data_16626 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone and stereospecific beta-sidechain assignments of 1H, 13C and 15N for Ubiquitin Unfolded in 8M Urea, pH2.5. ; _BMRB_accession_number 16626 _BMRB_flat_file_name bmr16626.str _Entry_type original _Submission_date 2009-12-04 _Accession_date 2009-12-04 _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 Vajpai Navratna . . 2 Gentner Martin . . 3 Grzesiek Stephan . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 263 "13C chemical shifts" 210 "15N chemical shifts" 72 "coupling constants" 263 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-05-18 update BMRB 'complete entry citation' 2010-01-25 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Side-chain chi(1) conformations in urea-denatured ubiquitin and protein G from (3)J coupling constants and residual dipolar couplings.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 20155903 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Vajpai Navratna . . 2 Gentner Martin . . 3 Huang Jie-Rong . . 4 Blackledge Martin . . 5 Grzesiek Stephan . . stop_ _Journal_abbreviation 'J. Am. Chem. Soc.' _Journal_name_full 'Journal of the American Chemical Society' _Journal_volume 132 _Journal_issue 9 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 3196 _Page_last 3203 _Year 2010 _Details . loop_ _Keyword '3J coupling constants' 'Coil model' populations RDCs Side-chains stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Ubiquitin _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Ubiquitin $Ubiquitin stop_ _System_molecular_weight 8668.31 _System_physical_state denatured _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Ubiquitin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Ubiquitin _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 76 _Mol_residue_sequence ; MQIFVKTLTGKTITLEVEPS DTIENVKAKIQDKEGIPPDQ QRLIFAGKQLEDGRTLSDYN IQKESTLHLVLRLRGG ; loop_ _Residue_seq_code _Residue_label 1 MET 2 GLN 3 ILE 4 PHE 5 VAL 6 LYS 7 THR 8 LEU 9 THR 10 GLY 11 LYS 12 THR 13 ILE 14 THR 15 LEU 16 GLU 17 VAL 18 GLU 19 PRO 20 SER 21 ASP 22 THR 23 ILE 24 GLU 25 ASN 26 VAL 27 LYS 28 ALA 29 LYS 30 ILE 31 GLN 32 ASP 33 LYS 34 GLU 35 GLY 36 ILE 37 PRO 38 PRO 39 ASP 40 GLN 41 GLN 42 ARG 43 LEU 44 ILE 45 PHE 46 ALA 47 GLY 48 LYS 49 GLN 50 LEU 51 GLU 52 ASP 53 GLY 54 ARG 55 THR 56 LEU 57 SER 58 ASP 59 TYR 60 ASN 61 ILE 62 GLN 63 LYS 64 GLU 65 SER 66 THR 67 LEU 68 HIS 69 LEU 70 VAL 71 LEU 72 ARG 73 LEU 74 ARG 75 GLY 76 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-18 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 11505 entity 100.00 76 98.68 98.68 3.54e-45 BMRB 11547 ubiquitin 100.00 76 98.68 98.68 3.54e-45 BMRB 15047 denatured_ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 15410 Ubi 100.00 76 100.00 100.00 6.54e-46 BMRB 15689 UBB 98.68 103 98.67 100.00 6.21e-44 BMRB 15907 Ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 16228 ubiquitin 100.00 76 97.37 98.68 1.73e-44 BMRB 16582 Ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 16895 UBB+1 98.68 103 98.67 100.00 6.21e-44 BMRB 17181 ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 17439 ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 17769 Ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 17919 entity 100.00 76 100.00 100.00 6.54e-46 BMRB 18582 ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 18583 ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 18584 ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 18610 Ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 18611 Ubiquitin_A_state 100.00 76 100.00 100.00 6.54e-46 BMRB 18737 UBIQUITIN 100.00 76 100.00 100.00 6.54e-46 BMRB 19406 entity 100.00 152 100.00 100.00 6.43e-45 BMRB 19412 entity 100.00 152 100.00 100.00 6.43e-45 BMRB 25070 Ubiquitin 100.00 79 100.00 100.00 6.66e-46 BMRB 25123 Ubiquitin 94.74 72 100.00 100.00 8.52e-43 BMRB 25601 entity_1 100.00 76 97.37 97.37 5.31e-44 BMRB 26604 Ubiquitin_(microcrystalline) 100.00 76 100.00 100.00 6.54e-46 BMRB 4245 ubiquitin 100.00 76 100.00 100.00 6.54e-46 BMRB 4375 Ubiquitin 100.00 76 100.00 100.00 6.54e-46 PDB 1AAR "Structure Of A Diubiquitin Conjugate And A Model For Interaction With Ubiquitin Conjugating Enzyme (E2)" 100.00 76 100.00 100.00 6.54e-46 PDB 1CMX "Structural Basis For The Specificity Of Ubiquitin C- Terminal Hydrolases" 98.68 76 100.00 100.00 4.40e-45 PDB 1D3Z "Ubiquitin Nmr Structure" 100.00 76 100.00 100.00 6.54e-46 PDB 1F9J "Structure Of A New Crystal Form Of Tetraubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 1FXT "Structure Of A Conjugating Enzyme-Ubiquitin Thiolester Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 1G6J "Structure Of Recombinant Human Ubiquitin In Aot Reverse Micelles" 98.68 76 100.00 100.00 7.58e-45 PDB 1GJZ "Solution Structure Of A Dimeric N-Terminal Fragment Of Human Ubiquitin" 67.11 53 100.00 100.00 3.14e-26 PDB 1NBF "Crystal Structure Of A Ubp-Family Deubiquitinating Enzyme In Isolation And In Complex With Ubiquitin Aldehyde" 98.68 76 100.00 100.00 4.40e-45 PDB 1OGW "Synthetic Ubiquitin With Fluoro-Leu At 50 And 67" 100.00 76 97.37 97.37 2.65e-44 PDB 1P3Q "Mechanism Of Ubiquitin Recognition By The Cue Domain Of Vps9" 100.00 76 100.00 100.00 6.54e-46 PDB 1Q5W "Ubiquitin Recognition By Npl4 Zinc-Fingers" 100.00 76 100.00 100.00 6.54e-46 PDB 1S1Q "Tsg101(Uev) Domain In Complex With Ubiquitin" 98.68 76 100.00 100.00 7.58e-45 PDB 1TBE "Structure Of Tetraubiquitin Shows How Multiubiquitin Chains Can Be Formed" 100.00 76 100.00 100.00 6.54e-46 PDB 1UBI "Synthetic Structural And Biological Studies Of The Ubiquitin System. Part 1" 100.00 76 100.00 100.00 6.54e-46 PDB 1UBQ "Structure Of Ubiquitin Refined At 1.8 Angstroms Resolution" 100.00 76 100.00 100.00 6.54e-46 PDB 1UZX "A Complex Of The Vps23 Uev With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 1V80 "Solution Structures Of Ubiquitin At 30 Bar And 3 Kbar" 100.00 76 100.00 100.00 6.54e-46 PDB 1V81 "Solution Structures Of Ubiquitin At 30 Bar And 3 Kbar" 100.00 76 100.00 100.00 6.54e-46 PDB 1VX7 "Cryo-em Structure Of The Plasmodium Falciparum 80s Ribosome Bound To The Anti-protozoan Drug Emetine, Large Subunit (protein On" 100.00 128 98.68 100.00 1.38e-45 PDB 1WR6 "Crystal Structure Of Gga3 Gat Domain In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 1WRD "Crystal Structure Of Tom1 Gat Domain In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 1XD3 "Crystal Structure Of Uchl3-Ubvme Complex" 98.68 75 100.00 100.00 4.28e-45 PDB 1XQQ "Simultaneous Determination Of Protein Structure And Dynamics" 100.00 76 100.00 100.00 6.54e-46 PDB 1YD8 "Complex Of Human Gga3 Gat Domain And Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 1YIW "X-Ray Crystal Structure Of A Chemically Synthesized Ubiquitin" 100.00 76 98.68 100.00 2.84e-45 PDB 1YJ1 "X-Ray Crystal Structure Of A Chemically Synthesized [d-Gln35]ubiquitin" 100.00 76 97.37 98.68 3.36e-44 PDB 1YX5 "Solution Structure Of S5a Uim-1UBIQUITIN COMPLEX" 100.00 98 100.00 100.00 2.31e-46 PDB 1YX6 "Solution Structure Of S5a Uim-2UBIQUITIN COMPLEX" 100.00 98 100.00 100.00 2.31e-46 PDB 1ZGU "Solution Structure Of The Human Mms2-Ubiquitin Complex" 100.00 76 98.68 100.00 1.56e-45 PDB 2AYO "Structure Of Usp14 Bound To Ubquitin Aldehyde" 98.68 76 100.00 100.00 4.40e-45 PDB 2BGF "Nmr Structure Of Lys48-Linked Di-Ubiquitin Using Chemical Shift Perturbation Data Together With Rdcs And 15n- Relaxation Data" 100.00 76 100.00 100.00 6.54e-46 PDB 2C7M "Human Rabex-5 Residues 1-74 In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2C7N "Human Rabex-5 Residues 1-74 In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2D3G "Double Sided Ubiquitin Binding Of Hrs-Uim" 100.00 76 100.00 100.00 6.54e-46 PDB 2DEN "Solution Structure Of The Ubiquitin-Associated Domain Of Human Bmsc-Ubp And Its Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2DX5 "The Complex Structure Between The Mouse Eap45-Glue Domain And Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2FCM "X-Ray Crystal Structure Of A Chemically Synthesized [d-Gln35]ubiquitin With A Cubic Space Group" 100.00 76 97.37 98.68 3.36e-44 PDB 2FCN "X-Ray Crystal Structure Of A Chemically Synthesized [d-Val35]ubiquitin With A Cubic Space Group" 100.00 76 97.37 98.68 3.36e-44 PDB 2FCQ "X-Ray Crystal Structure Of A Chemically Synthesized Ubiquitin With A Cubic Space Group" 100.00 76 98.68 100.00 2.84e-45 PDB 2FCS "X-Ray Crystal Structure Of A Chemically Synthesized [l-Gln35]ubiquitin With A Cubic Space Group" 100.00 76 97.37 98.68 3.83e-44 PDB 2FID "Crystal Structure Of A Bovine Rabex-5 Fragment Complexed With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2FIF "Crystal Structure Of A Bovine Rabex-5 Fragment Complexed With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2FUH "Solution Structure Of The Ubch5cUB NON-Covalent Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 2G45 "Co-Crystal Structure Of Znf Ubp Domain From The Deubiquitinating Enzyme Isopeptidase T (Isot) In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2GMI Mms2UBC13~UBIQUITIN 100.00 76 100.00 100.00 6.54e-46 PDB 2HD5 "Usp2 In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2HTH "Structural Basis For Ubiquitin Recognition By The Human Eap45ESCRT-Ii Glue Domain" 100.00 76 100.00 100.00 6.54e-46 PDB 2IBI "Covalent Ubiquitin-Usp2 Complex" 98.68 75 100.00 100.00 4.28e-45 PDB 2J7Q "Crystal Structure Of The Ubiquitin-Specific Protease Encoded By Murine Cytomegalovirus Tegument Protein M48 In Complex With A U" 98.68 75 100.00 100.00 4.28e-45 PDB 2JF5 "Crystal Structure Of Lys63-Linked Di-Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2JRI "Solution Structure Of The Josephin Domain Of Ataxin-3 In Complex With Ubiquitin Molecule." 