 1 1153 112 112 LEU CB C 42.500 0.01 1 1154 112 112 LEU CG C 26.359 0.01 1 1155 112 112 LEU CD1 C 25.551 0.01 1 1156 112 112 LEU CD2 C 23.254 0.01 1 1157 112 112 LEU N N 118.634 0.01 1 1158 113 113 GLY H H 7.669 0.005 1 1159 113 113 GLY HA2 H 4.299 0.005 2 1160 113 113 GLY HA3 H 3.680 0.005 2 1161 113 113 GLY C C 174.528 0.01 1 1162 113 113 GLY CA C 45.104 0.01 1 1163 113 113 GLY N N 104.996 0.01 1 1164 114 114 GLU H H 7.943 0.005 1 1165 114 114 GLU HA H 4.415 0.005 1 1166 114 114 GLU HB2 H 1.690 0.005 2 1167 114 114 GLU HB3 H 1.885 0.005 2 1168 114 114 GLU HG2 H 2.055 0.005 2 1169 114 114 GLU HG3 H 2.106 0.005 2 1170 114 114 GLU C C 175.164 0.01 1 1171 114 114 GLU CA C 55.256 0.01 1 1172 114 114 GLU CB C 30.454 0.01 1 1173 114 114 GLU CG C 34.949 0.01 1 1174 114 114 GLU N N 121.369 0.01 1 1175 115 115 LYS H H 8.474 0.005 1 1176 115 115 LYS HA H 4.380 0.005 1 1177 115 115 LYS HB2 H 1.754 0.005 2 1178 115 115 LYS HB3 H 1.754 0.005 2 1179 115 115 LYS HG2 H 1.400 0.005 2 1180 115 115 LYS HG3 H 1.314 0.005 2 1181 115 115 LYS HD2 H 1.660 0.005 2 1182 115 115 LYS HD3 H 1.660 0.005 2 1183 115 115 LYS HE2 H 2.976 0.005 2 1184 115 115 LYS HE3 H 2.976 0.005 2 1185 115 115 LYS C C 175.421 0.01 1 1186 115 115 LYS CA C 55.511 0.01 1 1187 115 115 LYS CB C 31.856 0.01 1 1188 115 115 LYS CG C 24.567 0.01 1 1189 115 115 LYS CD C 28.915 0.01 1 1190 115 115 LYS CE C 41.955 0.01 1 1191 115 115 LYS N N 124.890 0.01 1 1192 116 116 LEU H H 7.998 0.005 1 1193 116 116 LEU HA H 4.830 0.005 1 1194 116 116 LEU HB2 H 1.586 0.005 2 1195 116 116 LEU HB3 H 1.495 0.005 2 1196 116 116 LEU HG H 1.548 0.005 1 1197 116 116 LEU HD1 H 0.786 0.005 2 1198 116 116 LEU HD2 H 0.712 0.005 2 1199 116 116 LEU C C 177.985 0.01 1 1200 116 116 LEU CA C 53.886 0.01 1 1201 116 116 LEU CB C 44.915 0.01 1 1202 116 116 LEU CG C 27.179 0.01 1 1203 116 116 LEU CD1 C 24.171 0.01 1 1204 116 116 LEU CD2 C 26.905 0.01 1 1205 116 116 LEU N N 125.129 0.01 1 1206 117 117 THR H H 9.177 0.005 1 1207 117 117 THR HA H 4.485 0.005 1 1208 117 117 THR HB H 4.746 0.005 1 1209 117 117 THR HG2 H 1.331 0.005 1 1210 117 117 THR C C 175.490 0.01 1 1211 117 117 THR CA C 60.635 0.01 1 1212 117 117 THR CB C 71.187 0.01 1 1213 117 117 THR CG2 C 21.710 0.01 1 1214 117 117 THR N N 114.806 0.01 1 1215 118 118 ASP H H 8.853 0.005 1 1216 118 118 ASP HA H 4.230 0.005 1 1217 118 118 ASP HB2 H 2.749 0.005 2 1218 118 118 ASP HB3 H 2.600 0.005 2 1219 118 118 ASP C C 178.599 0.01 1 1220 118 118 ASP CA C 57.972 0.01 1 1221 118 118 ASP CB C 39.615 0.01 1 1222 118 118 ASP N N 121.061 0.01 1 1223 119 119 GLU H H 8.658 0.005 1 1224 119 119 GLU HA H 4.112 0.005 1 1225 119 119 GLU HB2 H 2.059 0.005 2 1226 119 119 GLU HB3 H 1.956 0.005 2 1227 119 119 GLU HG2 H 2.391 0.005 2 1228 119 119 GLU HG3 H 2.330 0.005 2 1229 119 119 GLU C C 179.092 0.01 1 1230 119 119 GLU CA C 60.013 0.01 1 1231 119 119 GLU CB C 29.022 0.01 1 1232 119 119 GLU CG C 36.400 0.01 1 1233 119 119 GLU N N 119.216 0.01 1 1234 120 120 GLU H H 7.711 0.005 1 1235 120 120 GLU HA H 4.033 0.005 1 1236 120 120 GLU HB2 H 1.948 0.005 2 1237 120 120 GLU HB3 H 1.948 0.005 2 1238 120 120 GLU HG2 H 2.382 0.005 2 1239 120 120 GLU HG3 H 2.382 0.005 2 1240 120 120 GLU C C 179.918 0.01 1 1241 120 120 GLU CA C 59.317 0.01 1 1242 120 120 GLU CB C 30.359 0.01 1 1243 120 120 GLU CG C 38.115 0.01 1 1244 120 120 GLU N N 120.309 0.01 1 1245 121 121 VAL H H 7.974 0.005 1 1246 121 121 VAL HA H 3.592 0.005 1 1247 121 121 VAL HB H 2.216 0.005 1 1248 121 121 VAL HG1 H 0.951 0.005 2 1249 121 121 VAL HG2 H 1.010 0.005 2 1250 121 121 VAL C C 177.433 0.01 1 1251 121 121 VAL CA C 66.989 0.01 1 1252 121 121 VAL CB C 31.280 0.01 1 1253 121 121 VAL CG1 C 23.624 0.01 1 1254 121 121 VAL CG2 C 22.257 0.01 1 1255 121 121 VAL N N 120.685 0.01 1 1256 122 122 ASP H H 8.047 0.005 1 1257 122 122 ASP HA H 4.324 0.005 1 1258 122 122 ASP HB2 H 2.770 0.005 2 1259 122 122 ASP HB3 H 2.642 0.005 2 1260 122 122 ASP C C 179.048 0.01 1 1261 122 122 ASP CA C 57.747 0.01 1 1262 122 122 ASP CB C 40.434 0.01 1 1263 122 122 ASP N N 120.104 0.01 1 1264 123 123 GLU H H 7.998 0.005 1 1265 123 123 GLU HA H 3.972 0.005 1 1266 123 123 GLU HB2 H 2.146 0.005 2 1267 123 123 GLU HB3 H 2.052 0.005 2 1268 123 123 GLU HG2 H 2.393 0.005 2 1269 123 123 GLU HG3 H 2.327 0.005 2 1270 123 123 GLU C C 178.680 0.01 1 1271 123 123 GLU CA C 59.371 0.01 1 1272 123 123 GLU CB C 29.253 0.01 1 1273 123 123 GLU CG C 36.000 0.01 1 1274 123 123 GLU N N 119.147 0.01 1 1275 124 124 MET H H 7.656 0.005 1 1276 124 124 MET HA H 4.296 0.005 1 1277 124 124 MET HB2 H 2.945 0.005 2 1278 124 124 MET HB3 H 2.945 0.005 2 1279 124 124 MET HG2 H 2.401 0.005 2 1280 124 124 MET HG3 H 2.322 0.005 2 1281 124 124 MET C C 178.143 0.01 1 1282 124 124 MET CA C 59.713 0.01 1 1283 124 124 MET CB C 33.580 0.01 1 1284 124 124 MET CG C 33.467 0.01 1 1285 124 124 MET N N 119.147 0.01 1 1286 125 125 ILE H H 7.821 0.005 1 1287 125 125 ILE HA H 3.530 0.005 1 1288 125 125 ILE HB H 2.234 0.005 1 1289 125 125 ILE HG12 H 1.410 0.005 2 1290 125 125 ILE HG13 H 1.410 0.005 2 1291 125 125 ILE HG2 H 0.731 0.005 1 1292 125 125 ILE HD1 H 0.612 0.005 1 1293 125 125 ILE C C 178.469 0.01 1 1294 125 125 ILE CA C 63.116 0.01 1 1295 125 125 ILE CB C 35.879 0.01 1 1296 125 125 ILE CG1 C 27.589 0.01 1 1297 125 125 ILE CG2 C 16.379 0.01 1 1298 125 125 ILE CD1 C 9.680 0.01 1 1299 125 125 ILE N N 118.019 0.01 1 1300 126 126 ARG H H 8.218 0.005 1 1301 126 126 ARG HA H 4.033 0.005 1 1302 126 126 ARG HB2 H 1.933 0.005 2 1303 126 126 ARG HB3 H 1.933 0.005 2 1304 126 126 ARG HG2 H 1.868 0.005 2 1305 126 126 ARG HG3 H 1.706 0.005 2 1306 126 126 ARG HD2 H 3.200 0.005 2 1307 126 126 ARG HD3 H 3.200 0.005 2 1308 126 126 ARG C C 178.030 0.01 1 1309 126 126 ARG CA C 59.515 0.01 1 1310 126 126 ARG CB C 30.199 0.01 1 1311 126 126 ARG CG C 28.001 0.01 1 1312 126 126 ARG CD C 43.262 0.01 1 1313 126 126 ARG N N 118.122 0.01 1 1314 127 127 GLU H H 7.717 0.005 1 1315 127 127 GLU HA H 4.015 0.005 1 1316 127 127 GLU HB2 H 2.327 0.005 2 1317 127 127 GLU HB3 H 2.221 0.005 2 1318 127 127 GLU HG2 H 2.638 0.005 2 1319 127 127 GLU HG3 H 2.638 0.005 2 1320 127 127 GLU C C 177.005 0.01 1 1321 127 127 GLU CA C 59.105 0.01 1 1322 127 127 GLU CB C 30.043 0.01 1 1323 127 127 GLU CG C 36.612 0.01 1 1324 127 127 GLU N N 117.780 0.01 1 1325 128 128 ALA H H 7.223 0.005 1 1326 128 128 ALA HA H 4.632 0.005 1 1327 128 128 ALA HB H 1.464 0.005 1 1328 128 128 ALA C C 177.347 0.01 1 1329 128 128 ALA CA C 51.102 0.01 1 1330 128 128 ALA CB C 22.802 0.01 1 1331 128 128 ALA N N 117.165 0.01 1 1332 129 129 ASP H H 7.955 0.005 1 1333 129 129 ASP HA H 4.501 0.005 1 1334 129 129 ASP HB2 H 2.771 0.005 2 1335 129 129 ASP HB3 H 2.435 0.005 2 1336 129 129 ASP C C 175.806 0.01 1 1337 129 129 ASP CA C 54.569 0.01 1 1338 129 129 ASP CB C 40.846 0.01 1 1339 129 129 ASP N N 117.985 0.01 1 1340 130 130 ILE H H 8.377 0.005 1 1341 130 130 ILE HA H 3.981 0.005 1 1342 130 130 ILE HB H 2.000 0.005 1 1343 130 130 ILE HG12 H 1.707 0.005 2 1344 130 130 ILE HG13 H 1.305 0.005 2 1345 130 130 ILE HG2 H 0.948 0.005 1 1346 130 130 ILE HD1 H 0.900 0.005 1 1347 130 130 ILE C C 177.774 0.01 1 1348 130 130 ILE CA C 63.344 0.01 1 1349 130 130 ILE CB C 38.685 0.01 1 1350 130 130 ILE CG1 C 27.726 0.01 1 1351 130 130 ILE CG2 C 17.336 0.01 1 1352 130 130 ILE CD1 C 12.414 0.01 1 1353 130 130 ILE N N 128.137 0.01 1 1354 131 131 ASP H H 8.334 0.005 1 1355 131 131 ASP HA H 4.543 0.005 1 1356 131 131 ASP HB2 H 3.084 0.005 2 1357 131 131 ASP HB3 H 2.677 0.005 2 1358 131 131 ASP C C 178.267 0.01 1 1359 131 131 ASP CA C 53.961 0.01 1 1360 131 131 ASP CB C 39.806 0.01 1 1361 131 131 ASP N N 117.062 0.01 1 1362 132 132 GLY H H 7.669 0.005 1 1363 132 132 GLY HA2 H 4.005 0.005 2 1364 132 132 GLY HA3 H 3.827 0.005 2 1365 132 132 GLY C C 175.295 0.01 1 1366 132 132 GLY CA C 47.367 0.01 1 1367 132 132 GLY N N 108.551 0.01 1 1368 133 133 ASP H H 8.371 0.005 1 1369 133 133 ASP HA H 4.494 0.005 1 1370 133 133 ASP HB2 H 2.990 0.005 2 1371 133 133 ASP HB3 H 2.544 0.005 2 1372 133 133 ASP C C 177.554 0.01 1 1373 133 133 ASP CA C 53.658 0.01 1 1374 133 133 ASP CB C 40.011 0.01 1 1375 133 133 ASP N N 120.685 0.01 1 1376 134 134 GLY H H 10.129 0.005 1 1377 134 134 GLY HA2 H 4.073 0.005 2 1378 134 134 GLY HA3 H 3.440 0.005 2 1379 134 134 GLY C C 172.898 0.01 1 1380 134 134 GLY CA C 45.856 0.01 1 1381 134 134 GLY N N 112.482 0.01 1 1382 135 135 GLN H H 8.010 0.005 1 1383 135 135 GLN HA H 4.979 0.005 1 1384 135 135 GLN HB2 H 2.014 0.005 2 1385 135 135 GLN HB3 H 1.791 0.005 2 1386 135 135 GLN HG2 H 2.034 0.005 2 1387 135 135 GLN HG3 H 2.034 0.005 2 1388 135 135 GLN C C 175.143 0.01 1 1389 135 135 GLN CA C 53.212 0.01 1 1390 135 135 GLN CB C 32.525 0.01 1 1391 135 135 GLN CG C 33.311 0.01 1 1392 135 135 GLN N N 115.490 0.01 1 1393 136 136 VAL H H 9.140 0.005 1 1394 136 136 VAL HA H 5.226 0.005 1 1395 136 136 VAL HB H 2.344 0.005 1 1396 136 136 VAL HG1 H 1.316 0.005 2 1397 136 136 VAL HG2 H 1.047 0.005 2 1398 136 136 VAL C C 175.831 0.01 1 1399 136 136 VAL CA C 61.647 0.01 1 1400 136 136 VAL CB C 33.812 0.01 1 1401 136 136 VAL CG1 C 21.847 0.01 1 1402 136 136 VAL CG2 C 22.804 0.01 1 1403 136 136 VAL N N 125.471 0.01 1 1404 137 137 ASN H H 9.573 0.005 1 1405 137 137 ASN HA H 5.420 0.005 1 1406 137 137 ASN HB2 H 3.234 0.005 2 1407 137 137 ASN HB3 H 3.096 0.005 2 1408 137 137 ASN C C 174.936 0.01 1 1409 137 137 ASN CA C 50.992 0.01 1 1410 137 137 ASN CB C 38.430 0.01 1 1411 137 137 ASN N N 129.128 0.01 1 1412 138 138 TYR H H 8.328 0.005 1 1413 138 138 TYR HA H 3.430 0.005 1 1414 138 138 TYR HB2 H 2.436 0.005 2 1415 138 138 TYR HB3 H 2.131 0.005 2 1416 138 138 TYR HD1 H 6.467 0.005 1 1417 138 138 TYR HD2 H 6.467 0.005 1 1418 138 138 TYR HE1 H 6.208 0.005 1 1419 138 138 TYR HE2 H 6.208 0.005 1 1420 138 138 TYR HH H 6.208 0.005 1 1421 138 138 TYR C C 176.174 0.01 1 1422 138 138 TYR CA C 62.559 0.01 1 1423 138 138 TYR CB C 37.715 0.01 1 1424 138 138 TYR N N 118.805 0.01 1 1425 139 139 GLU H H 8.078 0.005 1 1426 139 139 GLU HA H 3.699 0.005 1 1427 139 139 GLU HB2 H 2.098 0.005 2 1428 139 139 GLU HB3 H 1.987 0.005 2 1429 139 139 GLU HG2 H 2.323 0.005 2 1430 139 139 GLU HG3 H 2.323 0.005 2 1431 139 139 GLU C C 180.264 0.01 1 1432 139 139 GLU CA C 60.173 0.01 1 1433 139 139 GLU CB C 28.730 0.01 1 1434 139 139 GLU CG C 37.022 0.01 1 1435 139 139 GLU N N 118.703 0.01 1 1436 140 140 GLU H H 8.780 0.005 1 1437 140 140 GLU HA H 3.953 0.005 1 1438 140 140 GLU HB2 H 2.578 0.005 2 1439 140 140 GLU HB3 H 2.334 0.005 2 1440 140 140 GLU HG2 H 2.388 0.005 2 1441 140 140 GLU HG3 H 2.953 0.005 2 1442 140 140 GLU C C 179.361 0.01 1 1443 140 140 GLU CA C 58.855 0.01 1 1444 140 140 GLU CB C 29.468 0.01 1 1445 140 140 GLU CG C 37.295 0.01 1 1446 140 140 GLU N N 119.968 0.01 1 1447 141 141 PHE H H 8.578 0.005 1 1448 141 141 PHE HA H 3.805 0.005 1 1449 141 141 PHE HB2 H 3.423 0.005 2 1450 141 141 PHE HB3 H 3.116 0.005 2 1451 141 141 PHE HD1 H 6.390 0.005 1 1452 141 141 PHE HD2 H 6.390 0.005 1 1453 141 141 PHE HE1 H 7.000 0.005 