100.00 76 100.00 100.00 6.54e-46 PDB 2JY6 "Solution Structure Of The Complex Of Ubiquitin And Ubiquilin 1 Uba Domain" 100.00 76 100.00 100.00 6.54e-46 PDB 2JZZ "Solid-State Nmr Structure Of Microcrystalline Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2K25 "Automated Nmr Structure Of The Ubb By Fapsy" 98.68 103 98.67 100.00 6.21e-44 PDB 2K39 "Recognition Dynamics Up To Microseconds Revealed From Rdc Derived Ubiquitin Ensemble In Solution" 100.00 76 100.00 100.00 6.54e-46 PDB 2K6D "Cin85 Sh3-C Domain In Complex With Ubiquitin" 98.68 76 100.00 100.00 3.99e-45 PDB 2K8B "Solution Structure Of Plaa Family Ubiquitin Binding Domain (Pfuc) Cis Isomer In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2K8C "Solution Structure Of Plaa Family Ubiquitin Binding Domain (Pfuc) Trans Isomer In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2KDE "Nmr Structure Of Major S5a (196-306):k48 Linked Diubiquitin Species" 100.00 76 100.00 100.00 6.54e-46 PDB 2KDF "Nmr Structure Of Minor S5a (196-306):k48 Linked Diubiquitin Species" 100.00 76 100.00 100.00 6.54e-46 PDB 2KHW "Solution Structure Of The Human Polymerase Iota Ubm2- Ubiquitin Complex" 100.00 79 100.00 100.00 6.66e-46 PDB 2KJH "Nmr Based Structural Model Of The Ubch8-Ubiquitin Complex" 98.68 76 100.00 100.00 3.99e-45 PDB 2KLG "Pere Nmr Structure Of Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2KN5 "A Correspondence Between Solution-State Dynamics Of An Individual Protein And The Sequence And Conformational Diversity Of Its " 100.00 76 100.00 100.00 6.54e-46 PDB 2KOX "Nmr Residual Dipolar Couplings Identify Long Range Correlated Motions In The Backbone Of The Protein Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2KTF "Solution Nmr Structure Of Human Polymerase Iota Ubm2 In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2KWU "Solution Structure Of Ubm2 Of Murine Polymerase Iota In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2KWV "Solution Structure Of Ubm1 Of Murine Polymerase Iota In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2KX0 "The Solution Structure Of Ubb+1, Frameshift Mutant Of Ubiquitin B" 98.68 103 98.67 100.00 6.21e-44 PDB 2L0F "Solution Nmr Structure Of Human Polymerase Iota Ubm2 (P692a Mutant) In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2L0T "Solution Structure Of The Complex Of Ubiquitin And The Vhs Domain Of Stam2" 100.00 76 100.00 100.00 6.54e-46 PDB 2L3Z "Proton-Detected 4d Dream Solid-State Nmr Structure Of Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2LD9 "Backbone Structure Of Ubiquitin Determined Using Backbone Amide Noes And Backbone N-H And N-C Rdcs" 100.00 77 100.00 100.00 7.92e-46 PDB 2LJ5 "Description Of The Structural Fluctuations Of Proteins From Structure- Based Calculations Of Residual Dipolar Couplings" 100.00 76 100.00 100.00 6.54e-46 PDB 2LVO "Structure Of The Gp78cue Domain Bound To Monubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2LVP "Gp78cue Domain Bound To The Distal Ubiquitin Of K48-Linked Diubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2LVQ "Gp78cue Domain Bound To The Proximal Ubiquitin Of K48-Linked Diubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2LZ6 "Distinct Ubiquitin Binding Modes Exhibited By Sh3 Domains: Molecular Determinants And Functional Implications" 100.00 76 100.00 100.00 6.54e-46 PDB 2MBB "Solution Structure Of The Human Polymerase Iota Ubm1-ubiquitin Complex" 100.00 78 100.00 100.00 5.38e-46 PDB 2MBH "Nmr Structure Of Eklf(22-40)/ubiquitin Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 2MBO "K11-linked Diubiquitin Average Solution Structure At Ph 6.8, 0 Mm Nacl" 100.00 76 100.00 100.00 6.54e-46 PDB 2MBQ "K11-linked Diubiquitin Average Solution Structure At Ph 6.8, 150 Mm Nacl" 100.00 76 100.00 100.00 6.54e-46 PDB 2MCN "Distinct Ubiquitin Binding Modes Exhibited By Sh3 Domains: Molecular Determinants And Functional Implications" 100.00 76 100.00 100.00 6.54e-46 PDB 2MJ5 "Structure Of The Uba Domain Of Human Nbr1 In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2MJB "Solution Nmr Structure Of Ubiquitin Refined Against Dipolar Couplings In 4 Media" 100.00 76 100.00 100.00 6.54e-46 PDB 2MOR "A Tensor-free Method For The Structural And Dynamical Refinement Of Proteins Using Residual Dipolar Couplings" 100.00 76 100.00 100.00 6.54e-46 PDB 2MRE "Nmr Structure Of The Rad18-ubz/ubiquitin Complex" 100.00 79 100.00 100.00 6.66e-46 PDB 2MRO "Structure Of The Complex Of Ubiquitin And The Uba Domain From Dna- Damage-inducible 1 Protein (ddi1)" 100.00 76 100.00 100.00 6.54e-46 PDB 2MSG "Solid-state Nmr Structure Of Ubiquitin" 94.74 72 100.00 100.00 8.52e-43 PDB 2MUR "Solution Structure Of The Human Faap20 Ubz-ubiquitin Complex" 100.00 78 100.00 100.00 5.38e-46 PDB 2MWS "Structure Of The Complex Of Ubiquitin And The Ubiquitin-like (ubl) Domain Of Ddi1" 100.00 76 98.68 98.68 4.40e-45 PDB 2N2K "Ensemble Structure Of The Closed State Of Lys63-linked Diubiquitin In The Absence Of A Ligand" 93.42 71 100.00 100.00 6.21e-42 PDB 2NR2 "The Mumo (Minimal Under-Restraining Minimal Over- Restraining) Method For The Determination Of Native States Ensembles Of Prote" 100.00 76 100.00 100.00 6.54e-46 PDB 2O6V "Crystal Structure And Solution Nmr Studies Of Lys48-Linked Tetraubiquitin At Neutral Ph" 100.00 76 100.00 100.00 6.54e-46 PDB 2OJR "Structure Of Ubiquitin Solved By Sad Using The Lanthanide- Binding Tag" 100.00 111 100.00 100.00 2.29e-45 PDB 2OOB "Crystal Structure Of The Uba Domain From Cbl-B Ubiquitin Ligase In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2PE9 "Nmr Based Structure Of The Open Conformation Of Lys48- Linked Di-Ubiquitin Using Experimental Global Rotational Diffusion Tenso" 100.00 76 100.00 100.00 6.54e-46 PDB 2PEA "Nmr Based Structure Of The Closed Conformation Of Lys48- Linked Di-Ubiquitin Using Experimental Global Rotational Diffusion Ten" 100.00 76 100.00 100.00 6.54e-46 PDB 2QHO "Crystal Structure Of The Uba Domain From Edd Ubiquitin Ligase In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2RR9 "The Solution Structure Of The K63-Ub2:tuims Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 2RSU "Alternative Structure Of Ubiquitin" 100.00 76 98.68 98.68 3.54e-45 PDB 2RU6 "The Pure Alternative State Of Ubiquitin" 100.00 76 98.68 98.68 3.54e-45 PDB 2W9N "Crystal Structure Of Linear Di-Ubiquitin" 98.68 152 100.00 100.00 5.62e-44 PDB 2WDT "Crystal Structure Of Plasmodium Falciparum Uchl3 In Complex With The Suicide Inhibitor Ubvme" 98.68 76 100.00 100.00 4.40e-45 PDB 2WWZ "Tab2 Nzf Domain In Complex With Lys63-Linked Di-Ubiquitin, P212121" 100.00 76 100.00 100.00 6.54e-46 PDB 2WX0 "Tab2 Nzf Domain In Complex With Lys63-Linked Di-Ubiquitin, P21" 100.00 76 100.00 100.00 6.54e-46 PDB 2WX1 "Tab2 Nzf Domain In Complex With Lys63-Linked Tri-Ubiquitin, P212121" 100.00 76 100.00 100.00 6.54e-46 PDB 2XBB "Nedd4 Hect:ub Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 2XEW "Crystal Structure Of K11-Linked Diubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2XK5 "Crystal Structure Of K6-Linked Diubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2Y5B "Structure Of Usp21 In Complex With Linear Diubiquitin-Aldehyde" 98.68 152 100.00 100.00 4.15e-44 PDB 2Z59 "Complex Structures Of Mouse Rpn13 (22-130aa) And Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 2ZCB "Crystal Structure Of Ubiquitin P37aP38A" 100.00 76 97.37 97.37 3.44e-44 PDB 2ZCC "Ubiquitin Crystallized Under High Pressure" 100.00 76 100.00 100.00 6.54e-46 PDB 2ZNV "Crystal Structure Of Human Amsh-Lp Dub Domain In Complex With Lys63-Linked Ubiquitin Dimer" 100.00 77 100.00 100.00 7.42e-46 PDB 2ZVN "Nemo Cozi Domain Incomplex With Diubiquitin In P212121 Space Group" 100.00 154 100.00 100.00 5.98e-45 PDB 2ZVO "Nemo Cozi Domain In Complex With Diubiquitin In C2 Space Group" 100.00 154 100.00 100.00 5.98e-45 PDB 3A1Q "Crystal Structure Of The Mouse Rap80 Uims In Complex With Lys63-Linked Di-Ubiquitin" 100.00 77 100.00 100.00 7.42e-46 PDB 3A33 "Ubch5b~ubiquitin Conjugate" 100.00 76 100.00 100.00 6.54e-46 PDB 3A9J "Crystal Structure Of The Mouse Tab2-Nzf In Complex With Lys63-Linked Di-Ubiquitin" 100.00 77 100.00 100.00 7.42e-46 PDB 3A9K "Crystal Structure Of The Mouse Tab3-Nzf In Complex With Lys63-Linked Di-Ubiquitin" 100.00 77 100.00 100.00 7.42e-46 PDB 3AI5 "Crystal Structure Of Yeast Enhanced Green Fluorescent Protein- Ubiquitin Fusion Protein" 97.37 307 100.00 100.00 1.64e-41 PDB 3ALB "Cyclic Lys48-Linked Tetraubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3AUL "Crystal Structure Of Wild-Type Lys48-Linked Diubiquitin In An Open Conformation" 100.00 76 100.00 100.00 6.54e-46 PDB 3AXC "Crystal Structure Of Linear Diubiquitin" 100.00 154 100.00 100.00 5.98e-45 PDB 3B08 "Crystal Structure Of The Mouse Hoil1-l-nzf In Complex With Linear Di- Ubiquitin" 100.00 152 100.00 100.00 6.43e-45 PDB 3B0A "Crystal Structure Of The Mouse Hoil1-l-nzf In Complex With Linear Di- Ubiquitin" 100.00 152 100.00 100.00 6.43e-45 PDB 3BY4 "Structure Of Ovarian Tumor (Otu) Domain In Complex With Ubiquitin" 98.68 75 100.00 100.00 4.28e-45 PDB 3C0R "Structure Of Ovarian Tumor (Otu) Domain In Complex With Ubiquitin" 98.68 75 100.00 100.00 4.28e-45 PDB 3DVG "Crystal Structure Of K63-Specific Fab Apu.3a8 Bound To K63-Linked Di- Ubiquitin" 100.00 80 100.00 100.00 8.24e-46 PDB 3DVN "Crystal Structure Of K63-specific Fab Apu2.16 Bound To K63-linked Di- Ubiquitin" 100.00 80 100.00 100.00 8.24e-46 PDB 3EEC "X-Ray Structure Of Human Ubiquitin Cd(Ii) Adduct" 100.00 76 100.00 100.00 6.54e-46 PDB 3EFU "X-Ray Structure Of Human Ubiquitin-Hg(Ii) Adduct" 100.00 76 100.00 100.00 6.54e-46 PDB 3EHV "X-Ray Structure Of Human Ubiquitin Zn(Ii) Adduct" 100.00 76 100.00 100.00 6.54e-46 PDB 3H1U "Structure Of Ubiquitin In Complex With Cd Ions" 100.00 76 100.00 100.00 6.54e-46 PDB 3H7P "Crystal Structure Of K63-Linked Di-Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3H7S "Crystal Structures Of K63-Linked Di- And Tri-Ubiquitin Reveal A Highly Extended Chain Architecture" 100.00 76 98.68 98.68 2.81e-43 PDB 3HM3 "The Structure And Conformation Of Lys-63 Linked Tetra-Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3I3T "Crystal Structure Of Covalent Ubiquitin-usp21 Complex" 98.68 75 100.00 100.00 4.28e-45 PDB 3IFW "Crystal Structure Of The S18y Variant Of Ubiquitin Carboxy T Hydrolase L1 Bound To Ubiquitin Vinylmethylester." 98.68 75 100.00 100.00 4.28e-45 PDB 3IHP "Covalent Ubiquitin-Usp5 Complex" 98.68 75 100.00 100.00 4.28e-45 PDB 3JSV "Crystal Structure Of Mouse Nemo Cozi In Complex With Lys63- Linked Di-Ubiquitin" 100.00 77 100.00 100.00 7.42e-46 PDB 3JVZ E2~ubiquitin-Hect 100.00 81 100.00 100.00 7.68e-46 PDB 3JW0 E2~ubiquitin-Hect 100.00 81 100.00 100.00 7.68e-46 PDB 3K9O "The Crystal Structure Of E2-25k And Ubb+1 Complex" 98.68 96 100.00 100.00 1.27e-44 PDB 3K9P "The Crystal Structure Of E2-25k And Ubiquitin Complex" 100.00 79 100.00 100.00 6.66e-46 PDB 3KVF "Crystal Structure Of The I93m Mutant Of Ubiquitin Carboxy Te Hydrolase L1 Bound To Ubiquitin Vinylmethylester" 98.68 75 100.00 100.00 4.28e-45 PDB 3KW5 "Crystal Structure Of Ubiquitin Carboxy Terminal Hydrolase L1 Ubiquitin Vinylmethylester" 98.68 75 100.00 100.00 4.28e-45 PDB 3LDZ "Crystal Structure Of Human Stam1 Vhs Domain In Complex With Ubiquitin" 96.05 73 100.00 100.00 1.79e-43 PDB 3M3J "A New Crystal Form Of Lys48-Linked Diubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3MHS "Structure Of The Saga Ubp8SGF11SUS1SGF73 DUB MODULE BOUND Ubiquitin Aldehyde" 98.68 76 100.00 100.00 4.40e-45 PDB 3MTN "Usp21 In Complex With A Ubiquitin-based, Usp21-specific Inhibitor" 88.16 85 98.51 98.51 1.47e-37 PDB 3N30 "Crystal Structure Of Cubic Zn3-Hub (Human Ubiquitin) Adduct" 100.00 76 100.00 100.00 6.54e-46 PDB 3N32 "The Crystal Structure Of Human Ubiquitin Adduct With Zeise's Salt" 100.00 76 100.00 100.00 6.54e-46 PDB 3NHE "High Resolution Structure (1.26a) Of Usp2a In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3NOB "Structure Of K11-linked Di-ubiquitin" 100.00 78 100.00 100.00 5.38e-46 PDB 3NS8 "Crystal Structure Of An Open Conformation Of Lys48-Linked Diubiquitin At Ph 7.5" 100.00 76 100.00 100.00 6.54e-46 PDB 3O65 "Crystal Structure Of A Josephin-Ubiquitin Complex: Evolutionary Restraints On Ataxin-3 Deubiquitinating Activity" 98.68 76 100.00 100.00 4.40e-45 PDB 3OFI "Crystal Structure Of Human Insulin-Degrading Enzyme In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3OJ3 "Crystal Structure Of The A20 Znf4 And Ubiquitin Complex" 100.00 79 100.00 100.00 6.66e-46 PDB 3OJ4 "Crystal Structure Of The A20 Znf4, Ubiquitin And Ubch5a Complex" 100.00 79 100.00 100.00 6.66e-46 PDB 3ONS "Crystal Structure Of Human Ubiquitin In A New Crystal Form" 94.74 72 100.00 100.00 8.52e-43 PDB 3PHD "Crystal Structure Of Human Hdac6 In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3PHW "Otu Domain Of Crimean Congo Hemorrhagic Fever Virus In Complex With Ubiquitin" 98.68 75 100.00 100.00 4.28e-45 PDB 3PRM "Structural Analysis Of A Viral Otu Domain Protease From The Crimean- Congo Hemorrhagic Fever Virus In Complex With Human Ubiqui" 98.68 75 100.00 100.00 4.28e-45 PDB 3PRP "Structural Analysis Of A Viral Otu Domain Protease From The Crimean- Congo Hemorrhagic Fever Virus In Complex With Human Ubiqui" 98.68 75 100.00 100.00 4.28e-45 PDB 3PT2 "Structure Of A Viral Otu Domain Protease Bound To Ubiquitin" 98.68 75 100.00 100.00 4.28e-45 PDB 3PTF "X-Ray Structure Of The Non-Covalent Complex Between Ubch5a And Ubiquitin" 100.00 79 100.00 100.00 6.66e-46 PDB 3Q3F "Engineering Domain-Swapped Binding Interfaces By Mutually Exclusive Folding: Insertion Of Ubiquitin Into Position 103 Of Barnas" 98.68 189 100.00 100.00 5.35e-44 PDB 3RUL "New Strategy To Analyze Structures Of Glycopeptide-Target Complexes" 98.68 79 100.00 100.00 3.97e-45 PDB 3TBL "Structure Of Mono-ubiquitinated Pcna: Implications For Dna Polymerase Switching And Okazaki Fragment Maturation" 100.00 76 100.00 100.00 6.54e-46 PDB 3TMP "The Catalytic Domain Of Human Deubiquitinase Duba In Complex With Ubiquitin Aldehyde" 98.68 76 100.00 100.00 4.40e-45 PDB 3U30 "Crystal Structure Of A Linear-Specific Ubiquitin Fab Bound To Linear Ubiquitin" 100.00 172 100.00 100.00 6.89e-45 PDB 3UGB "Ubch5c~ubiquitin Conjugate" 100.00 76 100.00 100.00 6.54e-46 PDB 3VDZ "Tailoring Encodable Lanthanide-Binding Tags As Mri Contrast Agents: Xq-Dse3-Ubiquitin At 2.4 Angstroms" 100.00 111 100.00 100.00 1.47e-45 PDB 3VFK "The Structure Of Monodechloro-teicoplanin In Complex With Its Ligand, Using Ubiquitin As A Ligand Carrier" 98.68 79 100.00 100.00 3.97e-45 PDB 3VHT "Crystal Structure Of Gfp-Wrnip1 Ubz Domain Fusion Protein In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3VUW "Crystal Structure Of A20 Zf7 In Complex With Linear Ubiquitin, Form I" 100.00 76 100.00 100.00 6.54e-46 PDB 3VUX "Crystal Structure Of A20 Zf7 In Complex With Linear Ubiquitin, Form Ii" 100.00 76 100.00 100.00 6.54e-46 PDB 3VUY "Crystal Structure Of A20 Zf7 In Complex With Linear Tetraubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 3WWQ "Crystal Structure Of Faap20 Ubz Domain In Complex With Lys63-linked Diubiquitin" 100.00 77 100.00 100.00 7.42e-46 PDB 3WXE "Crystal Structure Of Cyld Usp Domain (c596s) In Complex With Met1- Linked Diubiquitin" 94.74 148 100.00 100.00 9.19e-42 PDB 3WXF "Crystal Structure Of Cyld Usp Domain (c596s E674q) In Complex With Met1-linked Diubiquitin" 94.74 148 100.00 100.00 9.19e-42 PDB 3WXG "Crystal Structure Of Cyld Usp Domain (c596a) In Complex With Lys63- Linked Diubiquitin" 94.74 72 100.00 100.00 8.52e-43 PDB 3ZLZ "Lys6-linked Tri-ubiquitin" 100.00 76 98.68 100.00 1.56e-45 PDB 3ZNH "Crimean Congo Hemorrhagic Fever Virus Otu Domain In Complex With Ubiquitin-propargyl." 98.68 76 100.00 100.00 4.40e-45 PDB 3ZNI "Structure Of Phosphotyr363-cbl-b - Ubch5b-ub - Zap-70 Peptide Complex" 100.00 81 100.00 100.00 7.68e-46 PDB 3ZNZ "Crystal Structure Of Otulin Otu Domain (c129a) In Complex With Met1-di Ubiquitin" 100.00 152 100.00 100.00 6.43e-45 PDB 4A18 "T.Thermophila 60s Ribosomal Subunit In Complex With Initiation Factor 6. This File Contains 26s Rrna And Proteins Of Molecule 1" 100.00 129 97.37 98.68 2.69e-44 PDB 4A19 "T.Thermophila 60s Ribosomal Subunit In Complex With Initiation Factor 6. This File Contains 26s Rrna And Proteins Of Molecule 2" 100.00 129 97.37 98.68 2.69e-44 PDB 4A1B "T.Thermophila 60s Ribosomal Subunit In Complex With Initiation Factor 6. This File Contains 26s Rrna And Proteins Of Molecule 3" 100.00 129 97.37 98.68 2.69e-44 PDB 4A1D "T.Thermophila 60s Ribosomal Subunit In Complex With Initiation Factor 6. This File Contains 26s Rrna And Proteins Of Molecule 4" 100.00 129 97.37 98.68 2.69e-44 PDB 4ADX "The Cryo-em Structure Of The Archaeal 50s Ribosomal Subunit In Complex With Initiation Factor 6" 100.00 129 97.37 98.68 2.69e-44 PDB 4AP4 "Rnf4 - Ubch5a - Ubiquitin Heterotrimeric Complex" 100.00 80 100.00 100.00 6.85e-46 PDB 4AUQ "Structure Of Birc7-Ubch5b-Ub Complex." 