1 1454 141 141 PHE HE2 H 7.000 0.005 1 1455 141 141 PHE HZ H 7.043 0.005 1 1456 141 141 PHE C C 176.725 0.01 1 1457 141 141 PHE CA C 62.027 0.01 1 1458 141 141 PHE CB C 40.415 0.01 1 1459 141 141 PHE N N 124.309 0.01 1 1460 142 142 VAL H H 8.670 0.005 1 1461 142 142 VAL HA H 3.215 0.005 1 1462 142 142 VAL HB H 1.852 0.005 1 1463 142 142 VAL HG1 H 0.767 0.005 2 1464 142 142 VAL HG2 H 0.509 0.005 2 1465 142 142 VAL C C 181.531 0.01 1 1466 142 142 VAL CA C 66.825 0.01 1 1467 142 142 VAL CB C 31.554 0.01 1 1468 142 142 VAL CG1 C 21.437 0.01 1 1469 142 142 VAL CG2 C 23.214 0.01 1 1470 142 142 VAL N N 119.079 0.01 1 1471 143 143 GLN H H 7.857 0.005 1 1472 143 143 GLN HA H 3.906 0.005 1 1473 143 143 GLN HB2 H 2.126 0.005 2 1474 143 143 GLN HB3 H 2.126 0.005 2 1475 143 143 GLN HG2 H 2.433 0.005 2 1476 143 143 GLN HG3 H 2.433 0.005 2 1477 143 143 GLN C C 178.190 0.01 1 1478 143 143 GLN CA C 59.134 0.01 1 1479 143 143 GLN CB C 27.775 0.01 1 1480 143 143 GLN CG C 34.159 0.01 1 1481 143 143 GLN N N 119.389 0.01 1 1482 144 144 MET H H 7.607 0.005 1 1483 144 144 MET HA H 4.166 0.005 1 1484 144 144 MET HB2 H 2.035 0.005 2 1485 144 144 MET HB3 H 1.947 0.005 2 1486 144 144 MET HG2 H 2.369 0.005 2 1487 144 144 MET HG3 H 2.261 0.005 2 1488 144 144 MET C C 177.589 0.01 1 1489 144 144 MET CA C 58.126 0.01 1 1490 144 144 MET CB C 32.570 0.01 1 1491 144 144 MET CG C 31.143 0.01 1 1492 144 144 MET N N 118.088 0.01 1 1493 145 145 MET H H 7.534 0.005 1 1494 145 145 MET HA H 4.324 0.005 1 1495 145 145 MET HB2 H 2.028 0.005 2 1496 145 145 MET HB3 H 1.755 0.005 2 1497 145 145 MET HG2 H 2.124 0.005 2 1498 145 145 MET HG3 H 2.124 0.005 2 1499 145 145 MET C C 177.468 0.01 1 1500 145 145 MET CA C 55.501 0.01 1 1501 145 145 MET CB C 30.887 0.01 1 1502 145 145 MET CG C 31.554 0.01 1 1503 145 145 MET N N 114.977 0.01 1 1504 146 146 THR H H 7.699 0.005 1 1505 146 146 THR HA H 4.347 0.005 1 1506 146 146 THR HB H 4.292 0.005 1 1507 146 146 THR HG2 H 1.204 0.005 1 1508 146 146 THR C C 174.184 0.01 1 1509 146 146 THR CA C 62.171 0.01 1 1510 146 146 THR CB C 70.291 0.01 1 1511 146 146 THR CG2 C 20.753 0.01 1 1512 146 146 THR N N 110.157 0.01 1 1513 147 147 ALA H H 7.620 0.005 1 1514 147 147 ALA HA H 4.303 0.005 1 1515 147 147 ALA HB H 1.422 0.005 1 1516 147 147 ALA C C 176.680 0.01 1 1517 147 147 ALA CA C 52.958 0.01 1 1518 147 147 ALA CB C 18.715 0.01 1 1519 147 147 ALA N N 127.009 0.01 1 1520 148 148 LYS H H 7.888 0.005 1 1521 148 148 LYS HA H 4.153 0.005 1 1522 148 148 LYS HB2 H 1.836 0.005 2 1523 148 148 LYS HB3 H 1.702 0.005 2 1524 148 148 LYS HG2 H 1.417 0.005 2 1525 148 148 LYS HG3 H 1.417 0.005 2 1526 148 148 LYS HD2 H 1.666 0.005 2 1527 148 148 LYS HD3 H 1.666 0.005 2 1528 148 148 LYS HE2 H 3.006 0.005 2 1529 148 148 LYS HE3 H 3.006 0.005 2 1530 148 148 LYS C C 181.528 0.01 1 1531 148 148 LYS CA C 57.567 0.01 1 1532 148 148 LYS CB C 33.666 0.01 1 1533 148 148 LYS CG C 24.581 0.01 1 1534 148 148 LYS CD C 28.946 0.01 1 1535 148 148 LYS CE C 42.080 0.01 1 1536 148 148 LYS N N 126.291 0.01 1 stop_ save_ save_assigned_chem_shift_list_1_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D simultaneous 1H-13C/15N-edited NOESY-HSQC' stop_ loop_ _Sample_label $CaM-OLFp stop_ _Sample_conditions_label $sample_conditions _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Chain 2' _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 1 202 2 PRO HA H 4.503 0.005 1 2 202 2 PRO HB2 H 2.340 0.005 2 3 202 2 PRO HB3 H 1.888 0.005 2 4 202 2 PRO HG2 H 2.050 0.005 2 5 202 2 PRO HG3 H 2.005 0.005 2 6 202 2 PRO HD2 H 3.808 0.005 2 7 202 2 PRO HD3 H 3.684 0.005 2 8 202 2 PRO C C 176.383 0.01 1 9 202 2 PRO CA C 63.269 0.01 1 10 202 2 PRO CB C 31.884 0.01 1 11 202 2 PRO CG C 27.316 0.01 1 12 202 2 PRO CD C 51.095 0.01 1 13 203 3 ARG H H 8.503 0.005 1 14 203 3 ARG HA H 4.311 0.005 1 15 203 3 ARG HB2 H 1.829 0.005 2 16 203 3 ARG HB3 H 1.711 0.005 2 17 203 3 ARG HG2 H 1.772 0.005 2 18 203 3 ARG HG3 H 1.652 0.005 2 19 203 3 ARG HD2 H 3.182 0.005 2 20 203 3 ARG HD3 H 3.182 0.005 2 21 203 3 ARG C C 176.268 0.01 1 22 203 3 ARG CA C 55.996 0.01 1 23 203 3 ARG CB C 30.512 0.01 1 24 203 3 ARG CG C 26.847 0.01 1 25 203 3 ARG CD C 43.269 0.01 1 26 203 3 ARG N N 121.415 0.01 1 27 204 4 ARG H H 8.321 0.005 1 28 204 4 ARG HA H 4.395 0.005 1 29 204 4 ARG HB2 H 1.884 0.005 2 30 204 4 ARG HB3 H 1.778 0.005 2 31 204 4 ARG HG2 H 1.652 0.005 2 32 204 4 ARG HG3 H 1.602 0.005 2 33 204 4 ARG HD2 H 3.188 0.005 2 34 204 4 ARG HD3 H 3.188 0.005 2 35 204 4 ARG C C 176.822 0.01 1 36 204 4 ARG CA C 55.716 0.01 1 37 204 4 ARG CB C 30.731 0.01 1 38 204 4 ARG CG C 26.891 0.01 1 39 204 4 ARG CD C 43.152 0.01 1 40 204 4 ARG N N 121.897 0.01 1 41 205 5 GLY H H 8.685 0.005 1 42 205 5 GLY HA2 H 4.003 0.005 2 43 205 5 GLY HA3 H 3.799 0.005 2 44 205 5 GLY C C 173.981 0.01 1 45 205 5 GLY CA C 45.136 0.01 1 46 205 5 GLY N N 109.784 0.01 1 47 206 6 ARG H H 8.623 0.005 1 48 206 6 ARG HA H 4.280 0.005 1 49 206 6 ARG HB2 H 1.858 0.005 2 50 206 6 ARG HB3 H 1.858 0.005 2 51 206 6 ARG HG2 H 1.607 0.005 2 52 206 6 ARG HG3 H 1.607 0.005 2 53 206 6 ARG HD2 H 3.190 0.005 2 54 206 6 ARG HD3 H 3.190 0.005 2 55 206 6 ARG C C 177.477 0.01 1 56 206 6 ARG CA C 57.561 0.01 1 57 206 6 ARG CB C 30.641 0.01 1 58 206 6 ARG CG C 27.131 0.01 1 59 206 6 ARG CD C 43.472 0.01 1 60 206 6 ARG N N 121.897 0.01 1 61 207 7 GLY H H 8.926 0.005 1 62 207 7 GLY HA2 H 4.006 0.005 2 63 207 7 GLY HA3 H 4.006 0.005 2 64 207 7 GLY C C 175.789 0.01 1 65 207 7 GLY CA C 46.027 0.01 1 66 207 7 GLY N N 109.682 0.01 1 67 208 8 GLY H H 8.263 0.005 1 68 208 8 GLY HA2 H 3.866 0.005 2 69 208 8 GLY HA3 H 3.866 0.005 2 70 208 8 GLY C C 175.494 0.01 1 71 208 8 GLY CA C 46.742 0.01 1 72 208 8 GLY N N 109.428 0.01 1 73 209 9 PHE H H 9.266 0.005 1 74 209 9 PHE HA H 4.599 0.005 1 75 209 9 PHE HB2 H 3.075 0.005 2 76 209 9 PHE HB3 H 2.786 0.005 2 77 209 9 PHE HD1 H 6.735 0.005 1 78 209 9 PHE HD2 H 6.735 0.005 1 79 209 9 PHE HE1 H 6.647 0.005 1 80 209 9 PHE HE2 H 6.647 0.005 1 81 209 9 PHE HZ H 7.238 0.005 1 82 209 9 PHE C C 177.953 0.01 1 83 209 9 PHE CA C 57.707 0.01 1 84 209 9 PHE CB C 38.264 0.01 1 85 209 9 PHE N N 125.427 0.01 1 86 210 10 GLN H H 8.949 0.005 1 87 210 10 GLN HA H 3.631 0.005 1 88 210 10 GLN HB2 H 2.166 0.005 2 89 210 10 GLN HB3 H 1.989 0.005 2 90 210 10 GLN HG2 H 2.385 0.005 2 91 210 10 GLN HG3 H 2.385 0.005 2 92 210 10 GLN HE21 H 7.516 0.005 2 93 210 10 GLN HE22 H 6.934 0.005 2 94 210 10 GLN C C 177.956 0.01 1 95 210 10 GLN CA C 59.684 0.01 1 96 210 10 GLN CB C 28.062 0.01 1 97 210 10 GLN CG C 33.965 0.01 1 98 210 10 GLN N N 119.281 0.01 1 99 210 10 GLN NE2 N 111.761 0.01 1 100 211 11 ARG H H 7.864 0.005 1 101 211 11 ARG HA H 3.991 0.005 1 102 211 11 ARG HB2 H 1.990 0.005 2 103 211 11 ARG HB3 H 1.990 0.005 2 104 211 11 ARG HG2 H 1.851 0.005 2 105 211 11 ARG HG3 H 1.574 0.005 2 106 211 11 ARG HD2 H 3.275 0.005 2 107 211 11 ARG HD3 H 3.275 0.005 2 108 211 11 ARG HE H 7.660 0.005 1 109 211 11 ARG C C 179.042 0.01 1 110 211 11 ARG CA C 59.807 0.01 1 111 211 11 ARG CB C 29.979 0.01 1 112 211 11 ARG CG C 27.488 0.01 1 113 211 11 ARG CD C 43.299 0.01 1 114 211 11 ARG N N 116.666 0.01 1 115 211 11 ARG NE N 110.035 0.01 1 116 212 12 ILE H H 7.782 0.005 1 117 212 12 ILE HA H 4.201 0.005 1 118 212 12 ILE HB H 2.313 0.005 1 119 212 12 ILE HG12 H 1.745 0.005 2 120 212 12 ILE HG13 H 1.640 0.005 2 121 212 12 ILE HG2 H 1.255 0.005 1 122 212 12 ILE HD1 H 0.894 0.005 1 123 212 12 ILE C C 177.654 0.01 1 124 212 12 ILE CA C 62.009 0.01 1 125 212 12 ILE CB C 36.595 0.01 1 126 212 12 ILE CG1 C 27.207 0.01 1 127 212 12 ILE CG2 C 18.016 0.01 1 128 212 12 ILE CD1 C 11.548 0.01 1 129 212 12 ILE N N 119.789 0.01 1 130 213 13 VAL H H 8.357 0.005 1 131 213 13 VAL HA H 3.734 0.005 1 132 213 13 VAL HB H 2.046 0.005 1 133 213 13 VAL HG1 H 0.720 0.005 2 134 213 13 VAL HG2 H 0.769 0.005 2 135 213 13 VAL C C 178.963 0.01 1 136 213 13 VAL CA C 67.647 0.01 1 137 213 13 VAL CB C 30.536 0.01 1 138 213 13 VAL CG1 C 23.760 0.01 1 139 213 13 VAL CG2 C 21.845 0.01 1 140 213 13 VAL N N 122.253 0.01 1 141 214 14 ARG H H 8.298 0.005 1 142 214 14 ARG HA H 4.133 0.005 1 143 214 14 ARG HB2 H 2.042 0.005 2 144 214 14 ARG HB3 H 1.925 0.005 2 145 214 14 ARG HG2 H 1.571 0.005 2 146 214 14 ARG HG3 H 1.571 0.005 2 147 214 14 ARG HD2 H 3.142 0.005 2 148 214 14 ARG HD3 H 3.142 0.005 2 149 214 14 ARG HE H 7.979 0.005 1 150 214 14 ARG C C 179.390 0.01 1 151 214 14 ARG CA C 59.681 0.01 1 152 214 14 ARG CB C 29.781 0.01 1 153 214 14 ARG CG C 27.987 0.01 1 154 214 14 ARG CD C 43.453 0.01 1 155 214 14 ARG N N 118.850 0.01 1 156 214 14 ARG NE N 110.851 0.01 1 157 215 15 LEU H H 7.970 0.005 1 158 215 15 LEU HA H 4.213 0.005 1 159 215 15 LEU HB2 H 2.134 0.005 2 160 215 15 LEU HB3 H 1.947 0.005 2 161 215 15 LEU HG H 1.859 0.005 1 162 215 15 LEU HD1 H 1.155 0.005 2 163 215 15 LEU HD2 H 1.060 0.005 2 164 215 15 LEU C C 178.506 0.01 1 165 215 15 LEU CA C 58.080 0.01 1 166 215 15 LEU CB C 41.500 0.01 1 167 215 15 LEU CG C 25.141 0.01 1 168 215 15 LEU CD1 C 23.855 0.01 1 169 215 15 LEU CD2 C 25.401 0.01 1 170 215 15 LEU N N 121.135 0.01 1 171 216 16 VAL H H 8.538 0.005 1 172 216 16 VAL HA H 3.614 0.005 1 173 216 16 VAL HB H 2.549 0.005 1 174 216 16 VAL HG1 H 1.065 0.005 2 175 216 16 VAL HG2 H 1.182 0.005 2 176 216 16 VAL C C 178.097 0.01 1 177 216 16 VAL CA C 67.505 0.01 1 178 216 16 VAL CB C 31.428 0.01 1 179 216 16 VAL CG1 C 21.312 0.01 1 180 216 16 VAL CG2 C 23.486 0.01 1 181 216 16 VAL N N 119.459 0.01 1 182 217 17 GLY H H 8.392 0.005 1 183 217 17 GLY HA2 H 4.056 0.005 2 184 217 17 GLY HA3 H 3.874 0.005 2 185 217 17 GLY C C 176.334 0.01 1 186 217 17 GLY CA C 47.388 0.01 1 187 217 17 GLY N N 106.914 0.01 1 188 218 18 VAL H H 8.157 0.005 1 189 218 18 VAL HA H 3.806 0.005 1 190 218 18 VAL HB H 2.559 0.005 1 191 218 18 VAL HG1 H 1.037 0.005 2 192 218 18 VAL HG2 H 1.150 0.005 2 193 218 18 VAL C C 178.061 0.01 1 194 218 18 VAL CA C 66.693 0.01 1 195 218 18 VAL CB C 31.096 0.01 1 196 218 18 VAL CG1 C 21.558 0.01 1 197 218 18 VAL CG2 C 23.213 0.01 1 198 218 18 VAL N N 123.116 0.01 1 199 219 19 ILE H H 8.427 0.005 1 200 219 19 ILE HA H 3.914 0.005 1 201 219 19 ILE HB H 2.124 0.005 1 202 219 19 ILE HG12 H 1.306 0.005 2 203 219 19 ILE HG2 H 1.036 0.005 1 204 219 19 ILE HD1 H 0.898 0.005 1 205 219 19 ILE C C 177.443 0.01 1 206 219 19 ILE CA C 66.073 0.01 1 207 219 19 ILE CB C 37.511 0.01 1 208 219 19 ILE CG1 C 29.515 0.01 1 209 219 19 ILE CG2 C 18.016 0.01 1 210 219 19 ILE CD1 C 13.109 0.01 1 211 219 19 ILE N N 120.094 0.01 1 212 220 20 ARG H H 8.486 0.005 1 213 220 20 ARG HA H 3.896 0.005 1 214 220 20 ARG HB2 H 1.959 0.005 2 215 220 20 ARG HB3 H 1.826 0.005 2 216 220 20 ARG HG2 H 1.500 0.005 2 217 220 20 ARG HG3 H 1.548 0.005 2 218 220 20 ARG HD2 H 3.157 0.005 2 219 220 20 ARG HD3 H 3.157 0.005 2 220 220 20 ARG HE H 7.733 0.005 1 221 220 20 ARG C C 178.791 0.01 1 222 220 20 ARG CA C 59.290 0.01 1 223 220 20 ARG CB C 29.119 0.01 1 224 220 20 ARG CG C 27.005 0.01 1 225 220 20 ARG CD C 42.480 0.01 1 226 220 20 ARG N N 119.307 0.01 1 227 220 20 ARG NE N 110.680 0.01 1 228 221 21 ASP H H 8.192 0.005 1 229 221 21 ASP HA H 4.472 0.005 1 230 221 21 ASP HB2 H 2.902 0.005 2 231 221 21 ASP HB3 H 2.706 0.005 2 232 221 21 ASP C C 178.439 0.01 1 233 221 21 ASP CA C 56.786 0.01 1 234 221 21 ASP CB C 40.821 0.01 1 235 221 21 ASP N N 119.764 0.01 1 236 222 22 TRP H H 8.797 0.005 1 237 222 22 TRP HA H 4.562 0.005 1 238 222 22 TRP HB2 H 3.517 0.005 2 239 222 22 TRP HB3 H 3.319 0.005 2 240 222 22 TRP HE1 H 9.833 0.005 1 241 222 22 TRP HE3 H 7.135 0.005 1 242 222 22 TRP HZ2 H 7.000 0.005 1 243 222 22 TRP HZ3 H 6.404 0.005 1 244 222 22 TRP HH2 H 6.631 0.005 1 245 222 22 TRP C C 178.172 0.01 1 246 222 22 TRP CA C 57.503 0.01 1 247 222 22 TRP CB C 29.903 0.01 1 248 222 22 TRP N N 122.786 0.01 1 249 222 22 TRP NE1 N 127.637 0.01 1 250 223 23 ALA H H 8.591 0.005 1 251 223 23 ALA HA H 4.135 0.005 1 252 223 23 ALA HB H 1.448 0.005 1 253 223 23 ALA C C 178.433 0.01 1 254 223 23 ALA CA C 53.795 0.01 1 255 223 23 ALA CB C 18.540 0.01 1 256 223 23 ALA N N 119.916 0.01 1 257 224 24 ASN H H 7.911 0.005 1 258 224 24 ASN HA H 4.567 0.005 1 259 224 24 ASN HB2 H 3.054 0.005 2 260 224 24 ASN HB3 H 2.799 0.005 2 261 224 24 ASN HD21 H 7.750 0.005 2 262 224 24 ASN HD22 H 6.932 0.005 2 263 224 24 ASN C C 174.921 0.01 1 264 224 24 ASN CA C 53.666 0.01 1 265 224 24 ASN CB C 38.169 0.01 1 266 224 24 ASN N N 114.634 0.01 1 267 224 24 ASN ND2 N 113.013 0.01 1 268 225 25 LYS H H 8.022 0.005 1 269 225 25 LYS HA H 4.087 0.005 1 270 225 25 LYS HB2 H 1.823 0.005 2 271 225 25 LYS HB3 H 1.823 0.005 2 272 225 25 LYS HG2 H 1.440 0.005 2 273 225 25 LYS HG3 H 1.440 0.005 2 274 225 25 LYS HD2 H 1.698 0.005 2 275 225 25 LYS HD3 H 1.698 0.005 2 276 225 25 LYS HE2 H 2.993 0.005 2 277 225 25 LYS HE3 H 2.993 0.005 2 278 225 25 LYS C C 175.758 0.01 1 279 225 25 LYS CA C 56.400 0.01 1 280 225 25 LYS CB C 31.757 0.01 1 281 225 25 LYS CG C 24.345 0.01 1 282 225 25 LYS CD C 28.804 0.01 1 283 225 25 LYS CE C 42.029 0.01 1 284 225 25 LYS N N 119.231 0.01 1 285 226 26 ASN H H 8.233 0.005 1 286 226 26 ASN HA H 4.711 0.005 1 287 226 26 ASN HB2 H 2.757 0.005 2 288 226 26 ASN HB3 H 2.521 0.005 2 289 226 26 ASN HD21 H 7.715 0.005 2 290 226 26 ASN HD22 H 6.902 0.005 2 291 226 26 ASN C C 174.805 0.01 1 292 226 26 ASN CA C 53.061 0.01 1 293 226 26 ASN CB C 38.496 0.01 1 294 226 26 ASN N N 117.580 0.01 1 295 226 26 ASN ND2 N 113.122 0.01 1 296 227 27 PHE H H 8.128 0.005 1 297 227 27 PHE HA H 4.663 0.005 1 298 227 27 PHE HB2 H 3.210 0.005 2 299 227 27 PHE HB3 H 2.940 0.005 2 300 227 27 PHE C C 174.921 0.01 1 301 227 27 PHE CA C 56.465 0.01 1 302 227 27 PHE CB C 38.939 0.01 1 303 227 27 PHE N N 121.364 0.01 1 304 228 28 ARG H H 8.181 0.005 1 305 228 28 ARG HA H 4.209 0.005 1 306 228 28 ARG HB2 H 1.739 0.005 2 307 228 28 ARG HG2 H 1.525 0.005 2 308 228 28 ARG HD2 H 3.192 0.005 2 309 228 28 ARG HD3 H 3.192 0.005 2 310 228 28 ARG CA C 57.299 0.01 1 311 228 28 ARG CB C 31.301 0.01 1 312 228 28 ARG N N 127.433 0.01 1 stop_ save_ save_assigned_chem_shift_list_2_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D simultaneous 1H-13C/15N-edited NOESY-HSQC' stop_ loop_ _Sample_label $CaM-OLFp stop_ _Sample_conditions_label $sample_conditions _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Chain 1' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 2 ASP HA H 4.641 0.005 1 2 2 2 ASP HB2 H 2.684 0.005 2 3 2 2 ASP HB3 H 2.542 0.005 2 4 2 2 ASP C C 175.593 0.01 1 5 2 2 ASP CA C 54.875 0.01 1 6 2 2 ASP CB C 41.276 0.01 1 7 3 3 GLN H H 8.346 0.005 1 8 3 3 GLN HA H 4.380 0.005 1 9 3 3 GLN HB2 H 2.093 0.005 2 10 3 3 GLN HB3 H 1.976 0.005 2 11 3 3 GLN HG2 H 2.357 0.005 2 12 3 3 GLN HG3 H 2.357 0.005 2 13 3 3 GLN C C 175.407 0.01 1 14 3 3 GLN CA C 55.513 0.01 1 15 3 3 GLN CB C 29.638 0.01 1 16 3 3 GLN CG C 33.693 0.01 1 17 3 3 GLN N N 119.968 0.01 1 18 4 4 LEU H H 8.261 0.005 1 19 4 4 LEU HA H 4.686 0.005 1 20 4 4 LEU HB2 H 1.733 0.005 2 21 4 4 LEU HB3 H 1.521 0.005 2 22 4 4 LEU HG H 0.957 0.005 1 23 4 4 LEU HD1 H 0.946 0.005 2 24 4 4 LEU HD2 H 0.957 0.005 2 25 4 4 LEU C C 177.604 0.01 1 26 4 4 LEU CA C 54.368 0.01 1 27 4 4 LEU CB C 43.551 0.01 1 28 4 4 LEU CG C 26.666 0.01 1 29 4 4 LEU CD1 C 23.608 0.01 1 30 4 4 LEU N N 123.078 0.01 1 31 5 5 THR H H 8.651 0.005 1 32 5 5 THR HA H 4.478 0.005 1 33 5 5 THR HB H 4.761 0.005 1 34 5 5 THR HG2 H 1.314 0.005 1 35 5 5 THR C C 175.466 0.01 1 36 5 5 THR CA C 60.446 0.01 1 37 5 5 THR CB C 71.229 0.01 1 38 5 5 THR CG2 C 21.878 0.01 1 39 5 5 THR N N 112.994 0.01 1 40 6 6 GLU H H 8.975 0.005 1 41 6 6 GLU HA H 3.964 0.005 1 42 6 6 GLU HB2 H 2.038 0.005 2 43 6 6 GLU HB3 H 2.038 0.005 2 44 6 6 GLU HG2 H 2.368 0.005 2 45 6 6 GLU HG3 H 2.368 0.005 2 46 6 6 GLU C C 179.432 0.01 1 47 6 6 GLU CA C 60.099 0.01 1 48 6 6 GLU CB C 29.021 0.01 1 49 6 6 GLU CG C 36.232 0.01 1 50 6 6 GLU N N 120.514 0.01 1 51 7 7 GLU H H 8.609 0.005 1 52 7 7 GLU HA H 4.094 0.005 1 53 7 7 GLU HB2 H 2.042 0.005 2 54 7 7 GLU HB3 H 1.948 0.005 2 55 7 7 GLU HG2 H 2.351 0.005 2 56 7 7 GLU HG3 H 2.351 0.005 2 57 7 7 GLU C C 179.155 0.01 1 58 7 7 GLU CA C 59.811 0.01 1 59 7 7 GLU CB C 28.975 0.01 1 60 7 7 GLU CG C 36.399 0.01 1 61 7 7 GLU N N 119.386 0.01 1 62 8 8 GLN H H 7.674 0.005 1 63 8 8 GLN HA H 3.762 0.005 1 64 8 8 GLN HB2 H 2.289 0.005 2 65 8 8 GLN HB3 H 1.552 0.005 2 66 8 8 GLN HG2 H 2.236 0.005 2 67 8 8 GLN HG3 H 2.291 0.005 2 68 8 8 GLN C C 178.389 0.01 1 69 8 8 GLN CA C 58.564 0.01 1 70 8 8 GLN CB C 29.000 0.01 1 71 8 8 GLN CG C 34.971 0.01 1 72 8 8 GLN N N 120.617 0.01 1 73 9 9 ILE H H 8.383 0.005 1 74 9 9 ILE HA H 3.703 0.005 1 75 9 9 ILE HB H 1.960 0.005 1 76 9 9 ILE HG12 H 1.836 0.005 2 77 9 9 ILE HG13 H 1.071 0.005 2 78 9 9 ILE HG2 H 1.133 0.005 1 79 9 9 ILE HD1 H 0.870 0.005 1 80 9 9 ILE C C 177.803 0.01 1 81 9 9 ILE CA C 66.410 0.01 1 82 9 9 ILE CB C 37.436 0.01 1 83 9 9 ILE CG1 C 29.287 0.01 1 84 9 9 ILE CG2 C 17.200 0.01 1 85 9 9 ILE CD1 C 12.828 0.01 1 86 9 9 ILE N N 119.557 0.01 1 87 10 10 ALA H H 8.029 0.005 1 88 10 10 ALA HA H 4.111 0.005 1 89 10 10 ALA HB H 1.527 0.005 1 90 10 10 ALA C C 181.029 0.01 1 91 10 10 ALA CA C 55.483 0.01 1 92 10 10 ALA CB C 17.712 0.01 1 93 10 10 ALA N N 121.506 0.01 1 94 11 11 GLU H H 7.772 0.005 1 95 11 11 GLU HA H 4.142 0.005 1 96 11 11 GLU HB2 H 2.007 0.005 2 97 11 11 GLU HB3 H 1.901 0.005 2 98 11 11 GLU HG2 H 2.351 0.005 2 99 11 11 GLU HG3 H 2.351 0.005 2 100 11 11 GLU C C 180.514 0.01 1 101 11 11 GLU CA C 59.471 0.01 1 102 11 11 GLU CB C 29.010 0.01 1 103 11 11 GLU CG C 36.338 0.01 1 104 11 11 GLU N N 119.489 0.01 1 105 12 12 PHE H H 8.535 0.005 1 106 12 12 PHE HA H 5.061 0.005 1 107 12 12 PHE HB2 H 3.496 0.005 2 108 12 12 PHE HB3 H 3.496 0.005 2 109 12 12 PHE HD1 H 6.800 0.005 1 110 12 12 PHE HD2 H 6.800 0.005 1 111 12 12 PHE HE1 H 7.160 0.005 1 112 12 12 PHE HE2 H 7.160 0.005 1 113 12 12 PHE HZ H 7.080 0.005 1 114 12 12 PHE C C 178.721 0.01 1 115 12 12 PHE CA C 59.117 0.01 1 116 12 12 PHE CB C 37.460 0.01 1 117 12 12 PHE N N 120.036 0.01 1 118 13 13 LYS H H 9.213 0.005 1 119 13 13 LYS HA H 4.040 0.005 1 120 13 13 LYS HB2 H 1.921 0.005 2 121 13 13 LYS HB3 H 1.921 0.005 2 122 13 13 LYS HG2 H 1.035 0.005 2 123 13 13 LYS HG3 H 1.245 0.005 2 124 13 13 LYS HD2 H 1.381 0.005 2 125 13 13 LYS HD3 H 1.234 0.005 2 126 13 13 LYS HE2 H 2.594 0.005 2 127 13 13 LYS HE3 H 2.594 0.005 2 128 13 13 LYS C C 179.304 0.01 1 129 13 13 LYS CA C 60.125 0.01 1 130 13 13 LYS CB C 31.834 0.01 1 131 13 13 LYS CG C 25.135 0.01 1 132 13 13 LYS CD C 28.716 0.01 1 133 13 13 LYS CE C 41.539 0.01 1 134 13 13 LYS N N 123.625 0.01 1 135 14 14 GLU H H 7.949 0.005 1 136 14 14 GLU HA H 4.136 0.005 1 137 14 14 GLU HB2 H 2.258 0.005 2 138 14 14 GLU HB3 H 2.181 0.005 2 139 14 14 GLU HG2 H 2.473 0.005 2 140 14 14 GLU HG3 H 2.473 0.005 2 141 14 14 GLU C C 179.813 0.01 1 142 14 14 GLU CA C 59.503 0.01 1 143 14 14 GLU CB C 29.095 0.01 1 144 14 14 GLU CG C 36.051 0.01 1 145 14 14 GLU N N 120.514 0.01 1 146 15 15 ALA H H 8.041 0.005 1 147 15 15 ALA HA H 4.274 0.005 1 148 15 15 ALA HB H 1.996 0.005 1 149 15 15 ALA C C 178.915 0.01 1 150 15 15 ALA CA C 55.465 0.01 1 151 15 15 ALA CB C 18.240 0.01 1 152 15 15 ALA N N 122.155 0.01 1 153 16 16 PHE H H 8.877 0.005 1 154 16 16 PHE HA H 3.380 0.005 1 155 16 16 PHE HB2 H 3.143 0.005 2 156 16 16 PHE HB3 H 2.616 0.005 2 157 16 16 PHE HD1 H 6.630 0.005 1 158 16 16 PHE HD2 H 6.630 0.005 1 159 16 16 PHE HE1 H 7.180 0.005 1 160 16 16 PHE HE2 H 7.180 0.005 1 161 16 16 PHE HZ H 6.760 0.005 1 162 16 16 PHE C C 177.813 0.01 1 163 16 16 PHE CA C 62.267 0.01 1 164 16 16 PHE CB C 39.697 0.01 1 165 16 16 PHE N N 119.045 0.01 1 166 17 17 SER H H 8.115 0.005 1 167 17 17 SER HA H 4.143 0.005 1 168 17 17 SER HB2 H 4.050 0.005 2 169 17 17 SER HB3 H 4.050 0.005 2 170 17 17 SER C C 174.613 0.01 1 171 17 17 SER CA C 61.530 0.01 1 172 17 17 SER CB C 63.418 0.01 1 173 17 17 SER N N 113.178 0.01 1 174 18 18 LEU H H 7.369 0.005 1 175 18 18 LEU HA H 4.028 0.005 1 176 18 18 LEU HB2 H 1.745 0.005 2 177 18 18 LEU HB3 H 1.685 0.005 2 178 18 18 LEU HG H 1.558 0.005 1 179 18 18 LEU HD1 H 0.806 0.005 2 180 18 18 LEU HD2 H 0.658 0.005 2 181 18 18 LEU C C 177.537 0.01 1 182 18 18 LEU CA C 57.390 0.01 1 183 18 18 LEU CB C 41.291 0.01 1 184 18 18 LEU CG C 26.905 0.01 1 185 18 18 LEU CD1 C 24.664 0.01 1 186 18 18 LEU CD2 C 23.761 0.01 1 187 18 18 LEU N N 120.754 0.01 1 188 19 19 PHE H H 7.192 0.005 1 189 19 19 PHE HA H 4.085 0.005 1 190 19 19 PHE HB2 H 2.878 0.005 2 191 19 19 PHE HB3 H 2.720 0.005 2 192 19 19 PHE HD1 H 6.467 0.005 1 193 19 19 PHE HD2 H 6.467 0.005 1 194 19 19 PHE HE1 H 6.208 0.005 1 195 19 19 PHE HE2 H 6.208 0.005 1 196 19 19 PHE C C 176.536 0.01 1 197 19 19 PHE CA C 59.766 0.01 1 198 19 19 PHE CB C 41.353 0.01 1 199 19 19 PHE N N 113.781 0.01 1 200 20 20 ASP H H 7.888 0.005 1 201 20 20 ASP HA H 4.626 0.005 1 202 20 20 ASP HB2 H 2.420 0.005 2 203 20 20 ASP HB3 H 1.583 0.005 2 204 20 20 ASP C C 177.124 0.01 1 205 20 20 ASP CA C 52.371 0.01 1 206 20 20 ASP CB C 39.159 0.01 1 207 20 20 ASP N N 117.370 0.01 1 208 21 21 LYS H H 7.736 0.005 1 209 21 21 LYS HA H 4.013 0.005 1 210 21 21 LYS HB2 H 1.914 0.005 2 211 21 21 LYS HB3 H 1.914 0.005 2 212 21 21 LYS HG2 H 1.563 0.005 2 213 21 21 LYS HG3 H 1.510 0.005 2 214 21 21 LYS HD2 H 1.685 0.005 2 215 21 21 LYS HD3 H 1.685 0.005 2 216 21 21 LYS HE2 H 3.049 0.005 2 217 21 21 LYS HE3 H 3.049 0.005 2 218 21 21 LYS C C 178.291 0.01 1 219 21 21 LYS CA C 58.622 0.01 1 220 21 21 LYS CB C 32.491 0.01 1 221 21 21 LYS CG C 24.075 0.01 1 222 21 21 LYS CD C 27.994 0.01 1 223 21 21 LYS CE C 42.219 0.01 1 224 21 21 LYS N N 124.274 0.01 1 225 22 22 ASP H H 8.078 0.005 1 226 22 22 ASP HA H 4.625 0.005 1 227 22 22 ASP HB2 H 3.086 0.005 2 228 22 22 ASP HB3 H 2.646 0.005 2 229 22 22 ASP C C 177.740 0.01 1 230 22 22 ASP CA C 52.738 0.01 1 231 22 22 ASP CB C 39.498 0.01 1 232 22 22 ASP N N 114.157 0.01 1 233 23 23 GLY H H 7.681 0.005 1 234 23 23 GLY HA2 H 3.892 0.005 2 235 23 23 GLY HA3 H 3.892 0.005 2 236 23 23 GLY C C 175.183 0.01 1 237 23 23 GLY CA C 47.187 0.01 1 