100.00 81 100.00 100.00 7.68e-46 PDB 4BBN "Nedd4 Hect-ub:ub Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 4BOS "Structure Of Otud2 Otu Domain In Complex With Ubiquitin K11- Linked Peptide" 100.00 76 100.00 100.00 6.54e-46 PDB 4BOZ "Structure Of Otud2 Otu Domain In Complex With K11-linked Di Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4BVU "Structure Of Shigella Effector Ospg In Complex With Host Ubch5c-ubiquitin Conjugate" 100.00 76 100.00 100.00 6.54e-46 PDB 4CXC "Regulation Of The Mammalian Elongation Cycle By 40s Subunit Rolling: A Eukaryotic-specific Ribosome Rearrangement" 100.00 156 100.00 100.00 7.65e-46 PDB 4CXD "Regulation Of The Mammalian Elongation Cycle By 40s Subunit Rolling: A Eukaryotic-specific Ribosome Rearrangement" 100.00 128 100.00 100.00 4.55e-46 PDB 4D5L "Cryo-em Structures Of Ribosomal 80s Complexes With Termination Factors And Cricket Paralysis Virus Ires Reveal The Ires In The " 100.00 156 100.00 100.00 7.65e-46 PDB 4D61 "Cryo-em Structures Of Ribosomal 80s Complexes With Termination Factors And Cricket Paralysis Virus Ires Reveal The Ires In The " 100.00 156 100.00 100.00 7.65e-46 PDB 4DDG "Crystal Structure Of Human Otub1UBCH5B~UBUB" 100.00 76 100.00 100.00 6.54e-46 PDB 4DDI "Crystal Structure Of Human Otub1UBCH5B~UBUB" 100.00 76 100.00 100.00 6.54e-46 PDB 4DHJ "The Structure Of A Ceotub1 Ubiquitin Aldehyde Ubc13~ub Complex" 98.68 76 100.00 100.00 3.99e-45 PDB 4DHZ "The Structure Of HCEOTUB1-Ubiquitin Aldehyde-Ubc13~ub" 98.68 76 100.00 100.00 3.99e-45 PDB 4FJV "Crystal Structure Of Human Otubain2 And Ubiquitin Complex" 100.00 86 100.00 100.00 9.86e-46 PDB 4HXD "Diversity Of Ubiquitin And Isg15 Specificity Amongst Nairoviruses Viral Ovarian Tumor Domain Proteases" 98.68 75 100.00 100.00 4.28e-45 PDB 4I6N "Crystal Structure Of Trichinella Spiralis Uch37 Catalytic Domain Bound To Ubiquitin Vinyl Methyl Ester" 97.37 75 100.00 100.00 4.54e-44 PDB 4IG7 "Crystal Structure Of Trichinella Spiralis Uch37 Bound To Ubiquitin Vinyl Methyl Ester" 98.68 75 100.00 100.00 4.28e-45 PDB 4IUM "Equine Arteritis Virus Papain-like Protease 2 (plp2) Covalently Bound To Ubiquitin" 98.68 76 100.00 100.00 4.40e-45 PDB 4JIO "Bro1 V Domain And Ubiquitin" 100.00 76 98.68 98.68 4.85e-45 PDB 4JQW "Crystal Structure Of A Complex Of Nod1 Card And Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4K1R "Crystal Structure Of Schizosaccharomyces Pombe Sst2 Catalytic Domain And Ubiquitin" 100.00 81 100.00 100.00 1.15e-45 PDB 4K7S "Crystal Structure Of Zn2-hub (human Ubiquitin) Adduct From A Solution 35 Mm Zinc Acetate/1.3 Mm Hub" 100.00 76 100.00 100.00 6.54e-46 PDB 4K7U "Crystal Structure Of Zn2.3-hub (human Ubiquitin) Adduct From A Solution 70 Mm Zinc Acetate/1.3 Mm Hub" 100.00 76 100.00 100.00 6.54e-46 PDB 4K7W "Crystal Structure Of Zn3-hub(human Ubiquitin) Adduct From A Solution 100 Mm Zinc Acetate/1.3 Mm Hub" 100.00 76 100.00 100.00 6.54e-46 PDB 4KSK "Gumby/fam105b In Complex With Ubiquitin" 100.00 80 100.00 100.00 6.85e-46 PDB 4KSL "Gumby/fam105b In Complex With Linear Di-ubiquitin" 100.00 156 100.00 100.00 6.34e-45 PDB 4KZX "Rabbit 40s Ribosomal Subunit In Complex With Eif1." 100.00 156 100.00 100.00 7.65e-46 PDB 4KZY "Rabbit 40s Ribosomal Subunit In Complex With Eif1 And Eif1a." 100.00 156 100.00 100.00 7.65e-46 PDB 4KZZ "Rabbit 40s Ribosomal Subunit In Complex With Mrna, Initiator Trna And Eif1a" 100.00 156 100.00 100.00 7.65e-46 PDB 4LCD "Structure Of An Rsp5xubxsna3 Complex: Mechanism Of Ubiquitin Ligation And Lysine Prioritization By A Hect E3" 97.37 83 100.00 100.00 1.79e-44 PDB 4LDT "The Structure Of H/ceotub1-ubiquitin Aldehyde-ubch5b~ub" 100.00 76 100.00 100.00 6.54e-46 PDB 4LJO "Structure Of An Active Ligase (hoip)/ubiquitin Transfer Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 4LJP "Structure Of An Active Ligase (hoip-h889a)/ubiquitin Transfer Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 4M0W "Crystal Structure Of Sars-cov Papain-like Protease C112s Mutant In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4MDK "Cdc34-ubiquitin-cc0651 Complex" 100.00 80 100.00 100.00 6.85e-46 PDB 4MM3 "Crystal Structure Of Sars-cov Papain-like Protease Plpro In Complex With Ubiquitin Aldehyde" 98.68 76 100.00 100.00 4.40e-45 PDB 4MSM "Crystal Structure Of Schizosaccharomyces Pombe Amsh-like Protease Sst2 E286a Mutant Bound To Ubiquitin" 100.00 81 100.00 100.00 1.15e-45 PDB 4MSQ "Crystal Structure Of Schizosaccharomyces Pombe Amsh-like Protease Sst2 Catalytic Domain Bound To Ubiquitin" 100.00 81 100.00 100.00 1.15e-45 PDB 4NQK "Structure Of An Ubiquitin Complex" 100.00 79 100.00 100.00 1.20e-45 PDB 4NQL "The Crystal Structure Of The Dub Domain Of Amsh Orthologue, Sst2 From S. Pombe, In Complex With Lysine 63-linked Diubiquitin" 100.00 77 100.00 100.00 7.42e-46 PDB 4P4H "Caught-in-action Signaling Complex Of Rig-i 2card Domain And Mavs Card Domain" 100.00 79 100.00 100.00 1.20e-45 PDB 4PIG "Crystal Structure Of The Ubiquitin K11s Mutant" 100.00 76 98.68 98.68 2.81e-45 PDB 4PIH "X-ray Crystal Structure Of The K33s Mutant Of Ubiquitin" 100.00 76 98.68 98.68 2.81e-45 PDB 4PIJ "X-ray Crystal Structure Of The K11s/k63s Double Mutant Of Ubiquitin" 98.68 75 97.33 97.33 7.90e-44 PDB 4PQT "Insights Into The Mechanism Of Deubiquitination By Jamm Deubiquitinases From Co-crystal Structures Of Enzyme With Substrate And" 100.00 81 100.00 100.00 1.15e-45 PDB 4R62 "Structure Of Rad6~ub" 100.00 78 100.00 100.00 6.20e-46 PDB 4RF0 "Crystal Structure Of The Middle-east Respiratory Syndrome Coronavirus Papain-like Protease In Complex With Ubiquitin (space Gro" 98.68 75 100.00 100.00 4.28e-45 PDB 4RF1 "Crystal Structure Of The Middle-east Respiratory Syndrome Coronavirus Papain-like Protease In Complex With Ubiquitin (space Gro" 98.68 75 100.00 100.00 4.28e-45 PDB 4S1Z "Crystal Structure Of Trabid Nzf1 In Complex With K29 Linked Di- Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4S22 "Crystal Structure Of K29 Linked Di-ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4UEL "Uch-l5 In Complex With Ubiquitin-propargyl Bound To The Rpn13 Deubad Domain" 98.68 76 100.00 100.00 4.40e-45 PDB 4UF6 "Uch-l5 In Complex With Ubiquitin-propargyl Bound To An Activating Fragment Of Ino80g" 98.68 76 100.00 100.00 4.40e-45 PDB 4UN2 "Crystal Structure Of The Uba Domain Of Dsk2 In Complex With Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4UPX "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Pre-like State" 100.00 128 100.00 100.00 4.55e-46 PDB 4UQ1 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Post-like State" 100.00 128 100.00 100.00 4.55e-46 PDB 4UQ4 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Post-like State" 100.00 156 100.00 100.00 7.65e-46 PDB 4UQ5 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Pre-like State" 100.00 156 100.00 100.00 7.65e-46 PDB 4V3K "Rnf38-ubch5b-ub Complex" 100.00 81 100.00 100.00 7.68e-46 PDB 4V3L "Rnf38-ub-ubch5b-ub Complex" 100.00 81 100.00 100.00 7.68e-46 PDB 4W20 "Structure Of The Mammalian 60s Ribosomal Subunit (this Entry Contains The Large Ribosomal Proteins)" 100.00 128 100.00 100.00 4.55e-46 PDB 4W22 "Structure Of The 80s Mammalian Ribosome Bound To Eef2 (this Entry Contains The Large Ribosomal Subunit Proteins)" 100.00 128 100.00 100.00 4.55e-46 PDB 4W23 "Structure Of The 80s Mammalian Ribosome Bound To Eef2 (this Entry Contains The Small Ribosomal Subunit)" 100.00 156 100.00 100.00 7.65e-46 PDB 4W25 "Structure Of The Idle Mammalian Ribosome-sec61 Complex (this Entry Contains The Large Ribosomal Subunit Proteins)" 100.00 128 100.00 100.00 4.55e-46 PDB 4W27 "Structure Of The Translating Mammalian Ribosome-sec61 Complex (this Entry Contains The Large Ribosomal Subunit Proteins)" 100.00 128 100.00 100.00 4.55e-46 PDB 4W28 "Structure Of The Translating Mammalian Ribosome-sec61 Complex (this Entry Contains The Small Ribosomal Subunit)" 100.00 156 100.00 100.00 7.65e-46 PDB 4WHV Rnf8/ubc13c87k~ub 100.00 83 100.00 100.00 1.61e-45 PDB 4WLR "Crystal Structure Of Much37-hrpn13 Ctd-hub Complex" 100.00 76 100.00 100.00 6.54e-46 PDB 4WUR "The Crystal Structure Of The Mers-cov Papain-like Protease (c111s) With Human Ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4WZP "Ser65 Phosphorylated Ubiquitin, Major Conformation" 100.00 76 98.68 98.68 4.64e-45 PDB 4XKL "Crystal Structure Of Ndp52 Zf2 In Complex With Mono-ubiquitin" 100.00 80 100.00 100.00 1.02e-45 PDB 4XOF "Observing The Overall Rocking Motion Of A Protein In A Crystal - Orthorhombic Ubiquitin Crystals Without Zinc." 100.00 76 100.00 100.00 6.54e-46 PDB 4XOK "Observing The Overall Rocking Motion Of A Protein In A Crystal." 100.00 76 100.00 100.00 6.54e-46 PDB 4XOL "Observing The Overall Rocking Motion Of A Protein In A Crystal - Cubic Ubiquitin Crystals." 100.00 76 100.00 100.00 6.54e-46 PDB 4XYZ "Crystal Structure Of K33 Linked Di-ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4Y1H "Crystal Structure Of K33 Linked Tri-ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4Z9S "Non-covalent Assembly Of Monoubiquitin That Mimics K11 Poly-ubiquitin" 100.00 76 100.00 100.00 6.54e-46 PDB 4ZFR "Catalytic Domain Of Sst2 F403a Mutant Bound To Ubiquitin" 100.00 81 100.00 100.00 1.15e-45 PDB 4ZFT "Catalytic Domain Of Sst2 F403w Mutant Bound To Ubiquitin" 100.00 81 100.00 100.00 1.15e-45 PDB 4ZPZ "Crystal Structure Of Semi-synthetic Ubiquitin With Phospho-ser65 And Ala46cys" 100.00 76 97.37 97.37 1.81e-44 PDB 5A5B "Structure Of The 26s Proteasome-ubp6 Complex" 98.68 76 100.00 100.00 4.40e-45 PDB 5AF4 "Structure Of Lys33-linked Diub" 100.00 76 98.68 100.00 1.56e-45 PDB 5AF5 "Structure Of Lys33-linked Triub S.g. P 212121" 96.05 73 98.63 100.00 5.42e-43 PDB 5AF6 "Structure Of Lys33-linked Diub Bound To Trabid Nzf1" 100.00 76 98.68 100.00 1.56e-45 PDB 5AIT "A Complex Of Of Rnf4-ring Domain, Ubev2, Ubc13-ub (isopeptide Crosslink)" 100.00 76 100.00 100.00 6.54e-46 PDB 5AIU "A Complex Of Rnf4-ring Domain, Ubc13-ub (isopeptide Crosslink)" 100.00 76 100.00 100.00 6.54e-46 PDB 5CAW "Structure Of Pediculus Humanus Parkin Bound To Phospho-ubiquitin" 98.68 76 98.67 98.67 2.77e-44 DBJ BAA03983 "polyubiquitin [Rattus norvegicus]" 100.00 305 100.00 100.00 3.25e-43 DBJ BAA09860 "polyubiquitin [Homo sapiens]" 