238 23 23 GLY N N 109.303 0.01 1 239 24 24 ASP H H 8.474 0.005 1 240 24 24 ASP HA H 4.534 0.005 1 241 24 24 ASP HB2 H 3.079 0.005 2 242 24 24 ASP HB3 H 2.471 0.005 2 243 24 24 ASP C C 177.428 0.01 1 244 24 24 ASP CA C 53.665 0.01 1 245 24 24 ASP CB C 40.338 0.01 1 246 24 24 ASP N N 120.959 0.01 1 247 25 25 GLY H H 10.563 0.005 1 248 25 25 GLY HA2 H 4.393 0.005 2 249 25 25 GLY HA3 H 3.742 0.005 2 250 25 25 GLY C C 173.894 0.01 1 251 25 25 GLY CA C 45.377 0.01 1 252 25 25 GLY N N 112.858 0.01 1 253 26 26 THR H H 8.230 0.005 1 254 26 26 THR HA H 5.401 0.005 1 255 26 26 THR HB H 3.861 0.005 1 256 26 26 THR HG2 H 1.067 0.005 1 257 26 26 THR C C 173.168 0.01 1 258 26 26 THR CA C 59.526 0.01 1 259 26 26 THR CB C 72.817 0.01 1 260 26 26 THR CG2 C 21.860 0.01 1 261 26 26 THR N N 112.072 0.01 1 262 27 27 ILE H H 9.915 0.005 1 263 27 27 ILE HA H 4.909 0.005 1 264 27 27 ILE HB H 1.772 0.005 1 265 27 27 ILE HG12 H 1.249 0.005 2 266 27 27 ILE HG13 H 0.309 0.005 2 267 27 27 ILE HG2 H 0.972 0.005 1 268 27 27 ILE HD1 H 0.462 0.005 1 269 27 27 ILE C C 176.145 0.01 1 270 27 27 ILE CA C 61.010 0.01 1 271 27 27 ILE CB C 39.963 0.01 1 272 27 27 ILE CG1 C 27.191 0.01 1 273 27 27 ILE CG2 C 17.348 0.01 1 274 27 27 ILE CD1 C 16.254 0.01 1 275 27 27 ILE N N 126.872 0.01 1 276 28 28 THR H H 8.371 0.005 1 277 28 28 THR HA H 4.917 0.005 1 278 28 28 THR HB H 4.819 0.005 1 279 28 28 THR HG2 H 1.295 0.005 1 280 28 28 THR C C 176.711 0.01 1 281 28 28 THR CA C 59.318 0.01 1 282 28 28 THR CB C 72.635 0.01 1 283 28 28 THR CG2 C 21.794 0.01 1 284 28 28 THR N N 116.276 0.01 1 285 29 29 THR H H 9.201 0.005 1 286 29 29 THR HA H 3.755 0.005 1 287 29 29 THR HB H 4.198 0.005 1 288 29 29 THR HG2 H 1.279 0.005 1 289 29 29 THR C C 176.736 0.01 1 290 29 29 THR CA C 66.015 0.01 1 291 29 29 THR CB C 67.684 0.01 1 292 29 29 THR CG2 C 23.214 0.01 1 293 29 29 THR N N 111.832 0.01 1 294 30 30 LYS H H 7.449 0.005 1 295 30 30 LYS HA H 4.108 0.005 1 296 30 30 LYS HB2 H 1.835 0.005 2 297 30 30 LYS HB3 H 1.835 0.005 2 298 30 30 LYS HG2 H 1.498 0.005 2 299 30 30 LYS HG3 H 1.403 0.005 2 300 30 30 LYS HD2 H 1.654 0.005 2 301 30 30 LYS HD3 H 1.654 0.005 2 302 30 30 LYS HE2 H 3.002 0.005 2 303 30 30 LYS HE3 H 3.002 0.005 2 304 30 30 LYS C C 179.994 0.01 1 305 30 30 LYS CA C 59.185 0.01 1 306 30 30 LYS CB C 32.380 0.01 1 307 30 30 LYS CG C 24.855 0.01 1 308 30 30 LYS CD C 29.229 0.01 1 309 30 30 LYS CE C 42.080 0.01 1 310 30 30 LYS N N 120.514 0.01 1 311 31 31 GLU H H 7.772 0.005 1 312 31 31 GLU HA H 4.006 0.005 1 313 31 31 GLU HB2 H 2.807 0.005 2 314 31 31 GLU HB3 H 2.364 0.005 2 315 31 31 GLU HG2 H 2.523 0.005 2 316 31 31 GLU HG3 H 2.351 0.005 2 317 31 31 GLU C C 179.394 0.01 1 318 31 31 GLU CA C 59.557 0.01 1 319 31 31 GLU CB C 28.982 0.01 1 320 31 31 GLU CG C 38.453 0.01 1 321 31 31 GLU N N 122.292 0.01 1 322 32 32 LEU H H 8.438 0.005 1 323 32 32 LEU HA H 4.159 0.005 1 324 32 32 LEU HB2 H 1.858 0.005 2 325 32 32 LEU HB3 H 1.301 0.005 2 326 32 32 LEU HG H 1.386 0.005 1 327 32 32 LEU HD1 H 0.522 0.005 2 328 32 32 LEU HD2 H 0.451 0.005 2 329 32 32 LEU C C 178.729 0.01 1 330 32 32 LEU CA C 58.482 0.01 1 331 32 32 LEU CB C 41.540 0.01 1 332 32 32 LEU CG C 26.664 0.01 1 333 32 32 LEU CD1 C 22.819 0.01 1 334 32 32 LEU CD2 C 25.660 0.01 1 335 32 32 LEU N N 120.856 0.01 1 336 33 33 GLY H H 8.780 0.005 1 337 33 33 GLY HA2 H 3.934 0.005 2 338 33 33 GLY HA3 H 3.579 0.005 2 339 33 33 GLY C C 175.088 0.01 1 340 33 33 GLY CA C 48.313 0.01 1 341 33 33 GLY N N 106.124 0.01 1 342 34 34 THR H H 8.102 0.005 1 343 34 34 THR HA H 3.938 0.005 1 344 34 34 THR HB H 4.393 0.005 1 345 34 34 THR HG2 H 1.284 0.005 1 346 34 34 THR C C 176.804 0.01 1 347 34 34 THR CA C 67.194 0.01 1 348 34 34 THR CB C 68.710 0.01 1 349 34 34 THR CG2 C 21.437 0.01 1 350 34 34 THR N N 118.395 0.01 1 351 35 35 VAL H H 7.528 0.005 1 352 35 35 VAL HA H 3.573 0.005 1 353 35 35 VAL HB H 1.956 0.005 1 354 35 35 VAL HG1 H 0.658 0.005 2 355 35 35 VAL HG2 H 0.423 0.005 2 356 35 35 VAL C C 178.680 0.01 1 357 35 35 VAL CA C 66.764 0.01 1 358 35 35 VAL CB C 31.183 0.01 1 359 35 35 VAL CG1 C 22.804 0.01 1 360 35 35 VAL CG2 C 20.617 0.01 1 361 35 35 VAL N N 122.224 0.01 1 362 36 36 MET H H 8.401 0.005 1 363 36 36 MET HA H 4.059 0.005 1 364 36 36 MET HB2 H 1.916 0.005 2 365 36 36 MET HB3 H 1.916 0.005 2 366 36 36 MET HG2 H 2.369 0.005 2 367 36 36 MET HG3 H 2.369 0.005 2 368 36 36 MET C C 178.906 0.01 1 369 36 36 MET CA C 59.412 0.01 1 370 36 36 MET CB C 31.679 0.01 1 371 36 36 MET N N 117.985 0.01 1 372 37 37 ARG H H 7.827 0.005 1 373 37 37 ARG HA H 4.734 0.005 1 374 37 37 ARG HB2 H 1.921 0.005 2 375 37 37 ARG HB3 H 1.921 0.005 2 376 37 37 ARG HG2 H 1.869 0.005 2 377 37 37 ARG HG3 H 1.869 0.005 2 378 37 37 ARG HD2 H 3.302 0.005 2 379 37 37 ARG HD3 H 3.123 0.005 2 380 37 37 ARG CA C 59.275 0.01 1 381 37 37 ARG CB C 29.605 0.01 1 382 37 37 ARG CG C 29.336 0.01 1 383 37 37 ARG CD C 43.311 0.01 1 384 37 37 ARG N N 120.104 0.01 1 385 38 38 SER H H 8.018 0.005 1 386 38 38 SER HA H 4.321 0.005 1 387 38 38 SER HB2 H 3.808 0.005 2 388 38 38 SER HB3 H 4.110 0.005 2 389 38 38 SER CA C 62.027 0.01 1 390 38 38 SER CB C 62.851 0.01 1 391 38 38 SER N N 119.619 0.01 1 392 39 39 LEU H H 7.290 0.005 1 393 39 39 LEU HA H 4.284 0.005 1 394 39 39 LEU HB2 H 1.738 0.005 2 395 39 39 LEU HB3 H 1.738 0.005 2 396 39 39 LEU HG H 1.785 0.005 1 397 39 39 LEU HD1 H 0.771 0.005 2 398 39 39 LEU HD2 H 0.699 0.005 2 399 39 39 LEU C C 176.598 0.01 1 400 39 39 LEU CA C 54.210 0.01 1 401 39 39 LEU CB C 41.754 0.01 1 402 39 39 LEU CG C 27.769 0.01 1 403 39 39 LEU CD1 C 26.034 0.01 1 404 39 39 LEU CD2 C 22.719 0.01 1 405 39 39 LEU N N 119.216 0.01 1 406 40 40 GLY H H 7.827 0.005 1 407 40 40 GLY HA2 H 4.227 0.005 2 408 40 40 GLY HA3 H 3.795 0.005 2 409 40 40 GLY C C 174.425 0.01 1 410 40 40 GLY CA C 45.505 0.01 1 411 40 40 GLY N N 106.261 0.01 1 412 41 41 GLN H H 7.846 0.005 1 413 41 41 GLN HA H 4.458 0.005 1 414 41 41 GLN HB2 H 2.150 0.005 2 415 41 41 GLN HB3 H 1.602 0.005 2 416 41 41 GLN HG2 H 2.136 0.005 2 417 41 41 GLN HG3 H 2.136 0.005 2 418 41 41 GLN C C 174.194 0.01 1 419 41 41 GLN CA C 54.443 0.01 1 420 41 41 GLN CB C 30.000 0.01 1 421 41 41 GLN CG C 33.330 0.01 1 422 41 41 GLN N N 118.464 0.01 1 423 42 42 ASN H H 8.648 0.005 1 424 42 42 ASN HA H 5.226 0.005 1 425 42 42 ASN HB2 H 2.790 0.005 2 426 42 42 ASN HB3 H 2.520 0.005 2 427 42 42 ASN C C 174.176 0.01 1 428 42 42 ASN CA C 51.152 0.01 1 429 42 42 ASN CB C 39.197 0.01 1 430 42 42 ASN N N 116.243 0.01 1 431 43 43 PRO HA H 4.743 0.005 1 432 43 43 PRO HB2 H 2.173 0.005 2 433 43 43 PRO HB3 H 1.910 0.005 2 434 43 43 PRO HG2 H 1.885 0.005 2 435 43 43 PRO HG3 H 1.885 0.005 2 436 43 43 PRO HD2 H 3.580 0.005 2 437 43 43 PRO HD3 H 3.216 0.005 2 438 43 43 PRO C C 177.683 0.01 1 439 43 43 PRO CA C 62.344 0.01 1 440 43 43 PRO CB C 31.922 0.01 1 441 43 43 PRO CG C 30.050 0.01 1 442 43 43 PRO CD C 49.736 0.01 1 443 44 44 THR H H 8.633 0.005 1 444 44 44 THR HA H 4.443 0.005 1 445 44 44 THR HB H 4.708 0.005 1 446 44 44 THR HG2 H 1.345 0.005 1 447 44 44 THR C C 175.235 0.01 1 448 44 44 THR CA C 60.321 0.01 1 449 44 44 THR CB C 71.170 0.01 1 450 44 44 THR CG2 C 21.956 0.01 1 451 44 44 THR N N 112.413 0.01 1 452 45 45 GLU H H 8.774 0.005 1 453 45 45 GLU HA H 3.982 0.005 1 454 45 45 GLU HB2 H 2.044 0.005 2 455 45 45 GLU HB3 H 2.044 0.005 2 456 45 45 GLU HG2 H 2.341 0.005 2 457 45 45 GLU HG3 H 2.341 0.005 2 458 45 45 GLU C C 178.936 0.01 1 459 45 45 GLU CA C 60.012 0.01 1 460 45 45 GLU CB C 28.819 0.01 1 461 45 45 GLU CG C 35.790 0.01 1 462 45 45 GLU N N 120.651 0.01 1 463 46 46 ALA H H 8.218 0.005 1 464 46 46 ALA HA H 4.109 0.005 1 465 46 46 ALA HB H 1.407 0.005 1 466 46 46 ALA C C 180.475 0.01 1 467 46 46 ALA CA C 55.041 0.01 1 468 46 46 ALA CB C 18.118 0.01 1 469 46 46 ALA N N 120.720 0.01 1 470 47 47 GLU H H 7.676 0.005 1 471 47 47 GLU HA H 3.982 0.005 1 472 47 47 GLU HB2 H 1.847 0.005 2 473 47 47 GLU HB3 H 1.847 0.005 2 474 47 47 GLU HG2 H 2.314 0.005 2 475 47 47 GLU HG3 H 2.314 0.005 2 476 47 47 GLU C C 179.850 0.01 1 477 47 47 GLU CA C 59.234 0.01 1 478 47 47 GLU CB C 29.378 0.01 1 479 47 47 GLU CG C 36.602 0.01 1 480 47 47 GLU N N 118.942 0.01 1 481 48 48 LEU H H 8.059 0.005 1 482 48 48 LEU HA H 3.988 0.005 1 483 48 48 LEU HB2 H 2.058 0.005 2 484 48 48 LEU HB3 H 1.152 0.005 2 485 48 48 LEU HG H 1.708 0.005 1 486 48 48 LEU HD1 H 0.818 0.005 2 487 48 48 LEU HD2 H 0.701 0.005 2 488 48 48 LEU C C 178.602 0.01 1 489 48 48 LEU CA C 57.882 0.01 1 490 48 48 LEU CB C 42.508 0.01 1 491 48 48 LEU CG C 26.495 0.01 1 492 48 48 LEU CD1 C 25.812 0.01 1 493 48 48 LEU CD2 C 23.214 0.01 1 494 48 48 LEU N N 119.831 0.01 1 495 49 49 GLN H H 8.242 0.005 1 496 49 49 GLN HA H 3.793 0.005 1 497 49 49 GLN HB2 H 2.178 0.005 2 498 49 49 GLN HB3 H 2.178 0.005 2 499 49 49 GLN HG2 H 2.463 0.005 2 500 49 49 GLN HG3 H 2.463 0.005 2 501 49 49 GLN C C 178.473 0.01 1 502 49 49 GLN CA C 58.838 0.01 1 503 49 49 GLN CB C 28.120 0.01 1 504 49 49 GLN CG C 34.219 0.01 1 505 49 49 GLN N N 117.917 0.01 1 506 50 50 ASP H H 8.090 0.005 1 507 50 50 ASP HA H 4.463 0.005 1 508 50 50 ASP HB2 H 2.827 0.005 2 509 50 50 ASP HB3 H 2.721 0.005 2 510 50 50 ASP C C 178.805 0.01 1 511 50 50 ASP CA C 57.624 0.01 1 512 50 50 ASP CB C 40.491 0.01 1 513 50 50 ASP N N 119.865 0.01 1 514 51 51 MET H H 7.852 0.005 1 515 51 51 MET HA H 4.100 0.005 1 516 51 51 MET HB2 H 1.913 0.005 2 517 51 51 MET HB3 H 1.913 0.005 2 518 51 51 MET C C 179.808 0.01 1 519 51 51 MET CA C 59.059 0.01 1 520 51 51 MET CB C 33.125 0.01 1 521 51 51 MET CG C 32.551 0.01 1 522 51 51 MET N N 119.489 0.01 1 523 52 52 ILE H H 7.669 0.005 1 524 52 52 ILE HA H 3.738 0.005 1 525 52 52 ILE HB H 2.000 0.005 1 526 52 52 ILE HG12 H 1.460 0.005 2 527 52 52 ILE HG13 H 1.312 0.005 2 528 52 52 ILE HG2 H 0.755 0.005 1 529 52 52 ILE HD1 H 0.620 0.005 1 530 52 52 ILE C C 178.088 0.01 1 531 52 52 ILE CA C 64.045 0.01 1 532 52 52 ILE CB C 36.761 0.01 1 533 52 52 ILE CG1 C 29.242 0.01 1 534 52 52 ILE CG2 C 16.254 0.01 1 535 52 52 ILE CD1 C 11.457 0.01 1 536 52 52 ILE N N 118.156 0.01 1 537 53 53 ASN H H 8.786 0.005 1 538 53 53 ASN HA H 4.437 0.005 1 539 53 53 ASN HB2 H 3.043 0.005 2 540 53 53 ASN HB3 H 2.894 0.005 2 541 53 53 ASN C C 177.721 0.01 1 542 53 53 ASN CA C 56.027 0.01 1 543 53 53 ASN CB C 38.022 0.01 1 544 53 53 ASN N N 118.395 0.01 1 545 54 54 GLU H H 7.552 0.005 1 546 54 54 GLU HA H 4.044 0.005 1 547 54 54 GLU HB2 H 2.252 0.005 2 548 54 54 GLU HB3 H 2.040 0.005 2 549 54 54 GLU HG2 H 2.303 0.005 2 550 54 54 GLU HG3 H 2.549 0.005 2 551 54 54 GLU C C 177.293 0.01 1 552 54 54 GLU CA C 58.968 0.01 1 553 54 54 GLU CB C 30.369 0.01 1 554 54 54 GLU CG C 36.474 0.01 1 555 54 54 GLU N N 115.866 0.01 1 556 55 55 VAL H H 7.137 0.005 1 557 55 55 VAL HA H 4.405 0.005 1 558 55 55 VAL HB H 2.282 0.005 1 559 55 55 VAL HG1 H 0.865 0.005 2 560 55 55 VAL HG2 H 1.005 0.005 2 561 55 55 VAL C C 174.823 0.01 1 562 55 55 VAL CA C 60.334 0.01 1 563 55 55 VAL CB C 32.403 0.01 1 564 55 55 VAL CG1 C 22.396 0.01 1 565 55 55 VAL CG2 C 18.998 0.01 1 566 55 55 VAL N N 108.722 0.01 1 567 56 56 ASP H H 7.375 0.005 1 568 56 56 ASP HA H 4.505 0.005 1 569 56 56 ASP HB2 H 2.794 0.005 2 570 56 56 ASP HB3 H 2.586 0.005 2 571 56 56 ASP C C 176.138 0.01 1 572 56 56 ASP CA C 53.350 0.01 1 573 56 56 ASP CB C 40.244 0.01 1 574 56 56 ASP N N 121.882 0.01 1 575 57 57 ALA H H 7.870 0.005 1 576 57 57 ALA HA H 4.213 0.005 1 577 57 57 ALA HB H 1.562 0.005 1 578 57 57 ALA C C 178.767 0.01 1 579 57 57 ALA CA C 54.660 0.01 1 580 57 57 ALA CB C 19.562 0.01 1 581 57 57 ALA N N 130.940 0.01 1 582 58 58 ASP H H 8.218 0.005 1 583 58 58 ASP HA H 4.573 0.005 1 584 58 58 ASP HB2 H 3.080 0.005 2 585 58 58 ASP HB3 H 2.703 0.005 2 586 58 58 ASP C C 178.005 0.01 1 587 58 58 ASP CA C 52.784 0.01 1 588 58 58 ASP CB C 39.728 0.01 1 589 58 58 ASP N N 113.746 0.01 1 590 59 59 GLY H H 7.534 0.005 1 591 59 59 GLY HA2 H 3.935 0.005 2 592 59 59 GLY HA3 H 3.782 0.005 2 593 59 59 GLY C C 174.923 0.01 1 594 59 59 GLY CA C 47.165 0.01 1 595 59 59 GLY N N 108.277 0.01 1 596 60 60 ASN H H 8.126 0.005 1 597 60 60 ASN HA H 4.619 0.005 1 598 60 60 ASN HB2 H 3.319 0.005 2 599 60 60 ASN HB3 H 2.661 0.005 2 600 60 60 ASN C C 176.815 0.01 1 601 60 60 ASN CA C 52.713 0.01 1 602 60 60 ASN CB C 37.519 0.01 1 603 60 60 ASN N N 118.874 0.01 1 604 61 61 GLY H H 10.660 0.005 1 605 61 61 GLY HA2 H 4.306 0.005 2 606 61 61 GLY HA3 H 3.512 0.005 2 607 61 61 GLY C C 173.203 0.01 1 608 61 61 GLY CA C 45.553 0.01 1 609 61 61 GLY N N 113.678 0.01 1 610 62 62 THR H H 7.662 0.005 1 611 62 62 THR HA H 4.803 0.005 1 612 62 62 THR HB H 4.016 0.005 1 613 62 62 THR HG2 H 1.144 0.005 1 614 62 62 THR C C 173.126 0.01 1 615 62 62 THR CA C 59.355 0.01 1 616 62 62 THR CB C 72.466 0.01 1 617 62 62 THR CG2 C 22.370 0.01 1 618 62 62 THR N N 108.243 0.01 1 619 63 63 ILE H H 8.853 0.005 1 620 63 63 ILE HA H 5.383 0.005 1 621 63 63 ILE HB H 2.276 0.005 1 622 63 63 ILE HG12 H 1.365 0.005 2 623 63 63 ILE HG13 H 1.608 0.005 2 624 63 63 ILE HG2 H 1.227 0.005 1 625 63 63 ILE HD1 H 0.785 0.005 1 626 63 63 ILE C C 175.671 0.01 1 627 63 63 ILE CA C 57.734 0.01 1 628 63 63 ILE CB C 38.040 0.01 1 629 63 63 ILE CG1 C 27.492 0.01 1 630 63 63 ILE CG2 C 17.520 0.01 1 631 63 63 ILE CD1 C 10.774 0.01 1 632 63 63 ILE N N 124.719 0.01 1 633 64 64 ASP H H 8.847 0.005 1 634 64 64 ASP HA H 5.495 0.005 1 635 64 64 ASP HB2 H 3.197 0.005 2 636 64 64 ASP HB3 H 2.847 0.005 2 637 64 64 ASP C C 175.977 0.01 1 638 64 64 ASP CA C 51.985 0.01 1 639 64 64 ASP CB C 42.121 0.01 1 640 64 64 ASP N N 128.581 0.01 1 641 65 65 PHE H H 8.963 0.005 1 642 65 65 PHE HA H 3.997 0.005 1 643 65 65 PHE HB2 H 2.812 0.005 2 644 65 65 PHE HB3 H 2.074 0.005 2 645 65 65 PHE C C 173.633 0.01 1 646 65 65 PHE CA C 63.032 0.01 1 647 65 65 PHE CB C 35.818 0.01 1 648 65 65 PHE N N 118.224 0.01 1 649 66 66 PRO HA H 3.916 0.005 1 650 66 66 PRO HB2 H 2.240 0.005 2 651 66 66 PRO HB3 H 1.916 0.005 2 652 66 66 PRO HD2 H 3.771 0.005 2 653 66 66 PRO HD3 H 3.771 0.005 2 654 66 66 PRO C C 180.257 0.01 1 655 66 66 PRO CA C 66.825 0.01 1 656 66 66 PRO CB C 30.632 0.01 1 657 66 66 PRO CD C 49.052 0.01 1 658 67 67 GLU H H 8.413 0.005 1 659 67 67 GLU HA H 4.014 0.005 1 660 67 67 GLU HB2 H 2.043 0.005 2 661 67 67 GLU HB3 H 2.705 0.005 2 662 67 67 GLU HG2 H 3.058 0.005 2 663 67 67 GLU HG3 H 2.325 0.005 2 664 67 67 GLU C C 179.526 0.01 1 665 67 67 GLU CA C 59.283 0.01 1 666 67 67 GLU CB C 30.169 0.01 1 667 67 67 GLU CG C 37.677 0.01 1 668 67 67 GLU N N 118.122 0.01 1 669 68 68 PHE H H 8.749 0.005 1 670 68 68 PHE HA H 3.780 0.005 1 671 68 68 PHE HB2 H 3.108 0.005 2 672 68 68 PHE HB3 H 3.578 0.005 2 673 68 68 PHE C C 176.579 0.01 1 674 68 68 PHE CA C 61.139 0.01 1 675 68 68 PHE CB C 40.672 0.01 1 676 68 68 PHE N N 124.650 0.01 1 677 69 69 LEU H H 8.786 0.005 1 678 69 69 LEU HA H 3.394 0.005 1 679 69 69 LEU HB2 H 1.326 0.005 2 680 69 69 LEU HB3 H 1.209 0.005 2 681 69 69 LEU HG H 0.971 0.005 1 682 69 69 LEU HD1 H 0.698 0.005 2 683 69 69 LEU HD2 H 0.620 0.005 2 684 69 69 LEU C C 179.018 0.01 1 685 69 69 LEU CA C 57.713 0.01 1 686 69 69 LEU CB C 41.214 0.01 1 687 69 69 LEU CG C 25.812 0.01 1 688 69 69 LEU CD1 C 24.034 0.01 1 689 69 69 LEU CD2 C 25.141 0.01 1 690 69 69 LEU N N 119.318 0.01 1 691 70 70 THR H H 7.894 0.005 1 692 70 70 THR HA H 3.686 0.005 1 693 70 70 THR HB H 4.104 0.005 1 694 70 70 THR HG2 H 1.144 0.005 1 695 70 70 THR C C 176.446 0.01 1 696 70 70 THR CA C 66.725 0.01 1 697 70 70 THR CB C 68.387 0.01 1 698 70 70 THR CG2 C 21.984 0.01 1 699 70 70 THR N N 115.524 0.01 1 700 71 71 MET H H 7.516 0.005 1 701 71 71 MET HA H 3.918 0.005 1 702 71 71 MET HB2 H 1.799 0.005 2 703 71 71 MET HB3 H 1.799 0.005 2 704 71 71 MET HG2 H 2.242 0.005 2 705 71 71 MET HG3 H 2.065 0.005 2 706 71 71 MET C C 177.603 0.01 1 707 71 71 MET CA C 58.304 0.01 1 708 71 71 MET CB C 31.556 0.01 1 709 71 71 MET CG C 30.586 0.01 1 710 71 71 MET N N 120.070 0.01 1 711 72 72 MET H H 7.406 0.005 1 712 72 72 MET HA H 4.222 0.005 1 713 72 72 MET HB2 H 1.050 0.005 2 714 72 72 MET HB3 H 1.050 0.005 2 715 72 72 MET HG2 H 1.316 0.005 2 716 72 72 MET HG3 H 1.316 0.005 2 717 72 72 MET C C 177.764 0.01 1 718 72 72 MET CA C 54.423 0.01 1 719 72 72 MET CB C 28.712 0.01 1 720 72 72 MET CG C 30.186 0.01 1 721 72 72 MET N N 115.045 0.01 1 722 73 73 ALA H H 7.913 0.005 1 723 73 73 ALA HA H 4.175 0.005 1 724 73 73 ALA HB H 1.405 0.005 1 725 73 73 ALA C C 178.107 0.01 1 726 73 73 ALA CA C 53.097 0.01 1 727 73 73 ALA CB C 18.711 0.01 1 728 73 73 ALA N N 121.437 0.01 1 729 74 74 ARG H H 7.198 0.005 1 730 74 74 ARG HA H 4.160 0.005 1 731 74 74 ARG HB2 H 1.810 0.005 2 732 74 74 ARG HB3 H 1.810 0.005 2 733 74 74 ARG HG2 H 1.803 0.005 2 734 74 74 ARG HG3 H 1.628 0.005 2 735 74 74 ARG HD2 H 3.179 0.005 2 736 74 74 ARG HD3 H 3.179 0.005 2 737 74 74 ARG C C 176.591 0.01 1 738 74 74 ARG CA C 56.833 0.01 1 739 74 74 ARG CB C 30.324 0.01 1 740 74 74 ARG CG C 26.808 0.01 1 741 74 74 ARG CD C 43.523 0.01 1 742 74 74 ARG N N 117.506 0.01 1 743 75 75 LYS H H 8.126 0.005 1 744 75 75 LYS HA H 4.288 0.005 1 745 75 75 LYS HB2 H 1.861 0.005 2 746 75 75 LYS HB3 H 1.723 0.005 2 747 75 75 LYS HG2 H 1.440 0.005 2 748 75 75 LYS HG3 H 1.440 0.005 2 749 75 75 LYS HD2 H 1.670 0.005 2 750 75 75 LYS HD3 H 1.670 0.005 2 751 75 75 LYS HE2 H 2.854 0.005 2 752 75 75 LYS HE3 H 2.639 0.005 2 753 75 75 LYS C C 176.815 0.01 1 754 75 75 LYS CA C 56.253 0.01 1 755 75 75 LYS CB C 32.362 0.01 1 756 75 75 LYS CG C 24.554 0.01 1 757 75 75 LYS CD C 28.770 0.01 1 758 75 75 LYS CE C 41.533 0.01 1 759 75 75 LYS N N 122.839 0.01 1 760 76 76 MET H H 8.310 0.005 1 761 76 76 MET HA H 4.457 0.005 1 762 76 76 MET HB2 H 2.015 0.005 2 763 76 76 MET HB3 H 2.603 0.005 2 764 76 76 MET C C 176.384 0.01 1 765 76 76 MET CA C 55.615 0.01 1 766 76 76 MET CB C 32.511 0.01 1 767 76 76 MET N N 122.565 0.01 1 768 77 77 LYS HA H 4.345 0.005 1 769 77 77 LYS HB2 H 1.950 0.005 2 770 77 77 LYS HB3 H 1.828 0.005 2 771 77 77 LYS HG2 H 1.453 0.005 2 772 77 77 LYS HG3 H 1.453 0.005 2 773 77 77 LYS HD2 H 1.694 0.005 2 774 77 77 LYS HD3 H 1.694 0.005 2 775 77 77 LYS HE2 H 3.002 0.005 2 776 77 77 LYS HE3 H 3.002 0.005 2 777 77 77 LYS CA C 56.518 0.01 1 778 77 77 LYS CB C 32.724 0.01 1 779 77 77 LYS CG C 24.718 0.01 1 780 77 77 LYS CD C 28.945 0.01 1 781 77 77 LYS CE C 41.986 0.01 1 782 78 78 ASP HA H 4.685 0.005 1 783 78 78 ASP HB2 H 2.755 0.005 2 784 78 78 ASP HB3 H 2.755 0.005 2 785 78 78 ASP C C 175.980 0.01 1 786 78 78 ASP CA C 53.884 0.01 1 787 78 78 ASP CB C 41.311 0.01 1 788 79 79 THR H H 7.894 0.005 1 789 79 79 THR HA H 4.302 0.005 1 790 79 79 THR HB H 4.239 0.005 1 791 79 79 THR HG2 H 1.203 0.005 1 792 79 79 THR C C 174.532 0.01 1 793 79 79 THR CA C 62.045 0.01 1 794 79 79 THR CB C 69.669 0.01 1 795 79 79 THR CG2 C 21.437 0.01 1 796 79 79 THR N N 112.858 0.01 1 797 80 80 ASP H H 8.280 0.005 1 798 80 80 ASP HA H 4.887 0.005 1 799 80 80 ASP HB2 H 2.659 0.005 2 800 80 80 ASP HB3 H 2.509 0.005 2 801 80 80 ASP C C 175.655 0.01 1 802 80 80 ASP CA C 54.473 0.01 1 803 80 80 ASP CB C 41.358 0.01 1 804 80 80 ASP N N 122.994 0.01 1 805 81 81 SER H H 8.550 0.005 1 806 81 81 SER HA H 4.404 0.005 1 807 81 81 SER HB2 H 4.036 0.005 2 808 81 81 SER HB3 H 3.946 0.005 2 809 81 81 SER C C 175.549 0.01 1 810 81 81 SER CA C 59.760 0.01 1 811 81 81 SER CB C 63.811 0.01 1 812 81 81 SER N N 117.744 0.01 1 813 82 82 GLU H H 8.474 0.005 1 814 82 82 GLU HA H 4.090 0.005 1 815 82 82 GLU HB2 H 2.101 0.005 2 816 82 82 GLU HB3 H 2.101 0.005 2 817 82 82 GLU HG2 H 2.350 0.005 2 818 82 82 GLU HG3 H 2.350 0.005 2 819 82 82 GLU C C 178.370 0.01 1 820 82 82 GLU CA C 59.300 0.01 1 821 82 82 GLU CB C 29.279 0.01 1 822 82 82 GLU CG C 36.571 0.01 1 823 82 82 GLU N N 121.984 0.01 1 824 83 83 GLU H H 8.120 0.005 1 825 83 83 GLU HA H 3.984 0.005 1 826 83 83 GLU HB2 H 2.132 0.005 2 827 83 83 GLU HB3 H 2.132 0.005 2 828 83 83 GLU HG2 H 2.312 0.005 2 829 83 83 GLU HG3 H 2.386 0.005 2 830 83 83 GLU C C 178.721 0.01 1 831 83 83 GLU CA C 59.514 0.01 1 832 83 83 GLU CB C 29.080 0.01 1 833 83 83 GLU CG C 36.042 0.01 1 834 83 83 GLU N N 119.181 0.01 1 835 84 84 GLU H H 7.656 0.005 1 836 84 84 GLU HA H 4.054 0.005 1 837 84 84 GLU HB2 H 1.923 0.005 2 838 84 84 GLU HB3 H 1.923 0.005 2 839 84 84 GLU HG2 H 2.305 0.005 2 840 84 84 GLU HG3 H 2.305 0.005 2 841 84 84 GLU C C 178.606 0.01 1 842 84 84 GLU CA C 59.609 0.01 1 843 84 84 GLU CB C 29.193 0.01 1 844 84 84 GLU CG C 36.475 0.01 1 845 84 84 GLU N N 118.840 0.01 1 846 85 85 ILE H H 7.864 0.005 1 847 85 85 ILE HA H 3.917 0.005 1 848 85 85 ILE HB H 2.203 0.005 1 849 85 85 ILE HG12 H 1.818 0.005 2 850 85 85 ILE HG13 H 1.091 0.005 2 851 85 85 ILE HG2 H 1.145 0.005 1 852 85 85 ILE HD1 H 0.770 0.005 1 853 85 85 ILE C C 178.459 0.01 1 854 85 85 ILE CA C 65.457 0.01 1 855 85 85 ILE CB C 37.122 0.01 1 856 85 85 ILE CG1 C 29.229 0.01 1 857 85 85 ILE CG2 C 18.976 0.01 1 858 85 85 ILE CD1 C 12.824 0.01 1 859 85 85 ILE N N 120.617 0.01 1 860 86 86 ARG H H 8.279 0.005 1 861 86 86 ARG HA H 4.131 0.005 1 862 86 86 ARG HB2 H 2.070 0.005 2 863 86 86 ARG HB3 H 1.876 0.005 2 864 86 86 ARG HG2 H 1.555 0.005 2 865 86 86 ARG HG3 H 1.555 0.005 2 866 86 86 ARG HD2 H 2.953 0.005 2 867 86 86 ARG HD3 H 2.953 0.005 2 868 86 86 ARG C C 179.286 0.01 1 869 86 86 ARG CA C 59.971 0.01 1 870 86 86 ARG CB C 29.826 0.01 1 871 86 86 ARG CG C 26.889 0.01 1 872 86 86 ARG CD C 42.890 0.01 1 873 86 86 ARG N N 121.096 0.01 1 874 87 87 GLU H H 7.992 0.005 1 875 87 87 GLU HA H 4.113 0.005 1 876 87 87 GLU HB2 H 2.156 0.005 2 877 87 87 GLU HB3 H 2.056 0.005 2 878 87 87 GLU HG2 H 2.495 0.005 2 879 87 87 GLU HG3 H 2.374 0.005 2 880 87 87 GLU C C 179.289 0.01 1 881 87 87 GLU CA C 59.360 0.01 1 882 87 87 GLU CB C 29.200 0.01 1 883 87 87 GLU CG C 36.574 0.01 1 884 87 87 GLU N N 117.951 0.01 1 885 88 88 ALA H H 8.316 0.005 1 886 88 88 ALA HA H 4.062 0.005 1 887 88 88 ALA HB H 1.855 0.005 1 888 88 88 ALA C C 178.442 0.01 1 889 88 88 ALA CA C 55.552 0.01 1 890 88 88 ALA CB C 17.990 0.01 1 891 88 88 ALA N N 121.984 0.01 1 892 89 89 PHE H H 8.474 0.005 1 893 89 89 PHE HA H 3.332 0.005 1 894 89 89 PHE HB2 