100.00 611 98.68 98.68 1.53e-40 DBJ BAA11842 "ubiquitin [Cavia porcellus]" 100.00 311 100.00 100.00 3.52e-43 DBJ BAA11843 "ubiquitin extention protein [Cavia porcellus]" 100.00 156 100.00 100.00 7.65e-46 DBJ BAA23486 "polyubiquitin [Homo sapiens]" 100.00 609 98.68 98.68 8.23e-41 EMBL CAA25706 "unnamed protein product [Saccharomyces cerevisiae]" 50.00 191 100.00 100.00 4.38e-16 EMBL CAA26488 "unnamed protein product [Gallus gallus]" 100.00 157 98.68 98.68 3.90e-44 EMBL CAA28495 "ubiquitin [Homo sapiens]" 100.00 229 100.00 100.00 5.18e-44 EMBL CAA30183 "unnamed protein product [Dictyostelium discoideum]" 100.00 128 97.37 97.37 7.90e-44 EMBL CAA30815 "unnamed protein product [Cricetulus sp.]" 93.42 223 100.00 100.00 5.43e-40 GB AAA02769 "polyprotein [Bovine viral diarrhea virus 1-Osloss]" 98.68 3975 97.33 100.00 2.69e-39 GB AAA28154 "polyubiquitin [Caenorhabditis elegans]" 100.00 838 97.37 98.68 1.06e-39 GB AAA28997 "ubiquitin [Drosophila melanogaster]" 100.00 231 100.00 100.00 4.85e-44 GB AAA28998 "ubiquitin-hybrid protein precursor [Drosophila melanogaster]" 100.00 156 100.00 100.00 1.42e-45 GB AAA28999 "ubiquitin, partial [Drosophila melanogaster]" 100.00 76 100.00 100.00 6.54e-46 PIR I50437 "polyubiquitin 4 - chicken [Gallus gallus]" 100.00 305 100.00 100.00 3.25e-43 PIR I51568 "polyubiquitin - African clawed frog (fragment)" 100.00 167 100.00 100.00 1.00e-44 PIR I65237 "ubiquitin / ribosomal protein L40, cytosolic [validated] - rat" 100.00 128 100.00 100.00 4.55e-46 PIR JN0790 "ubiquitin/ribosomal protein CEP52 fusion protein - Leishmania major" 100.00 128 97.37 98.68 3.43e-45 PIR S13928 "ubiquitin precursor - chicken [Gallus gallus]" 100.00 229 100.00 100.00 5.35e-44 PRF 0412265A ubiquitin 98.68 75 98.67 98.67 1.80e-44 PRF 1101405A "ubiquitin precursor" 50.00 191 100.00 100.00 4.33e-16 PRF 1212243A "ubiquitin S1" 100.00 76 100.00 100.00 6.54e-46 PRF 1212243B "ubiquitin S5" 92.11 77 98.57 98.57 1.12e-40 PRF 1212243C "ubiquitin S3" 100.00 76 100.00 100.00 6.54e-46 REF NP_001005123 "ubiquitin-60S ribosomal protein L40 [Xenopus (Silurana) tropicalis]" 100.00 128 100.00 100.00 4.55e-46 REF NP_001006688 "ubiquitin C [Xenopus (Silurana) tropicalis]" 100.00 609 100.00 100.00 1.45e-41 REF NP_001009117 "polyubiquitin-B [Pan troglodytes]" 100.00 229 100.00 100.00 5.18e-44 REF NP_001009202 "polyubiquitin-B [Ovis aries]" 100.00 305 98.68 100.00 5.72e-43 REF NP_001009286 "ubiquitin-60S ribosomal protein L40 [Ovis aries]" 100.00 128 100.00 100.00 4.55e-46 SP P0C273 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 100.00 128 100.00 100.00 4.55e-46 SP P0C275 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 100.00 128 100.00 100.00 4.55e-46 SP P0C276 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 100.00 128 100.00 100.00 4.55e-46 SP P0CG47 "RecName: Full=Polyubiquitin-B; Contains: RecName: Full=Ubiquitin; Flags: Precursor" 100.00 229 100.00 100.00 5.18e-44 SP P0CG48 "RecName: Full=Polyubiquitin-C; Contains: RecName: Full=Ubiquitin; Flags: Precursor" 100.00 685 100.00 100.00 2.13e-41 TPD FAA00319 "TPA: polyubiquitin [Cryptococcus neoformans var. neoformans B-3501A]" 100.00 456 97.37 98.68 1.11e-40 TPE CEL68433 "TPA: ubiquitin / ribosomal protein CEP52 fusion protein, putative [Neospora caninum Liverpool]" 100.00 129 98.68 100.00 1.60e-45 TPE CEL70397 "TPA: Ubiquitin, related [Neospora caninum Liverpool]" 100.00 535 98.68 100.00 3.17e-41 TPE CEL75964 "TPA: ubiquitin / ribosomal protein CEP52 fusion protein, putative [Toxoplasma gondii VEG]" 100.00 129 98.68 100.00 1.60e-45 TPE CEL78064 "TPA: polyubiquitin, putative [Toxoplasma gondii VEG]" 100.00 307 98.68 100.00 1.16e-42 TPG DAA18802 "TPA: polyubiquitin [Bos taurus]" 100.00 305 100.00 100.00 3.43e-43 TPG DAA20663 "TPA: ubiquitin C [Bos taurus]" 98.68 314 98.67 100.00 1.30e-41 TPG DAA20672 "TPA: ubiquitin B-like [Bos taurus]" 100.00 77 98.68 98.68 4.88e-45 TPG DAA24675 "TPA: 40S ribosomal protein S27a [Bos taurus]" 100.00 156 100.00 100.00 7.65e-46 TPG DAA28295 "TPA: ubiquitin and ribosomal protein L40 [Bos taurus]" 100.00 128 100.00 100.00 4.55e-46 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Ubiquitin Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $Ubiquitin 'recombinant technology' . Escherichia coli . pET-21b(+) stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details 'Ubi-13C,15N in 8M urea' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Ubiquitin 1 mM '[U-13C; U-15N]' urea 8 M 'natural abundance' glycine 10 mM 'natural abundance' H2O 95 % 'natural abundance' D2O 5 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details 'Mac-OS X' save_ save_PIPP _Saveframe_category software _Name PIPP _Version . loop_ _Vendor _Address _Electronic_address Garrett . . stop_ loop_ _Task 'peak picking' stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 800 _Details 'Equipped with TCI cryoprobe' save_ ############################# # NMR applied experiments # ############################# save_3D_CBCA(CO)NH_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNHB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHB' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details 'Ubi-13C,15N in 8M urea' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 2.5 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details 'For stereo assignments of methylene protons 3D HN(CO)HB and HAHB(CACO)NH experiments were also acquired.' loop_ _Experiment_label '3D CBCA(CO)NH' '3D HBHA(CO)NH' '3D HNCO' '3D HNHB' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name Ubiquitin _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 MET HA H 3.89 0.010 1 2 1 1 MET HB2 H 1.89 0.010 2 3 1 1 MET HB3 H 1.89 0.010 2 4 1 1 MET C C 171.71 0.040 1 5 1 1 MET CA C 54.78 0.040 1 6 1 1 MET CB C 32.70 0.040 1 7 2 2 GLN H H 8.68 0.010 1 8 2 2 GLN HA H 4.22 0.010 1 9 2 2 GLN HB2 H 1.70 0.010 2 10 2 2 GLN C C 174.81 0.040 1 11 2 2 GLN CA C 55.49 0.040 1 12 2 2 GLN CB C 29.77 0.040 1 13 2 2 GLN N N 124.07 0.040 1 14 3 3 ILE H H 8.13 0.010 1 15 3 3 ILE HA H 3.94 0.010 1 16 3 3 ILE HB H 1.51 0.010 1 17 3 3 ILE C C 174.73 0.040 1 18 3 3 ILE CA C 60.21 0.040 1 19 3 3 ILE CB C 38.93 0.040 1 20 3 3 ILE N N 122.58 0.040 1 21 4 4 PHE H H 8.26 0.010 1 22 4 4 PHE HA H 4.57 0.010 1 23 4 4 PHE HB2 H 2.71 0.010 1 24 4 4 PHE HB3 H 2.82 0.010 1 25 4 4 PHE C C 174.22 0.040 1 26 4 4 PHE CA C 56.81 0.040 1 27 4 4 PHE CB C 39.58 0.040 1 28 4 4 PHE N N 124.68 0.040 1 29 5 5 VAL H H 8.12 0.010 1 30 5 5 VAL HA H 3.91 0.010 1 31 5 5 VAL HB H 1.75 0.010 1 32 5 5 VAL C C 174.81 0.040 1 33 5 5 VAL CA C 61.42 0.040 1 34 5 5 VAL CB C 33.02 0.040 1 35 5 5 VAL N N 122.59 0.040 1 36 6 6 LYS H H 8.22 0.010 1 37 6 6 LYS HA H 4.20 0.010 1 38 6 6 LYS HB2 H 1.49 0.010 1 39 6 6 LYS HB3 H 1.58 0.010 1 40 6 6 LYS C C 176.04 0.040 1 41 6 6 LYS CA C 55.91 0.040 1 42 6 6 LYS CB C 33.07 0.040 1 43 6 6 LYS N N 125.26 0.040 1 44 7 7 THR H H 8.12 0.010 1 45 7 7 THR HA H 4.16 0.010 1 46 7 7 THR HB H 4.01 0.010 1 47 7 7 THR C C 174.12 0.040 1 48 7 7 THR CA C 61.22 0.040 1 49 7 7 THR CB C 69.78 0.040 1 50 7 7 THR N N 116.08 0.040 1 51 8 8 LEU H H 8.28 0.010 1 52 8 8 LEU HA H 4.20 0.010 1 53 8 8 LEU HB2 H 1.43 0.010 1 54 8 8 LEU HB3 H 1.39 0.010 1 55 8 8 LEU C C 176.87 0.040 1 56 8 8 LEU CA C 55.14 0.040 1 57 8 8 LEU CB C 42.00 0.040 1 58 8 8 LEU N N 124.35 0.040 1 59 9 9 THR H H 7.87 0.010 1 60 9 9 THR HA H 4.14 0.010 1 61 9 9 THR HB H 4.04 0.010 1 62 9 9 THR C C 174.45 0.040 1 63 9 9 THR CA C 61.27 0.040 1 64 9 9 THR CB C 69.65 0.040 1 65 9 9 THR N N 112.78 0.040 1 66 10 10 GLY H H 8.09 0.010 1 67 10 10 GLY HA2 H 3.71 0.010 2 68 10 10 GLY HA3 H 3.79 0.010 2 69 10 10 GLY C C 173.19 0.040 1 70 10 10 GLY CA C 44.97 0.040 1 71 10 10 GLY N N 110.44 0.040 1 72 11 11 LYS H H 7.88 0.010 1 73 11 11 LYS HA H 4.17 0.010 1 74 11 11 LYS HB2 H 1.49 0.010 1 75 11 11 LYS HB3 H 1.58 0.010 1 76 11 11 LYS C C 176.01 0.040 1 77 11 11 LYS CA C 55.89 0.040 1 78 11 11 LYS CB C 33.17 0.040 1 79 11 11 LYS N N 120.56 0.040 1 80 12 12 THR H H 8.15 0.010 1 81 12 12 THR HA H 4.21 0.010 1 82 12 12 THR HB H 3.89 0.010 1 83 12 12 THR C C 173.76 0.040 1 84 12 12 THR CA C 61.69 0.040 1 85 12 12 THR CB C 69.60 0.040 1 86 12 12 THR N N 116.78 0.040 1 87 13 13 ILE H H 8.21 0.010 1 88 13 13 ILE HA H 4.08 0.010 1 89 13 13 ILE HB H 1.62 0.010 1 90 13 13 ILE C C 175.24 0.040 1 91 13 13 ILE CA C 60.44 0.040 1 92 13 13 ILE CB C 39.01 0.040 1 93 13 13 ILE N N 123.65 0.040 1 94 14 14 THR H H 8.09 0.010 1 95 14 14 THR HA H 4.20 0.010 1 96 14 14 THR HB H 3.87 0.010 1 97 14 14 THR C C 173.49 0.040 1 98 14 14 THR CA C 61.23 0.040 1 99 14 14 THR CB C 69.60 0.040 1 100 14 14 THR N N 118.82 0.040 1 101 15 15 LEU H H 8.16 0.010 1 102 15 15 LEU HA H 4.17 0.010 1 103 15 15 LEU HB2 H 1.30 0.010 2 104 15 15 LEU HB3 H 1.30 0.010 2 105 15 15 LEU C C 176.12 0.040 1 106 15 15 LEU CA C 54.41 0.040 1 107 15 15 LEU CB C 42.58 0.040 1 108 15 15 LEU N N 125.29 0.040 1 109 16 16 GLU H H 8.23 0.010 1 110 16 16 GLU HA H 4.22 0.010 1 111 16 16 GLU HB2 H 1.72 0.010 1 112 16 16 GLU HB3 H 1.82 0.010 1 113 16 16 GLU C C 175.09 0.040 1 114 16 16 GLU CA C 55.11 0.040 1 115 16 16 GLU CB C 28.62 0.040 1 116 16 16 GLU N N 121.67 0.040 1 117 17 17 VAL H H 8.03 0.010 1 118 17 17 VAL HA H 3.91 0.010 1 119 17 17 VAL HB H 