H 3.256 0.005 2 895 89 89 PHE HB3 H 3.047 0.005 2 896 89 89 PHE HD1 H 6.680 0.005 1 897 89 89 PHE HD2 H 6.680 0.005 1 898 89 89 PHE HE1 H 7.120 0.005 1 899 89 89 PHE HE2 H 7.120 0.005 1 900 89 89 PHE HZ H 7.290 0.005 1 901 89 89 PHE C C 176.911 0.01 1 902 89 89 PHE CA C 62.138 0.01 1 903 89 89 PHE CB C 39.391 0.01 1 904 89 89 PHE N N 118.258 0.01 1 905 90 90 ARG H H 7.785 0.005 1 906 90 90 ARG HA H 3.897 0.005 1 907 90 90 ARG HB2 H 1.998 0.005 2 908 90 90 ARG HB3 H 1.998 0.005 2 909 90 90 ARG HG2 H 1.765 0.005 2 910 90 90 ARG HG3 H 1.765 0.005 2 911 90 90 ARG HD2 H 3.249 0.005 2 912 90 90 ARG HD3 H 3.249 0.005 2 913 90 90 ARG C C 178.004 0.01 1 914 90 90 ARG CA C 58.800 0.01 1 915 90 90 ARG CB C 30.567 0.01 1 916 90 90 ARG CG C 27.943 0.01 1 917 90 90 ARG CD C 43.511 0.01 1 918 90 90 ARG N N 115.797 0.01 1 919 91 91 VAL H H 7.552 0.005 1 920 91 91 VAL HA H 3.518 0.005 1 921 91 91 VAL HB H 2.204 0.005 1 922 91 91 VAL HG1 H 1.098 0.005 2 923 91 91 VAL HG2 H 0.645 0.005 2 924 91 91 VAL C C 176.896 0.01 1 925 91 91 VAL CA C 65.795 0.01 1 926 91 91 VAL CB C 30.924 0.01 1 927 91 91 VAL CG1 C 23.078 0.01 1 928 91 91 VAL CG2 C 21.437 0.01 1 929 91 91 VAL N N 118.703 0.01 1 930 92 92 PHE H H 7.095 0.005 1 931 92 92 PHE HA H 4.296 0.005 1 932 92 92 PHE HB2 H 2.855 0.005 2 933 92 92 PHE HB3 H 2.626 0.005 2 934 92 92 PHE C C 177.167 0.01 1 935 92 92 PHE CA C 60.000 0.01 1 936 92 92 PHE CB C 41.540 0.01 1 937 92 92 PHE N N 113.917 0.01 1 938 93 93 ASP H H 7.907 0.005 1 939 93 93 ASP HA H 4.664 0.005 1 940 93 93 ASP HB2 H 2.343 0.005 2 941 93 93 ASP HB3 H 1.477 0.005 2 942 93 93 ASP C C 177.718 0.01 1 943 93 93 ASP CA C 52.534 0.01 1 944 93 93 ASP CB C 38.573 0.01 1 945 93 93 ASP N N 116.071 0.01 1 946 94 94 LYS H H 8.065 0.005 1 947 94 94 LYS HA H 3.982 0.005 1 948 94 94 LYS HB2 H 1.910 0.005 2 949 94 94 LYS HB3 H 1.910 0.005 2 950 94 94 LYS HG2 H 1.530 0.005 2 951 94 94 LYS HG3 H 1.530 0.005 2 952 94 94 LYS HD2 H 1.660 0.005 2 953 94 94 LYS HD3 H 1.660 0.005 2 954 94 94 LYS HE2 H 2.996 0.005 2 955 94 94 LYS HE3 H 2.996 0.005 2 956 94 94 LYS C C 178.373 0.01 1 957 94 94 LYS CA C 58.600 0.01 1 958 94 94 LYS CB C 32.381 0.01 1 959 94 94 LYS CG C 24.104 0.01 1 960 94 94 LYS CD C 28.226 0.01 1 961 94 94 LYS CE C 41.742 0.01 1 962 94 94 LYS N N 126.223 0.01 1 963 95 95 ASP H H 8.187 0.005 1 964 95 95 ASP HA H 4.585 0.005 1 965 95 95 ASP HB2 H 3.104 0.005 2 966 95 95 ASP HB3 H 2.670 0.005 2 967 95 95 ASP C C 177.677 0.01 1 968 95 95 ASP CA C 52.918 0.01 1 969 95 95 ASP CB C 39.422 0.01 1 970 95 95 ASP N N 114.225 0.01 1 971 96 96 GLY H H 7.785 0.005 1 972 96 96 GLY HA2 H 3.856 0.005 2 973 96 96 GLY HA3 H 3.856 0.005 2 974 96 96 GLY C C 175.137 0.01 1 975 96 96 GLY CA C 47.103 0.01 1 976 96 96 GLY N N 109.166 0.01 1 977 97 97 ASN H H 8.401 0.005 1 978 97 97 ASN HA H 4.683 0.005 1 979 97 97 ASN HB2 H 3.450 0.005 2 980 97 97 ASN HB3 H 2.688 0.005 2 981 97 97 ASN C C 176.165 0.01 1 982 97 97 ASN CA C 52.537 0.01 1 983 97 97 ASN CB C 38.068 0.01 1 984 97 97 ASN N N 119.694 0.01 1 985 98 98 GLY H H 10.630 0.005 1 986 98 98 GLY HA2 H 4.130 0.005 2 987 98 98 GLY HA3 H 3.504 0.005 2 988 98 98 GLY C C 172.855 0.01 1 989 98 98 GLY CA C 45.003 0.01 1 990 98 98 GLY N N 112.584 0.01 1 991 99 99 TYR H H 7.711 0.005 1 992 99 99 TYR HA H 5.092 0.005 1 993 99 99 TYR HB2 H 2.598 0.005 2 994 99 99 TYR HB3 H 2.553 0.005 2 995 99 99 TYR HD1 H 6.921 0.005 1 996 99 99 TYR HD2 H 6.921 0.005 1 997 99 99 TYR HE1 H 6.771 0.005 1 998 99 99 TYR HE2 H 6.771 0.005 1 999 99 99 TYR C C 175.006 0.01 1 1000 99 99 TYR CA C 56.160 0.01 1 1001 99 99 TYR CB C 42.663 0.01 1 1002 99 99 TYR N N 116.242 0.01 1 1003 100 100 ILE H H 10.149 0.005 1 1004 100 100 ILE HA H 4.667 0.005 1 1005 100 100 ILE HB H 1.884 0.005 1 1006 100 100 ILE HG12 H 1.360 0.005 2 1007 100 100 ILE HG13 H 0.218 0.005 2 1008 100 100 ILE HG2 H 0.933 0.005 1 1009 100 100 ILE HD1 H 0.389 0.005 1 1010 100 100 ILE C C 175.385 0.01 1 1011 100 100 ILE CA C 61.231 0.01 1 1012 100 100 ILE CB C 39.619 0.01 1 1013 100 100 ILE CG1 C 26.769 0.01 1 1014 100 100 ILE CG2 C 17.119 0.01 1 1015 100 100 ILE CD1 C 15.695 0.01 1 1016 100 100 ILE N N 127.189 0.01 1 1017 101 101 SER H H 8.969 0.005 1 1018 101 101 SER HA H 4.917 0.005 1 1019 101 101 SER HB2 H 4.452 0.005 2 1020 101 101 SER HB3 H 3.977 0.005 2 1021 101 101 SER C C 175.340 0.01 1 1022 101 101 SER CA C 55.534 0.01 1 1023 101 101 SER CB C 67.049 0.01 1 1024 101 101 SER N N 123.557 0.01 1 1025 102 102 ALA H H 9.225 0.005 1 1026 102 102 ALA HA H 3.883 0.005 1 1027 102 102 ALA HB H 1.492 0.005 1 1028 102 102 ALA C C 179.309 0.01 1 1029 102 102 ALA CA C 55.716 0.01 1 1030 102 102 ALA CB C 17.870 0.01 1 1031 102 102 ALA N N 123.078 0.01 1 1032 103 103 ALA H H 8.218 0.005 1 1033 103 103 ALA HA H 4.049 0.005 1 1034 103 103 ALA HB H 1.435 0.005 1 1035 103 103 ALA C C 181.402 0.01 1 1036 103 103 ALA CA C 55.337 0.01 1 1037 103 103 ALA CB C 18.144 0.01 1 1038 103 103 ALA N N 118.429 0.01 1 1039 104 104 GLU H H 7.919 0.005 1 1040 104 104 GLU HA H 4.023 0.005 1 1041 104 104 GLU HB2 H 2.047 0.005 2 1042 104 104 GLU HB3 H 2.047 0.005 2 1043 104 104 GLU HG2 H 2.346 0.005 2 1044 104 104 GLU HG3 H 2.346 0.005 2 1045 104 104 GLU C C 179.247 0.01 1 1046 104 104 GLU CA C 59.444 0.01 1 1047 104 104 GLU CB C 28.761 0.01 1 1048 104 104 GLU CG C 35.720 0.01 1 1049 104 104 GLU N N 120.494 0.01 1 1050 105 105 LEU H H 8.261 0.005 1 1051 105 105 LEU HA H 4.147 0.005 1 1052 105 105 LEU HB2 H 1.770 0.005 2 1053 105 105 LEU HB3 H 1.320 0.005 2 1054 105 105 LEU HG H 1.220 0.005 1 1055 105 105 LEU HD1 H 0.418 0.005 2 1056 105 105 LEU HD2 H 0.298 0.005 2 1057 105 105 LEU C C 178.398 0.01 1 1058 105 105 LEU CA C 58.720 0.01 1 1059 105 105 LEU CB C 42.063 0.01 1 1060 105 105 LEU CG C 27.042 0.01 1 1061 105 105 LEU CD1 C 25.675 0.01 1 1062 105 105 LEU CD2 C 24.855 0.01 1 1063 105 105 LEU N N 120.959 0.01 1 1064 106 106 ARG H H 8.615 0.005 1 1065 106 106 ARG HA H 3.706 0.005 1 1066 106 106 ARG HB2 H 1.948 0.005 2 1067 106 106 ARG HB3 H 1.948 0.005 2 1068 106 106 ARG HG2 H 1.626 0.005 2 1069 106 106 ARG HG3 H 1.626 0.005 2 1070 106 106 ARG HD2 H 3.209 0.005 2 1071 106 106 ARG HD3 H 3.269 0.005 2 1072 106 106 ARG C C 178.828 0.01 1 1073 106 106 ARG CA C 59.964 0.01 1 1074 106 106 ARG CB C 30.433 0.01 1 1075 106 106 ARG CG C 27.862 0.01 1 1076 106 106 ARG CD C 43.433 0.01 1 1077 106 106 ARG N N 117.575 0.01 1 1078 107 107 HIS H H 8.161 0.005 1 1079 107 107 HIS HA H 4.235 0.005 1 1080 107 107 HIS HB2 H 3.409 0.005 2 1081 107 107 HIS HB3 H 3.305 0.005 2 1082 107 107 HIS C C 177.472 0.01 1 1083 107 107 HIS CA C 60.037 0.01 1 1084 107 107 HIS CB C 30.389 0.01 1 1085 107 107 HIS N N 119.933 0.01 1 1086 108 108 VAL H H 7.901 0.005 1 1087 108 108 VAL HA H 3.617 0.005 1 1088 108 108 VAL HB H 2.132 0.005 1 1089 108 108 VAL HG1 H 1.098 0.005 2 1090 108 108 VAL HG2 H 0.584 0.005 2 1091 108 108 VAL C C 178.048 0.01 1 1092 108 108 VAL CA C 66.876 0.01 1 1093 108 108 VAL CB C 31.885 0.01 1 1094 108 108 VAL CG1 C 24.308 0.01 1 1095 108 108 VAL CG2 C 21.027 0.01 1 1096 108 108 VAL N N 118.566 0.01 1 1097 109 109 MET H H 8.145 0.005 1 1098 109 109 MET HA H 4.219 0.005 1 1099 109 109 MET HB2 H 2.124 0.005 2 1100 109 109 MET HB3 H 1.922 0.005 2 1101 109 109 MET HG2 H 2.464 0.005 2 1102 109 109 MET HG3 H 2.787 0.005 2 1103 109 109 MET C C 179.009 0.01 1 1104 109 109 MET CA C 57.750 0.01 1 1105 109 109 MET CB C 30.584 0.01 1 1106 109 109 MET CG C 33.148 0.01 1 1107 109 109 MET N N 115.148 0.01 1 1108 110 110 THR H H 8.450 0.005 1 1109 110 110 THR HA H 4.059 0.005 1 1110 110 110 THR HB H 4.263 0.005 1 1111 110 110 THR HG2 H 1.252 0.005 1 1112 110 110 THR C C 178.326 0.01 1 1113 110 110 THR CA C 66.486 0.01 1 1114 110 110 THR CB C 68.538 0.01 1 1115 110 110 THR CG2 C 21.984 0.01 1 1116 110 110 THR N N 115.421 0.01 1 1117 111 111 ASN H H 7.907 0.005 1 1118 111 111 ASN HA H 4.434 0.005 1 1119 111 111 ASN HB2 H 2.957 0.005 2 1120 111 111 ASN HB3 H 2.771 0.005 2 1121 111 111 ASN C C 176.816 0.01 1 1122 111 111 ASN CA C 55.842 0.01 1 1123 111 111 ASN CB C 37.701 0.01 1 1124 111 111 ASN N N 122.805 0.01 1 1125 112 112 LEU H H 7.736 0.005 1 1126 112 112 LEU HA H 4.283 0.005 1 1127 112 112 LEU HB2 H 1.765 0.005 2 1128 112 112 LEU HB3 H 1.765 0.005 2 1129 112 112 LEU HG H 1.773 0.005 1 1130 112 112 LEU HD1 H 0.826 0.005 2 1131 112 112 LEU HD2 H 0.784 0.005 2 1132 112 112 LEU C C 176.636 0.01 1 1133 112 112 LEU CA C 55.131 0.01 1 1134 112 112 LEU CB C 42.235 0.01 1 1135 112 112 LEU CG C 26.769 0.01 1 1136 112 112 LEU CD1 C 25.218 0.01 1 1137 112 112 LEU CD2 C 23.451 0.01 1 1138 112 112 LEU N N 119.010 0.01 1 1139 113 113 GLY H H 7.675 0.005 1 1140 113 113 GLY HA2 H 4.240 0.005 2 1141 113 113 GLY HA3 H 3.698 0.005 2 1142 113 113 GLY C C 174.569 0.01 1 1143 113 113 GLY CA C 45.330 0.01 1 1144 113 113 GLY N N 105.680 0.01 1 1145 114 114 GLU H H 7.913 0.005 1 1146 114 114 GLU HA H 4.382 0.005 1 1147 114 114 GLU HB2 H 1.878 0.005 2 1148 114 114 GLU HB3 H 1.609 0.005 2 1149 114 114 GLU HG2 H 2.083 0.005 2 1150 114 114 GLU HG3 H 2.083 0.005 2 1151 114 114 GLU C C 175.364 0.01 1 1152 114 114 GLU CA C 54.993 0.01 1 1153 114 114 GLU CB C 30.300 0.01 1 1154 114 114 GLU CG C 34.691 0.01 1 1155 114 114 GLU N N 120.549 0.01 1 1156 115 115 LYS H H 8.505 0.005 1 1157 115 115 LYS HA H 4.394 0.005 1 1158 115 115 LYS HB2 H 1.738 0.005 2 1159 115 115 LYS HB3 H 1.700 0.005 2 1160 115 115 LYS HG2 H 1.400 0.005 2 1161 115 115 LYS HG3 H 1.310 0.005 2 1162 115 115 LYS HD2 H 1.680 0.005 2 1163 115 115 LYS HD3 H 1.680 0.005 2 1164 115 115 LYS HE2 H 2.987 0.005 2 1165 115 115 LYS HE3 H 2.987 0.005 2 1166 115 115 LYS C C 175.393 0.01 1 1167 115 115 LYS CA C 55.432 0.01 1 1168 115 115 LYS CB C 31.845 0.01 1 1169 115 115 LYS CG C 24.569 0.01 1 1170 115 115 LYS CD C 28.908 0.01 1 1171 115 115 LYS CE C 41.947 0.01 1 1172 115 115 LYS N N 124.650 0.01 1 1173 116 116 LEU H H 8.035 0.005 1 1174 116 116 LEU HA H 4.839 0.005 1 1175 116 116 LEU HB2 H 1.585 0.005 2 1176 116 116 LEU HB3 H 1.499 0.005 2 1177 116 116 LEU HG H 1.548 0.005 1 1178 116 116 LEU HD1 H 0.816 0.005 2 1179 116 116 LEU HD2 H 0.781 0.005 2 1180 116 116 LEU C C 177.901 0.01 1 1181 116 116 LEU CA C 53.923 0.01 1 1182 116 116 LEU CB C 44.872 0.01 1 1183 116 116 LEU CG C 27.091 0.01 1 1184 116 116 LEU CD1 C 23.867 0.01 1 1185 116 116 LEU CD2 C 27.042 0.01 1 1186 116 116 LEU N N 125.026 0.01 1 1187 117 117 THR H H 9.036 0.005 1 1188 117 117 THR HA H 4.496 0.005 1 1189 117 117 THR HB H 4.743 0.005 1 1190 117 117 THR HG2 H 1.332 0.005 1 1191 117 117 THR C C 175.561 0.01 1 1192 117 117 THR CA C 60.538 0.01 1 1193 117 117 THR CB C 71.251 0.01 1 1194 117 117 THR CG2 C 21.984 0.01 1 1195 117 117 THR N N 114.054 0.01 1 1196 118 118 ASP H H 8.853 0.005 1 1197 118 118 ASP HA H 4.235 0.005 1 1198 118 118 ASP HB2 H 2.758 0.005 2 1199 118 118 ASP HB3 H 2.602 0.005 2 1200 118 118 ASP C C 178.599 0.01 1 1201 118 118 ASP CA C 57.917 0.01 1 1202 118 118 ASP CB C 39.615 0.01 1 1203 118 118 ASP N N 121.061 0.01 1 1204 119 119 GLU H H 8.658 0.005 1 1205 119 119 GLU HA H 4.106 0.005 1 1206 119 119 GLU HB2 H 2.060 0.005 2 1207 119 119 GLU HB3 H 2.060 0.005 2 1208 119 119 GLU HG2 H 2.328 0.005 2 1209 119 119 GLU HG3 H 2.328 0.005 2 1210 119 119 GLU C C 179.092 0.01 1 1211 119 119 GLU CA C 59.961 0.01 1 1212 119 119 GLU CB C 29.022 0.01 1 1213 119 119 GLU CG C 36.358 0.01 1 1214 119 119 GLU N N 119.216 0.01 1 1215 120 120 GLU H H 7.705 0.005 1 1216 120 120 GLU HA H 4.035 0.005 1 1217 120 120 GLU HB2 H 2.374 0.005 2 1218 120 120 GLU HB3 H 1.951 0.005 2 1219 120 120 GLU HG2 H 2.274 0.005 2 1220 120 120 GLU HG3 H 2.274 0.005 2 1221 120 120 GLU C C 179.919 0.01 1 1222 120 120 GLU CA C 59.210 0.01 1 1223 120 120 GLU CB C 30.376 0.01 1 1224 120 120 GLU CG C 38.093 0.01 1 1225 120 120 GLU N N 120.070 0.01 1 1226 121 121 VAL HA H 3.600 0.005 1 1227 121 121 VAL HB H 2.123 0.005 1 1228 121 121 VAL HG1 H 1.035 0.005 2 1229 121 121 VAL HG2 H 0.613 0.005 2 1230 121 121 VAL CA C 66.930 0.01 1 1231 121 121 VAL CB C 31.976 0.01 1 1232 121 121 VAL CG1 C 23.227 0.01 1 1233 121 121 VAL CG2 C 20.356 0.01 1 1234 122 122 ASP H H 8.054 0.005 1 1235 122 122 ASP HA H 4.205 0.005 1 1236 122 122 ASP HB2 H 2.747 0.005 2 1237 122 122 ASP HB3 H 2.596 0.005 2 1238 122 122 ASP C C 179.031 0.01 1 1239 122 122 ASP CA C 57.779 0.01 1 1240 122 122 ASP CB C 39.461 0.01 1 1241 122 122 ASP N N 119.993 0.01 1 1242 123 123 GLU H H 8.572 0.005 1 1243 123 123 GLU HA H 3.989 0.005 1 1244 123 123 GLU HB2 H 2.124 0.005 2 1245 123 123 GLU HB3 H 2.052 0.005 2 1246 123 123 GLU HG2 H 2.400 0.005 2 1247 123 123 GLU HG3 H 2.321 0.005 2 1248 123 123 GLU C C 179.142 0.01 1 1249 123 123 GLU CA C 59.378 0.01 1 1250 123 123 GLU CB C 29.222 0.01 1 1251 123 123 GLU CG C 36.061 0.01 1 1252 123 123 GLU N N 119.079 0.01 1 1253 124 124 MET H H 7.833 0.005 1 1254 124 124 MET HA H 4.168 0.005 1 1255 124 124 MET HB2 H 2.950 0.005 2 1256 124 124 MET HB3 H 2.950 0.005 2 1257 124 124 MET HG2 H 2.500 0.005 2 1258 124 124 MET HG3 H 2.336 0.005 2 1259 124 124 MET C C 178.484 0.01 1 1260 124 124 MET CA C 59.049 0.01 1 1261 124 124 MET CB C 33.137 0.01 1 1262 124 124 MET N N 119.762 0.01 1 1263 125 125 ILE H H 7.994 0.005 1 1264 125 125 ILE HA H 3.764 0.005 1 1265 125 125 ILE HB H 2.252 0.005 1 1266 125 125 ILE HG12 H 1.477 0.005 2 1267 125 125 ILE HG13 H 1.477 0.005 2 1268 125 125 ILE HG2 H 0.774 0.005 1 1269 125 125 ILE HD1 H 0.703 0.005 1 1270 125 125 ILE C C 177.810 0.01 1 1271 125 125 ILE CA C 63.294 0.01 1 1272 125 125 ILE CB C 35.000 0.01 1 1273 125 125 ILE CG1 C 27.726 0.01 1 1274 125 125 ILE CG2 C 16.379 0.01 1 1275 125 125 ILE CD1 C 9.954 0.01 1 1276 125 125 ILE N N 117.869 0.01 1 1277 126 126 ARG H H 8.401 0.005 1 1278 126 126 ARG HA H 4.043 0.005 1 1279 126 126 ARG HB2 H 1.941 0.005 2 1280 126 126 ARG HB3 H 1.941 0.005 2 1281 126 126 ARG HG2 H 1.640 0.005 2 1282 126 126 ARG HG3 H 1.640 0.005 2 1283 126 126 ARG HD2 H 3.258 0.005 2 1284 126 126 ARG HD3 H 3.200 0.005 2 1285 126 126 ARG C C 178.913 0.01 1 1286 126 126 ARG CA C 59.668 0.01 1 1287 126 126 ARG CB C 30.180 0.01 1 1288 126 126 ARG CG C 27.490 0.01 1 1289 126 126 ARG CD C 43.222 0.01 1 1290 126 126 ARG N N 118.532 0.01 1 1291 127 127 GLU H H 8.022 0.005 1 1292 127 127 GLU HA H 4.048 0.005 1 1293 127 127 GLU HB2 H 2.241 0.005 2 1294 127 127 GLU HB3 H 2.133 0.005 2 1295 127 127 GLU HG2 H 2.454 0.005 2 1296 127 127 GLU HG3 H 2.454 0.005 2 1297 127 127 GLU C C 177.023 0.01 1 1298 127 127 GLU CA C 58.587 0.01 1 1299 127 127 GLU CB C 29.515 0.01 1 1300 127 127 GLU CG C 35.726 0.01 1 1301 127 127 GLU N N 116.584 0.01 1 1302 128 128 ALA H H 7.247 0.005 1 1303 128 128 ALA HA H 4.512 0.005 1 1304 128 128 ALA HB H 1.495 0.005 1 1305 128 128 ALA C C 177.572 0.01 1 1306 128 128 ALA CA C 51.635 0.01 1 1307 128 128 ALA CB C 21.849 0.01 1 1308 128 128 ALA N N 118.053 0.01 1 1309 129 129 ASP H H 8.012 0.005 1 1310 129 129 ASP HA H 4.517 0.005 1 1311 129 129 ASP HB2 H 2.865 0.005 2 1312 129 129 ASP HB3 H 2.525 0.005 2 1313 129 129 ASP C C 175.830 0.01 1 1314 129 129 ASP CA C 54.446 0.01 1 1315 129 129 ASP CB C 40.863 0.01 1 1316 129 129 ASP N N 117.944 0.01 1 1317 130 130 ILE H H 8.310 0.005 1 1318 130 130 ILE HA H 3.966 0.005 1 1319 130 130 ILE HB H 2.000 0.005 1 1320 130 130 ILE HG12 H 1.708 0.005 2 1321 130 130 ILE HG13 H 1.305 0.005 2 1322 130 130 ILE HG2 H 0.951 0.005 1 1323 130 130 ILE HD1 H 0.897 0.005 1 1324 130 130 ILE C C 177.873 0.01 1 1325 130 130 ILE CA C 63.354 0.01 1 1326 130 130 ILE CB C 38.570 0.01 1 1327 130 130 ILE CG1 C 27.726 0.01 1 1328 130 130 ILE CG2 C 17.336 0.01 1 1329 130 130 ILE CD1 C 12.414 0.01 1 1330 130 130 ILE N N 127.864 0.01 1 1331 131 131 ASP H H 8.371 0.005 1 1332 131 131 ASP HA H 4.536 0.005 1 1333 131 131 ASP HB2 H 3.100 0.005 2 1334 131 131 ASP HB3 H 2.679 0.005 2 1335 131 131 ASP C C 178.296 0.01 1 1336 131 131 ASP CA C 53.907 0.01 1 1337 131 131 ASP CB C 39.835 0.01 1 1338 131 131 ASP N N 116.960 0.01 1 1339 132 132 GLY H H 7.662 0.005 1 1340 132 132 GLY HA2 H 4.013 0.005 2 1341 132 132 GLY HA3 H 3.832 0.005 2 1342 132 132 GLY C C 175.301 0.01 1 1343 132 132 GLY CA C 47.463 0.01 1 1344 132 132 GLY N N 108.243 0.01 1 1345 133 133 ASP H H 8.395 0.005 1 1346 133 133 ASP HA H 4.490 0.005 1 1347 133 133 ASP HB2 H 2.985 0.005 2 1348 133 133 ASP HB3 H 2.546 0.005 2 1349 133 133 ASP C C 177.550 0.01 1 1350 133 133 ASP CA C 53.596 0.01 1 1351 133 133 ASP CB C 40.022 0.01 1 1352 133 133 ASP N N 120.856 0.01 1 1353 134 134 GLY H H 10.208 0.005 1 1354 134 134 GLY HA2 H 4.071 0.005 2 1355 134 134 GLY HA3 H 3.450 0.005 2 1356 134 134 GLY C C 172.755 0.01 1 1357 134 134 GLY CA C 45.807 0.01 1 1358 134 134 GLY N N 112.653 0.01 1 1359 135 135 GLN H H 7.980 0.005 1 1360 135 135 GLN HA H 4.967 0.005 1 1361 135 135 GLN HB2 H 1.984 0.005 2 1362 135 135 GLN HB3 H 1.759 0.005 2 1363 135 135 GLN HG2 H 2.036 0.005 2 1364 135 135 GLN HG3 H 2.036 0.005 2 1365 135 135 GLN C C 175.153 0.01 1 1366 135 135 GLN CA C 53.192 0.01 1 1367 135 135 GLN CB C 32.300 0.01 1 1368 135 135 GLN CG C 33.188 0.01 1 1369 135 135 GLN N N 115.148 0.01 1 1370 136 136 VAL H H 9.103 0.005 1 1371 136 136 VAL HA H 5.209 0.005 1 1372 136 136 VAL HB H 2.373 0.005 1 1373 136 136 VAL HG1 H 1.254 0.005 2 1374 136 136 VAL HG2 H 1.157 0.005 2 1375 136 136 VAL C C 175.946 0.01 1 1376 136 136 VAL CA C 61.753 0.01 1 1377 136 136 VAL CB C 33.814 0.01 1 1378 136 136 VAL CG1 C 21.984 0.01 1 1379 136 136 VAL CG2 C 22.667 0.01 1 1380 136 136 VAL N N 125.539 0.01 1 1381 137 137 ASN H H 9.653 0.005 1 1382 137 137 ASN HA H 5.373 0.005 1 1383 137 137 ASN HB2 H 3.208 0.005 2 1384 137 137 ASN HB3 H 3.074 0.005 2 1385 137 137 ASN C C 174.888 0.01 1 1386 137 137 ASN CA C 51.126 0.01 1 1387 137 137 ASN CB C 38.430 0.01 1 1388 137 137 ASN N N 129.265 0.01 1 1389 138 138 TYR H H 8.273 0.005 1 1390 138 138 TYR HA H 3.410 0.005 1 1391 138 138 TYR HB2 H 2.407 0.005 2 1392 138 138 TYR HB3 H 2.052 0.005 2 1393 138 138 TYR HD1 H 6.548 0.005 1 1394 138 138 TYR HD2 H 6.548 0.005 1 1395 138 138 TYR HE1 H 6.300 0.005 1 1396 138 138 TYR HE2 H 6.300 0.005 1 1397 138 138 TYR C C 176.526 0.01 1 1398 138 138 TYR CA C 62.440 0.01 1 1399 138 138 TYR CB C 37.839 0.01 1 1400 138 138 TYR N N 118.556 0.01 1 1401 139 139 GLU H H 8.053 0.005 1 1402 139 139 GLU HA H 3.664 0.005 1 1403 139 139 GLU HB2 H 2.073 0.005 2 1404 139 139 GLU HB3 H 1.969 0.005 2 1405 139 139 GLU HG2 H 2.310 0.005 2 1406 139 139 GLU HG3 H 2.310 0.005 2 1407 139 139 GLU C C 180.342 0.01 1 1408 139 139 GLU CA C 60.229 0.01 1 1409 139 139 GLU CB C 28.738 0.01 1 1410 139 139 GLU CG C 36.706 0.01 1 1411 139 139 GLU N N 118.464 0.01 1 1412 140 140 GLU H H 8.743 0.005 1 1413 140 140 GLU HA H 3.900 0.005 1 1414 140 140 GLU HB2 H 2.351 0.005 2 1415 140 140 GLU HB3 H 2.559 0.005 2 1416 140 140 GLU HG2 H 2.351 0.005 2 1417 140 140 GLU HG3 H 2.922 0.005 2 1418 140 140 GLU C C 179.400 0.01 1 1419 140 140 GLU CA C 58.752 0.01 1 1420 140 140 GLU CB C 29.481 0.01 1 1421 140 140 GLU CG C 37.448 0.01 1 1422 140 140 GLU N N 119.762 0.01 1 1423 141 141 PHE H H 8.621 0.005 1 1424 141 141 PHE HA H 3.800 0.005 1 1425 141 141 PHE HB2 H 3.420 0.005 2 1426 141 141 PHE HB3 H 3.115 0.005 2 1427 141 141 PHE HD1 H 7.210 0.005 1 1428 141 141 PHE HD2 H 7.210 0.005 1 1429 141 141 PHE HE1 H 7.280 0.005 1 1430 141 141 PHE HE2 H 7.280 0.005 1 1431 141 141 PHE HZ H 7.470 0.005 1 1432 141 141 PHE C C 176.606 0.01 1 1433 141 141 PHE CA C 61.999 0.01 1 1434 141 141 PHE CB C 40.576 0.01 1 1435 141 141 PHE N N 123.796 0.01 1 1436 142 142 VAL H H 8.669 0.005 1 1437 142 142 VAL HA H 3.109 0.005 1 1438 142 142 VAL HB H 1.750 0.005 1 1439 142 142 VAL HG1 H 0.724 0.005 2 1440 142 142 VAL HG2 H 0.467 0.005 2 1441 142 142 VAL C C 181.527 0.01 1 1442 142 142 VAL CA C 66.825 0.01 1 1443 142 142 VAL CB C 31.417 0.01 1 1444 142 142 VAL CG1 C 21.300 0.01 1 1445 142 142 VAL CG2 C 22.804 0.01 1 1446 142 142 VAL N N 118.994 0.01 1 1447 143 143 GLN H H 7.949 0.005 1 1448 143 143 GLN HA H 3.810 0.005 1 1449 143 143 GLN HB2 H 2.057 0.005 2 1450 143 143 GLN HB3 H 2.057 0.005 2 1451 143 143 GLN HG2 H 2.370 0.005 2 1452 143 143 GLN HG3 H 2.370 0.005 2 1453 143 143 GLN C C 177.867 0.01 1 1454 143 143 GLN CA C 59.160 0.01 1 1455 143 143 GLN CB C 27.836 0.01 1 1456 143 143 GLN CG C 34.193 0.01 1 1457 143 143 GLN N N 119.079 0.01 1 1458 144 144 MET H H 7.461 0.005 1 1459 144 144 MET HA H 4.024 0.005 1 1460 144 144 MET HB2 H 1.909 0.005 2 1461 144 144 MET HB3 H 1.909 0.005 2 1462 144 144 MET HG2 H 1.960 0.005 2 1463 144 144 MET HG3 H 1.960 0.005 2 1464 144 144 MET C C 177.870 0.01 1 1465 144 144 MET CA C 57.867 0.01 1 1466 144 144 MET CB C 32.570 0.01 1 1467 144 144 MET CG C 30.479 0.01 1 1468 144 144 MET N N 118.224 0.01 1 1469 145 145 MET H H 7.705 0.005 1 1470 145 145 MET HA H 4.072 0.005 1 1471 145 145 MET HB2 H 1.668 0.005 2 1472 145 145 MET HB3 H 1.668 0.005 2 1473 145 145 MET HG2 H 2.047 0.005 2 1474 145 145 MET HG3 H 2.047 0.005 2 1475 145 145 MET C C 177.623 0.01 1 1476 145 145 MET CA C 56.025 0.01 1 1477 145 145 MET CB C 31.662 0.01 1 1478 145 145 MET N N 115.080 0.01 1 1479 146 146 THR H H 7.650 0.005 1 1480 146 146 THR HA H 4.300 0.005 1 1481 146 146 THR HB H 4.255 0.005 1 1482 146 146 THR HG2 H 1.158 0.005 1 1483 146 146 THR C C 174.264 0.01 1 1484 146 146 THR CA C 62.100 0.01 1 1485 146 146 THR CB C 70.000 0.01 1 1486 146 146 THR CG2 C 21.435 0.01 1 1487 146 146 THR N N 109.816 0.01 1 1488 147 147 ALA H H 7.528 0.005 1 1489 147 147 ALA HA H 4.303 0.005 1 1490 147 147 ALA HB H 1.420 0.005 1 1491 147 147 ALA C C 176.714 0.01 1 1492 147 147 ALA CA C 52.883 0.01 1 1493 147 147 ALA CB C 18.818 0.01 1 1494 147 147 ALA N N 126.531 0.01 1 1495 148 148 LYS H H 7.748 0.005 1 1496 148 148 LYS HA H 4.153 0.005 1 1497 148 148 LYS HB2 H 1.836 0.005 2 1498 148 148 LYS HB3 H 1.702 0.005 2 1499 148 148 LYS HG2 H 1.417 0.005 2 1500 148 148 LYS HG3 H 1.319 0.005 2 1501 148 148 LYS HD2 H 1.666 0.005 2 1502 148 148 LYS HD3 H 1.666 0.005 2 1503 148 148 LYS HE2 H 3.006 0.005 2 1504 148 148 LYS HE3 H 3.006 0.005 2 1505 148 148 