1.78 0.010 1 120 17 17 VAL C C 175.19 0.040 1 121 17 17 VAL CA C 61.63 0.040 1 122 17 17 VAL CB C 32.65 0.040 1 123 17 17 VAL N N 121.64 0.040 1 124 18 18 GLU H H 8.23 0.010 1 125 18 18 GLU N N 124.61 0.040 1 126 19 19 PRO HA H 4.22 0.010 1 127 19 19 PRO HB2 H 1.71 0.010 2 128 19 19 PRO HB3 H 2.08 0.010 2 129 19 19 PRO C C 176.20 0.040 1 130 19 19 PRO CA C 62.84 0.040 1 131 19 19 PRO CB C 31.85 0.040 1 132 20 20 SER H H 8.20 0.010 1 133 20 20 SER HA H 4.20 0.010 1 134 20 20 SER HB2 H 3.62 0.010 1 135 20 20 SER HB3 H 3.68 0.010 1 136 20 20 SER C C 173.98 0.040 1 137 20 20 SER CA C 58.05 0.040 1 138 20 20 SER CB C 63.58 0.040 1 139 20 20 SER N N 115.46 0.040 1 140 21 21 ASP H H 8.30 0.010 1 141 21 21 ASP HA H 4.58 0.010 1 142 21 21 ASP HB2 H 2.68 0.010 1 143 21 21 ASP HB3 H 2.73 0.010 1 144 21 21 ASP C C 174.57 0.040 1 145 21 21 ASP CA C 52.60 0.040 1 146 21 21 ASP CB C 37.85 0.040 1 147 21 21 ASP N N 120.63 0.040 1 148 22 22 THR H H 7.89 0.010 1 149 22 22 THR HA H 4.11 0.010 1 150 22 22 THR HB H 3.96 0.010 1 151 22 22 THR C C 173.80 0.040 1 152 22 22 THR CA C 61.67 0.040 1 153 22 22 THR CB C 69.59 0.040 1 154 22 22 THR N N 114.21 0.040 1 155 23 23 ILE H H 7.91 0.010 1 156 23 23 ILE HA H 3.92 0.010 1 157 23 23 ILE HB H 1.60 0.010 1 158 23 23 ILE C C 175.40 0.040 1 159 23 23 ILE CA C 60.78 0.040 1 160 23 23 ILE CB C 38.29 0.040 1 161 23 23 ILE N N 122.88 0.040 1 162 24 24 GLU H H 8.16 0.010 1 163 24 24 GLU HA H 4.15 0.010 1 164 24 24 GLU HB2 H 1.71 0.010 1 165 24 24 GLU HB3 H 1.83 0.010 1 166 24 24 GLU C C 174.94 0.040 1 167 24 24 GLU CA C 55.20 0.040 1 168 24 24 GLU CB C 28.71 0.040 1 169 24 24 GLU N N 123.82 0.040 1 170 25 25 ASN H H 8.27 0.010 1 171 25 25 ASN HA H 4.50 0.010 1 172 25 25 ASN HB2 H 2.50 0.010 2 173 25 25 ASN HB3 H 2.60 0.010 2 174 25 25 ASN C C 174.49 0.040 1 175 25 25 ASN CA C 52.80 0.040 1 176 25 25 ASN CB C 38.54 0.040 1 177 25 25 ASN N N 120.44 0.040 1 178 26 26 VAL H H 7.88 0.010 1 179 26 26 VAL HA H 3.86 0.010 1 180 26 26 VAL HB H 1.83 0.010 1 181 26 26 VAL C C 175.41 0.040 1 182 26 26 VAL CA C 62.02 0.040 1 183 26 26 VAL CB C 32.51 0.040 1 184 26 26 VAL N N 120.22 0.040 1 185 27 27 LYS H H 8.13 0.010 1 186 27 27 LYS HA H 4.06 0.010 1 187 27 27 LYS HB2 H 1.50 0.010 1 188 27 27 LYS HB3 H 1.59 0.010 1 189 27 27 LYS C C 175.62 0.040 1 190 27 27 LYS CA C 55.92 0.040 1 191 27 27 LYS CB C 32.68 0.040 1 192 27 27 LYS N N 124.58 0.040 1 193 28 28 ALA H H 8.00 0.010 1 194 28 28 ALA HA H 4.04 0.010 1 195 28 28 ALA HB H 1.13 0.010 1 196 28 28 ALA C C 176.91 0.040 1 197 28 28 ALA CA C 51.99 0.040 1 198 28 28 ALA CB C 19.05 0.040 1 199 28 28 ALA N N 125.12 0.040 1 200 29 29 LYS H H 8.10 0.010 1 201 29 29 LYS HA H 4.06 0.010 1 202 29 29 LYS HB2 H 1.48 0.010 1 203 29 29 LYS HB3 H 1.55 0.010 1 204 29 29 LYS C C 175.94 0.040 1 205 29 29 LYS CA C 56.01 0.040 1 206 29 29 LYS CB C 32.78 0.040 1 207 29 29 LYS N N 121.17 0.040 1 208 30 30 ILE H H 8.03 0.010 1 209 30 30 ILE HA H 3.90 0.010 1 210 30 30 ILE HB H 1.58 0.010 1 211 30 30 ILE C C 175.53 0.040 1 212 30 30 ILE CA C 60.74 0.040 1 213 30 30 ILE CB C 38.33 0.040 1 214 30 30 ILE N N 122.59 0.040 1 215 31 31 GLN H H 8.31 0.010 1 216 31 31 GLN HA H 4.13 0.010 1 217 31 31 GLN HB2 H 1.72 0.010 1 218 31 31 GLN HB3 H 1.83 0.010 1 219 31 31 GLN C C 174.93 0.040 1 220 31 31 GLN CA C 55.27 0.040 1 221 31 31 GLN CB C 29.38 0.040 1 222 31 31 GLN N N 124.64 0.040 1 223 32 32 ASP H H 8.33 0.010 1 224 32 32 ASP HA H 4.50 0.010 1 225 32 32 ASP HB2 H 2.60 0.010 1 226 32 32 ASP HB3 H 2.70 0.010 1 227 32 32 ASP C C 174.46 0.040 1 228 32 32 ASP CA C 52.58 0.040 1 229 32 32 ASP CB C 37.95 0.040 1 230 32 32 ASP N N 120.90 0.040 1 231 33 33 LYS H H 8.22 0.010 1 232 33 33 LYS HA H 4.08 0.010 1 233 33 33 LYS HB2 H 1.50 0.010 1 234 33 33 LYS HB3 H 1.61 0.010 1 235 33 33 LYS C C 175.75 0.040 1 236 33 33 LYS CA C 56.29 0.040 1 237 33 33 LYS CB C 32.70 0.040 1 238 33 33 LYS N N 122.12 0.040 1 239 34 34 GLU H H 8.12 0.010 1 240 34 34 GLU HA H 4.14 0.010 1 241 34 34 GLU HB2 H 1.76 0.010 1 242 34 34 GLU HB3 H 1.90 0.010 1 243 34 34 GLU C C 175.72 0.040 1 244 34 34 GLU CA C 55.49 0.040 1 245 34 34 GLU CB C 28.76 0.040 1 246 34 34 GLU N N 120.55 0.040 1 247 35 35 GLY H H 8.13 0.010 1 248 35 35 GLY HA2 H 3.67 0.010 2 249 35 35 GLY HA3 H 3.76 0.010 2 250 35 35 GLY C C 172.79 0.040 1 251 35 35 GLY CA C 44.72 0.040 1 252 35 35 GLY N N 109.61 0.040 1 253 36 36 ILE H H 7.82 0.010 1 254 36 36 ILE N N 121.03 0.040 1 255 38 38 PRO HA H 4.17 0.010 1 256 38 38 PRO HB2 H 1.69 0.010 2 257 38 38 PRO HB3 H 2.05 0.010 2 258 38 38 PRO C C 176.29 0.040 1 259 38 38 PRO CA C 63.09 0.040 1 260 38 38 PRO CB C 31.76 0.040 1 261 39 39 ASP H H 8.26 0.010 1 262 39 39 ASP HA H 4.41 0.010 1 263 39 39 ASP HB2 H 2.67 0.010 2 264 39 39 ASP HB3 H 2.71 0.010 2 265 39 39 ASP C C 174.65 0.040 1 266 39 39 ASP CA C 52.78 0.040 1 267 39 39 ASP CB C 37.57 0.040 1 268 39 39 ASP N N 117.32 0.040 1 269 40 40 GLN H H 8.10 0.010 1 270 40 40 GLN HA H 4.10 0.010 1 271 40 40 GLN HB2 H 1.69 0.010 1 272 40 40 GLN HB3 H 1.90 0.010 1 273 40 40 GLN C C 175.25 0.040 1 274 40 40 GLN CA C 55.60 0.040 1 275 40 40 GLN CB C 29.37 0.040 1 276 40 40 GLN N N 120.30 0.040 1 277 41 41 GLN H H 8.05 0.010 1 278 41 41 GLN HA H 4.04 0.010 1 279 41 41 GLN HB2 H 1.73 0.010 1 280 41 41 GLN HB3 H 1.83 0.010 1 281 41 41 GLN C C 175.20 0.040 1 282 41 41 GLN CA C 55.77 0.040 1 283 41 41 GLN CB C 29.28 0.040 1 284 41 41 GLN N N 121.08 0.040 1 285 42 42 ARG H H 8.17 0.010 1 286 42 42 ARG HA H 4.08 0.010 1 287 42 42 ARG HB2 H 1.50 0.010 1 288 42 42 ARG HB3 H 1.56 0.010 1 289 42 42 ARG C C 175.25 0.040 1 290 42 42 ARG CA C 55.69 0.040 1 291 42 42 ARG CB C 30.59 0.040 1 292 42 42 ARG N N 122.19 0.040 1 293 43 43 LEU H H 8.10 0.010 1 294 43 43 LEU HA H 4.09 0.010 1 295 43 43 LEU HB2 H 1.33 0.010 1 296 43 43 LEU HB3 H 1.15 0.010 1 297 43 43 LEU C C 176.07 0.040 1 298 43 43 LEU CA C 54.62 0.040 1 299 43 43 LEU CB C 42.15 0.040 1 300 43 43 LEU N N 123.91 0.040 1 301 44 44 ILE H H 7.96 0.010 1 302 44 44 ILE HA H 3.87 0.010 1 303 44 44 ILE HB H 1.50 0.010 1 304 44 44 ILE C C 175.18 0.040 1 305 44 44 ILE CA C 60.42 0.040 1 306 44 44 ILE CB C 38.58 0.040 1 307 44 44 ILE N N 121.96 0.040 1 308 45 45 PHE H H 8.20 0.010 1 309 45 45 PHE HA H 4.43 0.010 1 310 45 45 PHE HB2 H 2.73 0.010 1 311 45 45 PHE HB3 H 2.88 0.010 1 312 45 45 PHE C C 174.62 0.040 1 313 45 45 PHE CA C 56.98 0.040 1 314 45 45 PHE CB C 39.44 0.040 1 315 45 45 PHE N N 124.65 0.040 1 316 46 46 ALA H H 8.11 0.010 1 317 46 46 ALA HA H 4.10 0.010 1 318 46 46 ALA HB H 1.12 0.010 1 319 46 46 ALA C C 176.96 0.040 1 320 46 46 ALA CA C 51.95 0.040 1 321 46 46 ALA CB C 19.19 0.040 1 322 46 46 ALA N N 126.12 0.040 1 323 47 47 GLY H H 7.69 0.010 1 324 47 47 GLY HA2 H 3.67 0.010 2 325 47 47 GLY HA3 H 3.68 0.010 2 326 47 47 GLY C C 173.26 0.040 1 327 47 47 GLY CA C 44.87 0.040 1 328 47 47 GLY N N 107.39 0.040 1 329 48 48 LYS H H 8.01 0.010 1 330 48 48 LYS HA H 4.08 0.010 1 331 48 48 LYS HB2 H 1.49 0.010 1 332 48 48 LYS HB3 H 1.57 0.010 1 333 48 48 LYS C C 175.92 0.040 1 334 48 48 LYS CA C 56.01 0.040 1 335 48 48 LYS CB C 33.04 0.040 1 336 48 48 LYS N N 120.57 0.040 1 337 49 49 GLN H H 8.29 0.010 1 338 49 49 GLN HA H 4.09 0.010 1 339 49 49 GLN HB2 H 1.74 0.010 1 340 49 49 GLN HB3 H 1.83 0.010 1 341 49 49 GLN C C 175.29 0.040 1 342 49 49 GLN CA C 55.45 0.040 1 343 49 49 GLN CB C 29.14 0.040 1 344 49 49 GLN N N 121.53 0.040 1 345 50 50 LEU H H 8.14 0.010 1 346 50 50 LEU HA H 4.11 0.010 1 347 50 50 LEU HB2 H 1.38 0.010 2 348 50 50 LEU HB3 H 1.31 0.010 2 349 50 50 LEU C C 176.68 0.040 1 350 50 50 LEU CA C 54.81 0.040 1 351 50 50 LEU CB C 42.07 0.040 1 352 50 50 LEU N N 123.80 0.040 1 353 51 51 GLU H H 8.23 0.010 1 354 51 51 GLU HA H 4.17 0.010 1 355 51 51 GLU HB2 H 1.74 0.010 1 356 51 51 GLU HB3 H 1.88 0.010 1 357 51 51 GLU C C 175.19 0.040 1 358 51 51 GLU CA C 55.25 0.040 1 359 51 51 GLU CB C 28.50 0.040 1 360 51 51 GLU N N 120.71 0.040 1 361 52 52 ASP H H 8.30 0.010 1 362 52 52 ASP HA H 4.50 0.010 1 363 52 52 ASP HB2 H 2.64 0.010 1 364 52 52 ASP HB3 H 2.71 0.010 1 365 52 52 ASP C C 174.85 0.040 1 366 52 52 ASP CA C 52.67 0.040 1 367 52 52 ASP CB C 37.96 0.040 1 368 52 52 ASP N N 119.75 0.040 1 369 53 53 GLY H H 8.15 0.010 1 370 53 53 GLY HA2 H 3.71 0.010 2 371 53 53 GLY HA3 H 3.74 0.010 2 372 53 53 GLY C C 173.28 0.040 1 373 53 53 GLY CA C 45.15 0.040 1 374 53 53 GLY N N 108.72 0.040 1 375 54 54 ARG H H 7.92 0.010 1 376 54 54 ARG HA H 4.19 0.010 1 377 54 54 ARG HB2 H 1.53 0.010 1 378 54 54 ARG HB3 H 1.62 0.010 1 379 54 54 ARG C C 175.85 0.040 1 380 54 54 ARG CA C 55.75 0.040 1 381 54 54 ARG CB C 30.87 0.040 1 382 54 54 ARG N N 120.03 0.040 1 383 55 55 THR H H 8.04 0.010 1 384 55 55 THR HA H 4.13 0.010 1 385 55 55 THR HB H 3.96 0.010 1 386 55 55 THR C C 173.92 0.040 1 387 55 55 THR CA C 61.57 0.040 1 388 55 55 THR CB C 69.63 0.040 1 389 55 55 THR N N 115.45 0.040 1 390 56 56 LEU H H 8.14 0.010 1 391 56 56 LEU HA H 4.17 0.010 1 392 56 56 LEU HB2 H 1.38 0.010 1 393 56 56 LEU HB3 H 1.35 0.010 1 394 56 56 LEU C C 176.65 0.040 1 395 56 56 LEU CA C 54.77 0.040 1 396 56 56 LEU CB C 42.20 0.040 1 397 56 56 LEU N N 124.58 0.040 1 398 57 57 SER H H 8.13 0.010 1 399 57 57 SER HA H 4.19 0.010 1 400 57 57 SER HB2 H 3.54 0.010 2 401 57 57 SER HB3 H 3.58 0.010 2 402 