LYS C C 181.484 0.01 1 1506 148 148 LYS CA C 57.465 0.01 1 1507 148 148 LYS CB C 33.559 0.01 1 1508 148 148 LYS CG C 24.581 0.01 1 1509 148 148 LYS CD C 28.946 0.01 1 1510 148 148 LYS CE C 42.080 0.01 1 1511 148 148 LYS N N 125.710 0.01 1 stop_ save_ save_assigned_chem_shift_list_2_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D simultaneous 1H-13C/15N-edited NOESY-HSQC' stop_ loop_ _Sample_label $CaM-OLFp stop_ _Sample_conditions_label $sample_conditions _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Chain 2' _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 1 202 2 PRO HA H 4.502 0.005 1 2 202 2 PRO HB2 H 2.331 0.005 2 3 202 2 PRO HB3 H 1.876 0.005 2 4 202 2 PRO HG2 H 2.050 0.005 2 5 202 2 PRO HG3 H 2.005 0.005 2 6 202 2 PRO HD2 H 3.808 0.005 2 7 202 2 PRO HD3 H 3.684 0.005 2 8 202 2 PRO C C 176.481 0.01 1 9 202 2 PRO CA C 63.216 0.01 1 10 202 2 PRO CB C 31.934 0.01 1 11 202 2 PRO CG C 27.316 0.01 1 12 202 2 PRO CD C 51.096 0.01 1 13 203 3 ARG H H 8.480 0.005 1 14 203 3 ARG HA H 4.286 0.005 1 15 203 3 ARG HB2 H 1.831 0.005 2 16 203 3 ARG HB3 H 1.792 0.005 2 17 203 3 ARG HG2 H 1.653 0.005 2 18 203 3 ARG HG3 H 1.653 0.005 2 19 203 3 ARG HD2 H 3.202 0.005 2 20 203 3 ARG HD3 H 3.202 0.005 2 21 203 3 ARG C C 176.376 0.01 1 22 203 3 ARG CA C 56.043 0.01 1 23 203 3 ARG CB C 30.512 0.01 1 24 203 3 ARG CG C 26.798 0.01 1 25 203 3 ARG CD C 43.364 0.01 1 26 203 3 ARG N N 121.999 0.01 1 27 204 4 ARG H H 8.404 0.005 1 28 204 4 ARG HA H 4.357 0.005 1 29 204 4 ARG HB2 H 1.888 0.005 2 30 204 4 ARG HB3 H 1.783 0.005 2 31 204 4 ARG HG2 H 1.646 0.005 2 32 204 4 ARG HG3 H 1.646 0.005 2 33 204 4 ARG HD2 H 3.193 0.005 2 34 204 4 ARG HD3 H 3.193 0.005 2 35 204 4 ARG C C 176.638 0.01 1 36 204 4 ARG CA C 56.050 0.01 1 37 204 4 ARG CB C 30.536 0.01 1 38 204 4 ARG CG C 26.737 0.01 1 39 204 4 ARG CD C 43.325 0.01 1 40 204 4 ARG N N 122.351 0.01 1 41 205 5 GLY H H 8.454 0.005 1 42 205 5 GLY HA2 H 3.973 0.005 2 43 205 5 GLY HA3 H 3.973 0.005 2 44 205 5 GLY C C 174.053 0.01 1 45 205 5 GLY CA C 45.048 0.01 1 46 205 5 GLY N N 110.055 0.01 1 47 206 6 ARG H H 8.310 0.005 1 48 206 6 ARG HA H 4.426 0.005 1 49 206 6 ARG HB2 H 1.910 0.005 2 50 206 6 ARG HB3 H 1.778 0.005 2 51 206 6 ARG HG2 H 1.644 0.005 2 52 206 6 ARG HG3 H 1.644 0.005 2 53 206 6 ARG HD2 H 3.197 0.005 2 54 206 6 ARG HD3 H 3.197 0.005 2 55 206 6 ARG C C 177.375 0.01 1 56 206 6 ARG CA C 56.115 0.01 1 57 206 6 ARG CB C 30.519 0.01 1 58 206 6 ARG CG C 26.725 0.01 1 59 206 6 ARG CD C 43.349 0.01 1 60 206 6 ARG N N 120.678 0.01 1 61 207 7 GLY H H 9.826 0.005 1 62 207 7 GLY HA2 H 3.998 0.005 2 63 207 7 GLY HA3 H 3.998 0.005 2 64 207 7 GLY C C 176.127 0.01 1 65 207 7 GLY CA C 45.865 0.01 1 66 207 7 GLY N N 112.806 0.01 1 67 208 8 GLY H H 8.609 0.005 1 68 208 8 GLY HA2 H 3.842 0.005 2 69 208 8 GLY HA3 H 3.842 0.005 2 70 208 8 GLY C C 175.209 0.01 1 71 208 8 GLY CA C 47.385 0.01 1 72 208 8 GLY N N 108.286 0.01 1 73 209 9 PHE H H 8.978 0.005 1 74 209 9 PHE HA H 4.452 0.005 1 75 209 9 PHE HB2 H 3.430 0.005 2 76 209 9 PHE HB3 H 2.937 0.005 2 77 209 9 PHE HD1 H 6.735 0.005 1 78 209 9 PHE HD2 H 6.735 0.005 1 79 209 9 PHE HE1 H 6.647 0.005 1 80 209 9 PHE HE2 H 6.647 0.005 1 81 209 9 PHE HZ H 7.238 0.005 1 82 209 9 PHE C C 177.711 0.01 1 83 209 9 PHE CA C 58.364 0.01 1 84 209 9 PHE CB C 37.471 0.01 1 85 209 9 PHE N N 123.827 0.01 1 86 210 10 GLN H H 9.137 0.005 1 87 210 10 GLN HA H 3.579 0.005 1 88 210 10 GLN HB2 H 1.991 0.005 2 89 210 10 GLN HB3 H 1.884 0.005 2 90 210 10 GLN HG2 H 2.368 0.005 2 91 210 10 GLN HG3 H 2.368 0.005 2 92 210 10 GLN HE21 H 7.285 0.005 2 93 210 10 GLN HE22 H 7.000 0.005 2 94 210 10 GLN C C 177.812 0.01 1 95 210 10 GLN CA C 59.985 0.01 1 96 210 10 GLN CB C 27.558 0.01 1 97 210 10 GLN CG C 33.745 0.01 1 98 210 10 GLN N N 121.313 0.01 1 99 210 10 GLN NE2 N 111.631 0.01 1 100 211 11 ARG H H 7.811 0.005 1 101 211 11 ARG HA H 3.982 0.005 1 102 211 11 ARG HB2 H 1.986 0.005 2 103 211 11 ARG HB3 H 1.986 0.005 2 104 211 11 ARG HG2 H 1.855 0.005 2 105 211 11 ARG HG3 H 1.580 0.005 2 106 211 11 ARG HD2 H 3.288 0.005 2 107 211 11 ARG HD3 H 3.288 0.005 2 108 211 11 ARG C C 178.956 0.01 1 109 211 11 ARG CA C 59.711 0.01 1 110 211 11 ARG CB C 29.724 0.01 1 111 211 11 ARG CG C 27.399 0.01 1 112 211 11 ARG CD C 43.101 0.01 1 113 211 11 ARG N N 116.996 0.01 1 114 212 12 ILE H H 7.805 0.005 1 115 212 12 ILE HA H 4.011 0.005 1 116 212 12 ILE HB H 2.440 0.005 1 117 212 12 ILE HG12 H 1.881 0.005 2 118 212 12 ILE HG13 H 1.558 0.005 2 119 212 12 ILE HG2 H 1.112 0.005 1 120 212 12 ILE HD1 H 0.822 0.005 1 121 212 12 ILE C C 177.825 0.01 1 122 212 12 ILE CA C 62.075 0.01 1 123 212 12 ILE CB C 35.488 0.01 1 124 212 12 ILE CG1 C 27.589 0.01 1 125 212 12 ILE CG2 C 17.469 0.01 1 126 212 12 ILE CD1 C 10.358 0.01 1 127 212 12 ILE N N 120.018 0.01 1 128 213 13 VAL H H 8.210 0.005 1 129 213 13 VAL HA H 3.761 0.005 1 130 213 13 VAL HB H 2.070 0.005 1 131 213 13 VAL HG1 H 0.769 0.005 2 132 213 13 VAL HG2 H 0.720 0.005 2 133 213 13 VAL C C 179.446 0.01 1 134 213 13 VAL CA C 67.387 0.01 1 135 213 13 VAL CB C 31.079 0.01 1 136 213 13 VAL CG1 C 21.845 0.01 1 137 213 13 VAL CG2 C 23.760 0.01 1 138 213 13 VAL N N 120.907 0.01 1 139 214 14 ARG H H 8.327 0.005 1 140 214 14 ARG HA H 4.149 0.005 1 141 214 14 ARG HB2 H 1.999 0.005 2 142 214 14 ARG HB3 H 1.795 0.005 2 143 214 14 ARG HG2 H 1.592 0.005 2 144 214 14 ARG HG3 H 1.592 0.005 2 145 214 14 ARG HD2 H 3.193 0.005 2 146 214 14 ARG HD3 H 3.193 0.005 2 147 214 14 ARG C C 179.125 0.01 1 148 214 14 ARG CA C 59.102 0.01 1 149 214 14 ARG CB C 29.337 0.01 1 150 214 14 ARG CG C 26.608 0.01 1 151 214 14 ARG CD C 43.123 0.01 1 152 214 14 ARG N N 119.612 0.01 1 153 215 15 LEU H H 8.210 0.005 1 154 215 15 LEU HA H 4.185 0.005 1 155 215 15 LEU HB2 H 1.959 0.005 2 156 215 15 LEU HB3 H 1.959 0.005 2 157 215 15 LEU HG H 1.838 0.005 1 158 215 15 LEU HD1 H 0.980 0.005 2 159 215 15 LEU HD2 H 1.016 0.005 2 160 215 15 LEU C C 178.553 0.01 1 161 215 15 LEU CA C 58.665 0.01 1 162 215 15 LEU CB C 41.920 0.01 1 163 215 15 LEU CG C 25.300 0.01 1 164 215 15 LEU CD1 C 24.866 0.01 1 165 215 15 LEU CD2 C 24.070 0.01 1 166 215 15 LEU N N 121.922 0.01 1 167 216 16 VAL H H 8.409 0.005 1 168 216 16 VAL HA H 3.637 0.005 1 169 216 16 VAL HB H 2.460 0.005 1 170 216 16 VAL HG1 H 1.128 0.005 2 171 216 16 VAL HG2 H 1.029 0.005 2 172 216 16 VAL C C 177.737 0.01 1 173 216 16 VAL CA C 67.060 0.01 1 174 216 16 VAL CB C 31.428 0.01 1 175 216 16 VAL CG1 C 23.486 0.01 1 176 216 16 VAL CG2 C 21.574 0.01 1 177 216 16 VAL N N 117.758 0.01 1 178 217 17 GLY H H 8.333 0.005 1 179 217 17 GLY HA2 H 4.033 0.005 2 180 217 17 GLY HA3 H 3.921 0.005 2 181 217 17 GLY C C 175.936 0.01 1 182 217 17 GLY CA C 47.478 0.01 1 183 217 17 GLY N N 107.473 0.01 1 184 218 18 VAL H H 8.063 0.005 1 185 218 18 VAL HA H 3.954 0.005 1 186 218 18 VAL HB H 2.471 0.005 1 187 218 18 VAL HG1 H 1.117 0.005 2 188 218 18 VAL HG2 H 1.193 0.005 2 189 218 18 VAL C C 178.221 0.01 1 190 218 18 VAL CA C 66.239 0.01 1 191 218 18 VAL CB C 31.507 0.01 1 192 218 18 VAL CG1 C 21.572 0.01 1 193 218 18 VAL CG2 C 22.392 0.01 1 194 218 18 VAL N N 122.583 0.01 1 195 219 19 ILE H H 7.934 0.005 1 196 219 19 ILE HA H 3.919 0.005 1 197 219 19 ILE HB H 2.071 0.005 1 198 219 19 ILE HG13 H 1.158 0.005 2 199 219 19 ILE HG2 H 0.968 0.005 1 200 219 19 ILE HD1 H 0.717 0.005 1 201 219 19 ILE C C 178.021 0.01 1 202 219 19 ILE CA C 66.291 0.01 1 203 219 19 ILE CB C 37.942 0.01 1 204 219 19 ILE CG1 C 29.241 0.01 1 205 219 19 ILE CG2 C 17.743 0.01 1 206 219 19 ILE CD1 C 13.913 0.01 1 207 219 19 ILE N N 119.637 0.01 1 208 220 20 ARG H H 8.597 0.005 1 209 220 20 ARG HA H 3.957 0.005 1 210 220 20 ARG HB2 H 1.991 0.005 2 211 220 20 ARG HB3 H 1.832 0.005 2 212 220 20 ARG HG2 H 1.638 0.005 2 213 220 20 ARG HG3 H 1.571 0.005 2 214 220 20 ARG HD2 H 3.180 0.005 2 215 220 20 ARG HD3 H 3.180 0.005 2 216 220 20 ARG HE H 7.730 0.005 1 217 220 20 ARG C C 178.617 0.01 1 218 220 20 ARG CA C 59.424 0.01 1 219 220 20 ARG CB C 29.309 0.01 1 220 220 20 ARG CG C 28.123 0.01 1 221 220 20 ARG CD C 43.043 0.01 1 222 220 20 ARG N N 117.224 0.01 1 223 220 20 ARG NE N 110.300 0.01 1 224 221 21 ASP H H 8.357 0.005 1 225 221 21 ASP HA H 4.545 0.005 1 226 221 21 ASP HB2 H 3.034 0.005 2 227 221 21 ASP HB3 H 2.573 0.005 2 228 221 21 ASP C C 178.982 0.01 1 229 221 21 ASP CA C 56.840 0.01 1 230 221 21 ASP CB C 40.161 0.01 1 231 221 21 ASP N N 120.094 0.01 1 232 222 22 TRP H H 7.987 0.005 1 233 222 22 TRP HA H 4.686 0.005 1 234 222 22 TRP HB2 H 3.437 0.005 2 235 222 22 TRP HB3 H 3.369 0.005 2 236 222 22 TRP HE1 H 10.033 0.005 1 237 222 22 TRP HE3 H 7.235 0.005 1 238 222 22 TRP HZ2 H 7.081 0.005 1 239 222 22 TRP HZ3 H 5.938 0.005 1 240 222 22 TRP HH2 H 6.660 0.005 1 241 222 22 TRP C C 178.139 0.01 1 242 222 22 TRP CA C 58.137 0.01 1 243 222 22 TRP CB C 29.223 0.01 1 244 222 22 TRP N N 121.415 0.01 1 245 222 22 TRP NE1 N 127.878 0.01 1 246 223 23 ALA H H 7.917 0.005 1 247 223 23 ALA HA H 4.137 0.005 1 248 223 23 ALA HB H 1.444 0.005 1 249 223 23 ALA C C 178.145 0.01 1 250 223 23 ALA CA C 53.823 0.01 1 251 223 23 ALA CB C 18.563 0.01 1 252 223 23 ALA N N 119.256 0.01 1 253 224 24 ASN H H 8.046 0.005 1 254 224 24 ASN HA H 4.730 0.005 1 255 224 24 ASN HB2 H 2.958 0.005 2 256 224 24 ASN HB3 H 2.849 0.005 2 257 224 24 ASN HD21 H 7.749 0.005 2 258 224 24 ASN HD22 H 6.974 0.005 2 259 224 24 ASN C C 175.590 0.01 1 260 224 24 ASN CA C 53.530 0.01 1 261 224 24 ASN CB C 38.760 0.01 1 262 224 24 ASN N N 115.142 0.01 1 263 224 24 ASN ND2 N 113.320 0.01 1 264 225 25 LYS H H 7.999 0.005 1 265 225 25 LYS HA H 4.144 0.005 1 266 225 25 LYS HB2 H 1.827 0.005 2 267 225 25 LYS HB3 H 1.827 0.005 2 268 225 25 LYS HG2 H 1.450 0.005 2 269 225 25 LYS HG3 H 1.450 0.005 2 270 225 25 LYS HD2 H 1.677 0.005 2 271 225 25 LYS HD3 H 1.677 0.005 2 272 225 25 LYS HE2 H 3.006 0.005 2 273 225 25 LYS HE3 H 3.006 0.005 2 274 225 25 LYS C C 176.354 0.01 1 275 225 25 LYS CA C 56.926 0.01 1 276 225 25 LYS CB C 31.757 0.01 1 277 225 25 LYS CG C 24.363 0.01 1 278 225 25 LYS CD C 28.754 0.01 1 279 225 25 LYS CE C 41.911 0.01 1 280 225 25 LYS N N 120.348 0.01 1 281 226 26 ASN H H 8.245 0.005 1 282 226 26 ASN HA H 4.703 0.005 1 283 226 26 ASN HB2 H 2.642 0.005 2 284 226 26 ASN HB3 H 2.496 0.005 2 285 226 26 ASN HD21 H 7.467 0.005 2 286 226 26 ASN HD22 H 6.902 0.005 2 287 226 26 ASN C C 174.781 0.01 1 288 226 26 ASN CA C 53.042 0.01 1 289 226 26 ASN CB C 38.583 0.01 1 290 226 26 ASN N N 117.961 0.01 1 291 226 26 ASN ND2 N 113.164 0.01 1 292 227 27 PHE H H 8.128 0.005 1 293 227 27 PHE HA H 4.674 0.005 1 294 227 27 PHE HB2 H 3.253 0.005 2 295 227 27 PHE HB3 H 2.985 0.005 2 296 227 27 PHE C C 175.049 0.01 1 297 227 27 PHE CA C 57.508 0.01 1 298 227 27 PHE CB C 38.993 0.01 1 299 227 27 PHE N N 120.323 0.01 1 300 228 28 ARG H H 7.835 0.005 1 301 228 28 ARG HA H 4.148 0.005 1 302 228 28 ARG HB2 H 1.740 0.005 2 303 228 28 ARG HG2 H 1.565 0.005 2 304 228 28 ARG CA C 57.385 0.01 1 305 228 28 ARG CB C 31.230 0.01 1 306 228 28 ARG N N 126.392 0.01 1 stop_ save_