57 57 SER C C 173.69 0.040 1 403 57 57 SER CA C 57.93 0.040 1 404 57 57 SER CB C 63.64 0.040 1 405 57 57 SER N N 116.14 0.040 1 406 58 58 ASP H H 8.22 0.010 1 407 58 58 ASP HA H 4.47 0.010 1 408 58 58 ASP HB2 H 2.48 0.010 2 409 58 58 ASP HB3 H 2.53 0.010 2 410 58 58 ASP C C 174.09 0.040 1 411 58 58 ASP CA C 52.62 0.040 1 412 58 58 ASP CB C 37.84 0.040 1 413 58 58 ASP N N 120.60 0.040 1 414 59 59 TYR H H 7.87 0.010 1 415 59 59 TYR HA H 4.28 0.010 1 416 59 59 TYR HB2 H 2.67 0.010 1 417 59 59 TYR HB3 H 2.79 0.010 1 418 59 59 TYR C C 174.69 0.040 1 419 59 59 TYR CA C 57.67 0.040 1 420 59 59 TYR CB C 38.57 0.040 1 421 59 59 TYR N N 120.24 0.040 1 422 60 60 ASN H H 8.13 0.010 1 423 60 60 ASN HA H 4.45 0.010 1 424 60 60 ASN HB2 H 2.42 0.010 1 425 60 60 ASN HB3 H 2.56 0.010 1 426 60 60 ASN C C 174.34 0.040 1 427 60 60 ASN CA C 52.78 0.040 1 428 60 60 ASN CB C 38.63 0.040 1 429 60 60 ASN N N 120.23 0.040 1 430 61 61 ILE H H 7.77 0.010 1 431 61 61 ILE HA H 3.87 0.010 1 432 61 61 ILE HB H 1.59 0.010 1 433 61 61 ILE C C 175.51 0.040 1 434 61 61 ILE CA C 61.05 0.040 1 435 61 61 ILE CB C 38.33 0.040 1 436 61 61 ILE N N 120.77 0.040 1 437 62 62 GLN H H 8.18 0.010 1 438 62 62 GLN HA H 4.08 0.010 1 439 62 62 GLN HB2 H 1.74 0.010 1 440 62 62 GLN HB3 H 1.84 0.010 1 441 62 62 GLN C C 175.41 0.040 1 442 62 62 GLN CA C 55.58 0.040 1 443 62 62 GLN CB C 29.00 0.040 1 444 62 62 GLN N N 123.80 0.040 1 445 63 63 LYS H H 8.12 0.010 1 446 63 63 LYS HA H 4.05 0.010 1 447 63 63 LYS HB2 H 1.50 0.010 1 448 63 63 LYS HB3 H 1.59 0.010 1 449 63 63 LYS C C 175.98 0.040 1 450 63 63 LYS CA C 56.16 0.040 1 451 63 63 LYS CB C 32.85 0.040 1 452 63 63 LYS N N 122.55 0.040 1 453 64 64 GLU H H 8.18 0.010 1 454 64 64 GLU HA H 4.17 0.010 1 455 64 64 GLU HB2 H 1.76 0.010 1 456 64 64 GLU HB3 H 1.89 0.010 1 457 64 64 GLU C C 175.50 0.040 1 458 64 64 GLU CA C 55.46 0.040 1 459 64 64 GLU CB C 28.71 0.040 1 460 64 64 GLU N N 121.10 0.040 1 461 65 65 SER H H 8.22 0.010 1 462 65 65 SER HA H 4.29 0.010 1 463 65 65 SER HB2 H 3.62 0.010 1 464 65 65 SER HB3 H 3.69 0.010 1 465 65 65 SER C C 174.31 0.040 1 466 65 65 SER CA C 58.02 0.040 1 467 65 65 SER CB C 63.62 0.040 1 468 65 65 SER N N 116.83 0.040 1 469 66 66 THR H H 8.03 0.010 1 470 66 66 THR HA H 4.11 0.010 1 471 66 66 THR HB H 4.01 0.010 1 472 66 66 THR C C 173.78 0.040 1 473 66 66 THR CA C 61.53 0.040 1 474 66 66 THR CB C 69.31 0.040 1 475 66 66 THR N N 115.64 0.040 1 476 67 67 LEU H H 7.90 0.010 1 477 67 67 LEU HA H 4.05 0.010 1 478 67 67 LEU HB2 H 1.31 0.010 1 479 67 67 LEU HB3 H 1.23 0.010 1 480 67 67 LEU C C 176.26 0.040 1 481 67 67 LEU CA C 54.89 0.040 1 482 67 67 LEU CB C 42.27 0.040 1 483 67 67 LEU N N 123.90 0.040 1 484 68 68 HIS H H 8.42 0.010 1 485 68 68 HIS HA H 4.50 0.010 1 486 68 68 HIS HB2 H 2.91 0.010 1 487 68 68 HIS HB3 H 3.01 0.010 1 488 68 68 HIS C C 173.32 0.040 1 489 68 68 HIS CA C 54.45 0.040 1 490 68 68 HIS CB C 28.51 0.040 1 491 68 68 HIS N N 119.99 0.040 1 492 69 69 LEU H H 8.09 0.010 1 493 69 69 LEU HA H 4.13 0.010 1 494 69 69 LEU HB2 H 1.34 0.010 1 495 69 69 LEU HB3 H 1.26 0.010 1 496 69 69 LEU C C 176.13 0.040 1 497 69 69 LEU CA C 54.71 0.040 1 498 69 69 LEU CB C 42.36 0.040 1 499 69 69 LEU N N 124.19 0.040 1 500 70 70 VAL H H 8.16 0.010 1 501 70 70 VAL HA H 3.85 0.010 1 502 70 70 VAL HB H 1.77 0.010 1 503 70 70 VAL C C 175.18 0.040 1 504 70 70 VAL CA C 61.92 0.040 1 505 70 70 VAL CB C 32.30 0.040 1 506 70 70 VAL N N 122.71 0.040 1 507 71 71 LEU H H 8.16 0.010 1 508 71 71 LEU HA H 4.14 0.010 1 509 71 71 LEU HB2 H 1.36 0.010 1 510 71 71 LEU HB3 H 1.28 0.010 1 511 71 71 LEU C C 176.25 0.040 1 512 71 71 LEU CA C 54.43 0.040 1 513 71 71 LEU CB C 42.28 0.040 1 514 71 71 LEU N N 126.92 0.040 1 515 72 72 ARG H H 8.26 0.010 1 516 72 72 ARG HA H 4.14 0.010 1 517 72 72 ARG HB2 H 1.50 0.010 1 518 72 72 ARG HB3 H 1.57 0.010 1 519 72 72 ARG CA C 55.45 0.040 1 520 72 72 ARG CB C 30.51 0.040 1 521 72 72 ARG N N 122.83 0.040 1 522 73 73 LEU H H 8.14 0.010 1 523 73 73 LEU HA H 4.12 0.010 1 524 73 73 LEU HB2 H 1.38 0.010 1 525 73 73 LEU HB3 H 1.31 0.010 1 526 73 73 LEU C C 176.77 0.040 1 527 73 73 LEU CA C 54.69 0.040 1 528 73 73 LEU CB C 42.23 0.040 1 529 73 73 LEU N N 124.05 0.040 1 530 74 74 ARG H H 8.34 0.010 1 531 74 74 ARG HA H 4.10 0.010 1 532 74 74 ARG HB2 H 1.54 0.010 1 533 74 74 ARG HB3 H 1.63 0.010 1 534 74 74 ARG C C 176.09 0.040 1 535 74 74 ARG CA C 56.00 0.040 1 536 74 74 ARG CB C 30.60 0.040 1 537 74 74 ARG N N 122.13 0.040 1 538 75 75 GLY H H 8.23 0.010 1 539 75 75 GLY HA2 H 3.75 0.010 2 540 75 75 GLY HA3 H 3.77 0.010 2 541 75 75 GLY C C 173.56 0.040 1 542 75 75 GLY CA C 44.75 0.040 1 543 75 75 GLY N N 110.07 0.040 1 544 76 76 GLY H H 7.97 0.010 1 545 76 76 GLY N N 109.10 0.040 1 stop_ save_ ######################## # Coupling constants # ######################## save_coupling_constants _Saveframe_category coupling_constants _Details . loop_ _Experiment_label '3D CBCA(CO)NH' '3D HBHA(CO)NH' '3D HNCO' '3D HNHB' stop_ _Sample_conditions_label $sample_conditions_1 _Spectrometer_frequency_1H 800 _Mol_system_component_name Ubiquitin _Text_data_format . _Text_data . loop_ _Coupling_constant_ID _Coupling_constant_code _Atom_one_residue_seq_code _Atom_one_residue_label _Atom_one_name _Atom_two_residue_seq_code _Atom_two_residue_label _Atom_two_name _Coupling_constant_value _Coupling_constant_min_value _Coupling_constant_max_value _Coupling_constant_value_error 1 3JHAHB 3 ILE HA 3 ILE HB 7.46078 . . 0.2912 2 3JHAHB 4 PHE HA 4 PHE HB3 5.43586 . . 0.1500 3 3JHAHB 4 PHE HA 4 PHE HB2 8.62783 . . 0.1500 4 3JHAHB 5 VAL HA 5 VAL HB 6.90899 . . 0.1372 5 3JHAHB 6 LYS HA 6 LYS HB3 5.60800 . . 0.1500 6 3JHAHB 6 LYS HA 6 LYS HB2 7.53100 . . 0.1500 7 3JHAHB 7 THR HA 7 THR HB 4.99516 . . 0.1500 8 3JHAHB 8 LEU HA 8 LEU HB2 8.32302 . . 0.1500 9 3JHAHB 8 LEU HA 8 LEU HB3 4.48863 . . 0.1500 10 3JHAHB 9 THR HA 9 THR HB 4.56873 . . 0.1500 11 3JHAHB 11 LYS HA 11 LYS HB3 5.10628 . . 0.1500 12 3JHAHB 11 LYS HA 11 LYS HB2 7.74957 . . 0.1500 13 3JHAHB 13 ILE HA 13 ILE HB 7.16664 . . 0.2963 14 3JHAHB 14 THR HA 14 THR HB 5.23400 . . 0.1500 15 3JHAHB 16 GLU HA 16 GLU HB3 5.38568 . . 0.1558 16 3JHAHB 16 GLU HA 16 GLU HB2 7.88856 . . 0.1290 17 3JHAHB 17 VAL HA 17 VAL HB 7.18523 . . 0.1564 18 3JHAHB 20 SER HA 20 SER HB3 4.86407 . . 0.1301 19 3JHAHB 20 SER HA 20 SER HB2 4.85267 . . 0.1806 20 3JHAHB 21 ASP HA 21 ASP HB3 5.49106 . . 0.1292 21 3JHAHB 21 ASP HA 21 ASP HB2 5.97207 . . 0.1502 22 3JHAHB 22 THR HA 22 THR HB 4.89600 . . 0.1500 23 3JHAHB 24 GLU HA 24 GLU HB3 4.96374 . . 0.1500 24 3JHAHB 24 GLU HA 24 GLU HB2 7.95026 . . 0.1500 25 3JHAHB 26 VAL HA 26 VAL HB 6.45300 . . 0.1500 26 3JHAHB 27 LYS HA 27 LYS HB3 4.97110 . . 0.1500 27 3JHAHB 27 LYS HA 27 LYS HB2 8.23715 . . 0.1500 28 3JHAHB 29 LYS HA 29 LYS HB3 5.36561 . . 0.2332 29 3JHAHB 29 LYS HA 29 LYS HB2 7.44851 . . 0.2138 30 3JHAHB 30 ILE HA 30 ILE HB 7.86478 . . 0.1582 31 3JHAHB 31 GLN HA 31 GLN HB3 4.91623 . . 0.1500 32 3JHAHB 31 GLN HA 31 GLN HB2 7.90178 . . 0.1500 33 3JHAHB 32 ASP HA 32 ASP HB3 5.67692 . . 0.1500 34 3JHAHB 32 ASP HA 32 ASP HB2 6.74192 . . 0.1500 35 3JHAHB 33 LYS HA 33 LYS HB3 4.73997 . . 0.1584 36 3JHAHB 33 LYS HA 33 LYS HB2 7.98503 . . 0.1308 37 3JHAHB 34 GLU HA 34 GLU HB3 4.84429 . . 0.1518 38 3JHAHB 34 GLU HA 34 GLU HB2 8.07249 . . 0.1490 39 3JHAHB 40 GLN HA 40 GLN HB3 4.52293 . . 0.1487 40 3JHAHB 40 GLN HA 40 GLN HB2 8.07342 . . 0.1515 41 3JHAHB 41 GLN HA 41 GLN HB3 5.07281 . . 0.1519 42 3JHAHB 41 GLN HA 41 GLN HB2 7.91207 . . 0.1550 43 3JHAHB 42 ARG HA 42 ARG HB2 7.29300 . . 0.1500 44 3JHAHB 42 ARG HA 42 ARG HB3 5.08000 . . 0.1500 45 3JHAHB 43 LEU HA 43 LEU HB2 8.95634 . . 0.1509 46 3JHAHB 43 LEU HA 43 LEU HB3 4.84396 . . 0.1531 47 3JHAHB 44 ILE HA 44 ILE HB 7.97155 . . 0.1519 48 3JHAHB 45 PHE HA 45 PHE HB3 5.81980 . . 0.1524 49 3JHAHB 45 PHE HA 45 PHE HB2 8.09167 . . 0.1500 50 3JHAHB 48 LYS HA 48 LYS HB3 4.78300 . . 0.1500 51 3JHAHB 48 LYS HA 48 LYS HB2 7.60900 . . 0.1500 52 3JHAHB 49 GLN HA 49 GLN HB3 4.95700 . . 0.1500 53 3JHAHB 49 GLN HA 49 GLN HB2 7.75600 . . 0.1500 54 3JHAHB 50 LEU HA 50 LEU HB2 9.28618 . . 0.1500 55 3JHAHB 50 LEU HA 50 LEU HB3 4.68362 . . 0.1517 56 3JHAHB 51 GLU HA 51 GLU HB3 4.95694 . . 0.2691 57 3JHAHB 51 GLU HA 51 GLU HB2 8.07831 . . 0.1345 58 3JHAHB 52 ASP HA 52 ASP HB3 5.22355 . . 0.1500 59 3JHAHB 52 ASP HA 52 ASP HB2 6.63321 . . 0.1500 60 3JHAHB 54 ARG HA 54 ARG HB3 4.98726 . . 0.1584 61 3JHAHB 54 ARG HA 54 ARG HB2 7.61774 . . 0.1500 62 3JHAHB 55 THR HA 55 THR HB 5.30000 . . 0.1500 63 3JHAHB 56 LEU HA 56 LEU HB2 8.29155 . . 0.1500 64 3JHAHB 56 LEU HA 56 LEU HB3 5.54438 . . 0.1500 65 3JHAHB 59 TYR HA 59 TYR HB3 6.07499 . . 0.2535 66 3JHAHB 59 TYR HA 59 TYR HB2 7.35095 . . 0.1500 67 3JHAHB 60 ASN HA 60 ASN HB3 6.03455 . . 0.1500 68 3JHAHB 60 ASN HA 60 ASN HB2 6.75657 . . 0.1500 69 3JHAHB 62 GLN HA 62 GLN HB3 5.04400 . . 0.1500 70 3JHAHB 62 GLN HA 62 GLN HB2 8.03100 . . 0.1500 71 3JHAHB 63 LYS HA 63 LYS HB3 4.95965 . . 0.1500 72 3JHAHB 63 LYS HA 63 LYS HB2 7.99943 . . 0.1500 73 3JHAHB 64 GLU HA 64 GLU HB3 4.96629 . . 0.1500 74 3JHAHB 64 GLU HA 64 GLU HB2 7.94945 . . 0.1500 75 3JHAHB 65 SER HA 65 SER HB3 5.34200 . . 0.1500 76 3JHAHB 65 SER HA 65 SER HB2 5.01600 . . 0.1500 77 3JHAHB 66 THR HA 66 THR HB 4.56200 . . 0.1500 78 3JHAHB 67 LEU HA 67 LEU HB2 8.40736 . . 0.2375 79 3JHAHB 67 LEU HA 67 LEU HB3 5.29509 . . 0.1500 80 3JHAHB 68 HIS HA 68 HIS HB3 5.57800 . . 0.1500 81 3JHAHB 68 HIS HA 68 HIS HB2 8.07300 . . 0.1500 82 3JHAHB 69 LEU HA 69 LEU HB2 8.45800 . . 0.1500 83 3JHAHB 69 LEU HA 69 LEU HB3 4.47600 . . 0.1500 84 3JHAHB 70 VAL HA 70 VAL HB 7.96213 . . 0.1500 85 3JHAHB 71 LEU HA 71 LEU HB2 9.05070 . . 0.1500 86 3JHAHB 71 LEU HA 71 LEU HB3 5.01219 . . 0.1500 87 3JHAHB 73 LEU HA 73 LEU HB2 9.37009 . . 0.2837 88 3JHAHB 73 LEU HA 73 LEU HB3 4.46634 . . 0.1500 89 3JHAHB 74 ARG HA 74 ARG HB3 5.18893 . . 0.1500 90 3JHAHB 74 ARG HA 74 ARG HB2 7.46395 . . 0.1500 91 3JNHB 4 PHE N 4 PHE HB3 3.57650 . . 0.1000 92 3JNHB 4 PHE N 4 PHE HB2 1.77800 . . 0.1000 93 3JNHB 6 LYS N 6 LYS HB3 3.27850 . . 0.1000 94 3JNHB 6 LYS N 6 LYS HB2 1.78400 . . 0.1000 95 3JNHB 7 THR N 7 THR HB 2.30900 . . 0.1000 96 3JNHB 8 LEU N 8 LEU HB2 1.90800 . . 0.1000 97 3JNHB 8 LEU N 8 LEU HB3 3.71900 . . 0.1000 98 3JNHB 9 THR N 9 THR HB 2.43750 . . 0.1000 99 3JNHB 11 LYS N 11 LYS HB3 3.49750 . . 0.1000 100 3JNHB 11 LYS N 11 LYS HB2 1.51050 . . 0.1000 101 3JNHB 13 ILE N 13 ILE HB 2.26100 . . 0.1000 102 3JNHB 14 THR N 14 THR HB 2.00450 . . 0.1000 103 3JNHB 16 GLU N 16 GLU HB3 3.48300 . . 0.1000 104 3JNHB 16 GLU N 16 GLU HB2 1.88750 . . 0.1000 105 3JNHB 17 VAL N 17 VAL HB 2.03550 . . 0.1000 106 3JNHB 18 GLU N 18 GLU HB3 3.83750 . . 0.1000 107 3JNHB 18 GLU N 18 GLU HB2 2.01100 . . 0.1000 108 3JNHB 20 SER N 20 SER HB2 1.94650 . . 0.1000 109 3JNHB 20 SER N 20 SER HB3 2.30200 . . 0.1000 110 3JNHB 21 ASP N 21 ASP HB3 2.54600 . . 0.1000 111 3JNHB 21 ASP N 21 ASP HB2 2.53550 . . 0.1000 112 3JNHB 22 THR N 22 THR HB 2.27650 . . 0.1000 113 3JNHB 23 ILE N 23 ILE HB 2.15950 . . 0.1000 114 3JNHB 24 GLU N 24 GLU HB2 1.81500 . . 0.1000 115 3JNHB 24 GLU N 24 GLU HB3 3.46500 . . 0.1000 116 3JNHB 25 ASN N 25 ASN HB3 2.83250 . . 0.1000 117 3JNHB 25 ASN N 25 ASN HB2 2.03500 . . 0.1000 118 3JNHB 26 VAL N 26 VAL HB 2.46900 . . 0.1000 119 3JNHB 27 LYS N 27 LYS HB2 1.72900 . . 0.1000 120 3JNHB 27 LYS N 27 LYS HB3 3.37700 . . 0.1000 121 3JNHB 29 LYS N 29 LYS HB3 3.44200 . . 0.1000 122 3JNHB 29 LYS N 29 LYS HB2 1.94700 . . 0.1000 123 3JNHB 30 ILE N 30 ILE HB 2.14400 . . 0.1000 124 3JNHB 31 GLN N 31 GLN HB3 3.41900 . . 0.1000 125 3JNHB 31 GLN N 31 GLN HB2 1.94150 . . 0.1000 126 3JNHB 32 ASP N 32 ASP HB3 2.90700 . . 0.1000 127 3JNHB 32 ASP N 32 ASP HB2 2.18750 . . 0.1000 128 3JNHB 33 LYS N 33 LYS HB3 3.76850 . . 0.1000 129 3JNHB 33 LYS N 33 LYS HB2 2.06950 . . 0.1000 130 3JNHB 34 GLU N 34 GLU HB3 3.64300 . . 0.1000 131 3JNHB 34 GLU N 34 GLU HB2 2.06900 . . 0.1000 132 3JNHB 36 ILE N 36 ILE HB 2.17050 . . 0.1000 133 3JNHB 40 GLN N 40 GLN HB3 3.54750 . . 0.1000 134 3JNHB 40 GLN N 40 GLN HB2 1.92250 . . 0.1000 135 3JNHB 41 GLN N 41 GLN HB3 3.57600 . . 0.1000 136 3JNHB 41 GLN N 41 GLN HB2 1.95050 . . 0.1000 137 3JNHB 42 ARG N 42 ARG HB3 3.17750 . . 0.1000 138 3JNHB 42 ARG N 42 ARG HB2 1.97750 . . 0.1000 139 3JNHB 43 LEU N 43 LEU HB2 1.68500 . . 0.1000 140 3JNHB 43 LEU N 43 LEU HB3 4.00700 . . 0.1000 141 3JNHB 44 ILE N 44 ILE HB 2.05150 . . 0.1000 142 3JNHB 45 PHE N 45 PHE HB3 3.43650 . . 0.1000 143 3JNHB 45 PHE N 45 PHE HB2 1.75350 . . 0.1000 144 3JNHB 48 LYS N 48 LYS HB3 3.40450 . . 0.1000 145 3JNHB 48 LYS N 48 LYS HB2 1.93700 . . 0.1000 146 3JNHB 49 GLN N 49 GLN HB3 3.43700 . . 0.1000 147 3JNHB 49 GLN N 49 GLN HB2 1.91250 . . 0.1000 148 3JNHB 50 LEU N 50 LEU HB3 3.91650 . . 0.1000 149 3JNHB 50 LEU N 50 LEU HB2 1.69500 . . 0.1000 150 3JNHB 51 GLU N 51 GLU HB2 1.91900 . . 0.1000 151 3JNHB 51 GLU N 51 GLU HB3 3.45600 . . 0.1000 152 3JNHB 52 ASP N 52 ASP HB3 2.74150 . . 0.1000 153 3JNHB 52 ASP N 52 ASP HB2 2.29900 . . 0.1000 154 3JNHB 54 ARG N 54 ARG HB3 3.39600 . . 0.1000 155 3JNHB 54 ARG N 54 ARG HB2 1.66450 . . 0.1000 156 3JNHB 55 THR N 55 THR HB 2.19400 . . 0.1000 157 3JNHB 56 LEU N 56 LEU HB3 3.65300 . . 0.1000 158 3JNHB 56 LEU N 56 LEU HB2 1.94700 . . 0.1000 159 3JNHB 58 ASP N 58 ASP HB2 2.24400 . . 0.1000 160 3JNHB 58 ASP N 58 ASP HB3 2.61500 . . 0.1000 161 3JNHB 59 TYR N 59 TYR HB2 2.00000 . . 0.1000 162 3JNHB 59 TYR N 59 TYR HB3 2.88900 . . 0.1000 163 3JNHB 60 ASN N 60 ASN HB3 2.87900 . . 0.1000 164 3JNHB 60 ASN N 60 ASN HB2 1.98350 . . 0.1000 165 3JNHB 61 ILE N 61 ILE HB 2.38800 . . 0.1000 166 3JNHB 62 GLN N 62 GLN HB2 1.82000 . . 0.1000 167 3JNHB 62 GLN N 62 GLN HB3 3.54200 . . 0.1000 168 3JNHB 64 GLU N 64 GLU HB3 3.45800 . . 0.1000 169 3JNHB 64 GLU N 64 GLU HB2 2.03400 . . 0.1000 170 3JNHB 65 SER N 65 SER HB3 2.23500 . . 0.1000 171 3JNHB 65 SER N 65 SER HB2 2.01550 . . 0.1000 172 3JNHB 66 THR N 66 THR HB 2.32700 . . 0.1000 173 3JNHB 67 LEU N 67 LEU HB2 1.74450 . . 0.1000 174 3JNHB 67 LEU N 67 LEU HB3 3.51350 . . 0.1000 175 3JNHB 68 HIS N 68 HIS HB3 3.26300 . . 0.1000 176 3JNHB 68 HIS N 68 HIS HB2 2.00800 . . 0.1000 177 3JNHB 69 LEU N 69 LEU HB2 1.72450 . . 0.1000 178 3JNHB 69 LEU N 69 LEU HB3 3.67300 . . 0.1000 179 3JNHB 70 VAL N 70 VAL HB 2.05150 . . 0.1000 180 3JNHB 71 LEU N 71 LEU HB2 1.65300 . . 0.1000 181 3JNHB 71 LEU N 71 LEU HB3 3.75350 . . 0.1000 182 3JNHB 72 ARG N 72 ARG HB3 3.28500 . . 0.1000 183 3JNHB 72 ARG N 72 ARG HB2 1.81350 . . 0.1000 184 3JNHB 73 LEU N 73 LEU HB2 1.70150 . . 0.1000 185 3JNHB 73 LEU N 73 LEU HB3 4.28700 . . 0.1000 186 3JNHB 74 ARG N 74 ARG HB3 3.19750 . . 0.1000 187 3JNHB 74 ARG N 74 ARG HB2 1.85150 . . 0.1000 188 3JHBC' 3 ILE HB 3 ILE C' 1.74250 . . 0.1000 189 3JHBC' 5 VAL HB 5 VAL C' 1.75200 . . 0.1000 190 3JHBC' 7 THR HB 7 THR C' 1.41350 . . 0.1735 191 3JHBC' 8 LEU HB2 8 LEU C' 2.28600 . . 0.3570 192 3JHBC' 8 LEU HB3 8 LEU C' 1.82950 . . 0.3845 193 3JHBC' 9 THR HB 9 THR C' 1.34300 . . 0.1000 194 3JHBC' 11 LYS HB3 11 LYS C' 2.22550 . . 0.1000 195 3JHBC' 11 LYS HB2 11 LYS C' 2.98150 . . 0.1015 196 3JHBC' 13 ILE HB 13 ILE C' 1.80250 . . 0.1000 197 3JHBC' 14 THR HB 14 THR C' 1.78250 . . 0.1395 198 3JHBC' 16 GLU HB3 16 GLU C' 1.91300 . . 0.1000 199 3JHBC' 16 GLU HB2 16 GLU C' 3.11650 . . 0.1000 200 3JHBC' 17 VAL HB 17 VAL C' 1.53700 . . 0.1380 201 3JHBC' 20 SER HB3 20 SER C' 2.71450 . . 0.1765 202 3JHBC' 20 SER HB2 20 SER C' 3.25100 . . 0.1000 203 3JHBC' 21 ASP HB3 21 ASP C' 3.35700 . . 0.1000 204 3JHBC' 21 ASP HB2 21 ASP C' 2.34200 . . 0.1000 205 3JHBC' 22 THR HB 22 THR C' 1.31900 . . 0.1360 206 3JHBC' 24 GLU HB3 24 GLU C' 1.93200 . . 0.3750 207 3JHBC' 24 GLU HB2 24 GLU C' 2.84450 . . 0.1000 208 3JHBC' 27 LYS HB3 27 LYS C' 1.97950 . . 0.1000 209 3JHBC' 27 LYS HB2 27 LYS C' 2.78800 . . 0.1000 210 3JHBC' 29 LYS HB3 29 LYS C' 2.07600 . . 0.1440 211 3JHBC' 29 LYS HB2 29 LYS C' 3.09950 . . 0.1000 212 3JHBC' 30 ILE HB 30 ILE C' 1.83600 . . 0.1000 213 3JHBC' 31 GLN HB3 31 GLN C' 2.04200 . . 0.1000 214 3JHBC' 31 GLN HB2 31 GLN C' 2.85100 . . 0.1000 215 3JHBC' 32 ASP HB3 32 ASP C' 3.28350 . . 0.2335 216 3JHBC' 32 ASP HB2 32 ASP C' 3.23850 . . 0.2695 217 3JHBC' 33 LYS HB3 33 LYS C' 2.10700 . . 0.1000 218 3JHBC' 33 LYS HB2 33 LYS C' 2.73900 . . 0.1000 219 3JHBC' 34 GLU HB3 34 GLU C' 2.10400 . . 0.2660 220 3JHBC' 34 GLU HB2 34 GLU C' 2.53200 . . 0.1790 221 3JHBC' 40 GLN HB3 40 GLN C' 1.89450 . . 0.1045 222 3JHBC' 40 GLN HB2 40 GLN C' 2.57600 . . 0.1000 223 3JHBC' 41 GLN HB3 41 GLN C' 2.37250 . . 0.1255 224 3JHBC' 41 GLN HB2 41 GLN C' 3.03450 . . 0.1000 225 3JHBC' 42 ARG HB3 42 ARG C' 1.90300 . . 0.1820 226 3JHBC' 42 ARG HB2 42 ARG C' 2.64350 . . 0.3045 227 3JHBC' 43 LEU HB2 43 LEU C' 2.87200 . . 0.1000 228 3JHBC' 43 LEU HB3 43 LEU C' 1.57050 . . 0.1000 229 3JHBC' 44 ILE HB 44 ILE C' 0.90200 . . 0.4990 230 3JHBC' 45 PHE HB3 45 PHE C' 1.97200 . . 0.1000 231 3JHBC' 45 PHE HB2 45 PHE C' 3.10200 . . 0.1000 232 3JHBC' 48 LYS HB3 48 LYS C' 2.13100 . . 0.1000 233 3JHBC' 48 LYS HB2 48 LYS C' 2.89400 . . 0.1000 234 3JHBC' 51 GLU HB3 51 GLU C' 1.99100 . . 0.1000 235 3JHBC' 51 GLU HB2 51 GLU C' 2.68000 . . 0.1000 236 3JHBC' 52 ASP HB3 52 ASP C' 2.63300 . . 0.6905 237 3JHBC' 52 ASP HB2 52 ASP C' 2.21800 . . 0.1590 238 3JHBC' 54 ARG HB3 54 ARG C' 2.32950 . . 0.1000 239 3JHBC' 54 ARG HB2 54 ARG C' 2.66500 . . 0.1000 240 3JHBC' 59 TYR HB3 59 TYR C' 2.12450 . . 0.2505 241 3JHBC' 59 TYR HB2 59 TYR C' 3.18000 . . 0.1000 242 3JHBC' 60 ASN HB3 60 ASN C' 2.60800 . . 0.1000 243 3JHBC' 60 ASN HB2 60 ASN C' 3.22050 . . 0.1000 244 3JHBC' 63 LYS HB3 63 LYS C' 2.31550 . . 0.2405 245 3JHBC' 63 LYS HB2 63 LYS C' 3.38000 . . 0.4490 246 3JHBC' 64 GLU HB3 64 GLU C' 2.37900 . . 0.1000 247 3JHBC' 64 GLU HB2 64 GLU C' 2.85200 . . 0.1000 248 3JHBC' 65 SER HB3 65 SER C' 2.65100 . . 0.1000 249 3JHBC' 65 SER HB2 65 SER C' 3.29100 . . 0.1000 250 3JHBC' 67 LEU HB2 67 LEU C' 3.22300 . . 0.1000 251 3JHBC' 67 LEU HB3 67 LEU C' 1.73050 . . 0.1000 252 3JHBC' 68 HIS HB2 68 HIS C' 2.92750 . . 0.1000 253 3JHBC' 69 LEU HB2 69 LEU C' 3.16800 . . 0.1000 254 3JHBC' 69 LEU HB3 69 LEU C' 1.75200 . . 0.1000 255 3JHBC' 70 VAL HB 70 VAL C' 1.42300 . . 0.1610 256 3JHBC' 71 LEU HB2 71 LEU C' 2.89750 . . 0.1000 257 3JHBC' 71 LEU HB3 71 LEU C' 1.61750 . . 0.1000 258 3JHBC' 72 ARG HB3 72 ARG C' 2.08150 . . 0.1000 259 3JHBC' 72 ARG HB2 72 ARG C' 3.07800 . . 0.1000 260 3JHBC' 73 LEU HB2 73 LEU C' 2.52400 . . 0.1000 261 3JHBC' 73 LEU HB3 73 LEU C' 1.62950 . . 0.1000 262 3JHBC' 74 ARG HB3 74 ARG C' 1.94350 . . 0.1000 263 3JHBC' 74 ARG HB2 74 ARG C' 2.51000 . . 0.1000 stop_ save_