data_15689 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Automated NMR Structure of the UBB by FAPSY ; _BMRB_accession_number 15689 _BMRB_flat_file_name bmr15689.str _Entry_type original _Submission_date 2008-03-21 _Accession_date 2008-03-21 _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 Lee Woonghee . . 2 Jung Jin-Won . . 3 Lee Weontae . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 509 "13C chemical shifts" 294 "15N chemical shifts" 92 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-05-12 original author . stop_ _Original_release_date 2009-05-12 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'The Automated Suite for Protein Structure by NMR Spectroscopy' _Citation_status 'in preparation' _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Lee Woonghee . . 2 Jung Jin-Won . . 3 Lee Weontae . . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name UBB _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label UBB $UBB stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_UBB _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common UBB _Molecular_mass 11539.073 _Mol_thiol_state unknown _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 103 _Mol_residue_sequence ; GSLVPRGSMQIFVKTLTGKT ITLEVEPSDTIENVKAKIQD KEGIPPDQQRLIFAGKQLED GRTLSEYNIQKESTLHLVLR LRGYADLREDPDRQDHHPGS GAQ ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 LEU 4 VAL 5 PRO 6 ARG 7 GLY 8 SER 9 MET 10 GLN 11 ILE 12 PHE 13 VAL 14 LYS 15 THR 16 LEU 17 THR 18 GLY 19 LYS 20 THR 21 ILE 22 THR 23 LEU 24 GLU 25 VAL 26 GLU 27 PRO 28 SER 29 ASP 30 THR 31 ILE 32 GLU 33 ASN 34 VAL 35 LYS 36 ALA 37 LYS 38 ILE 39 GLN 40 ASP 41 LYS 42 GLU 43 GLY 44 ILE 45 PRO 46 PRO 47 ASP 48 GLN 49 GLN 50 ARG 51 LEU 52 ILE 53 PHE 54 ALA 55 GLY 56 LYS 57 GLN 58 LEU 59 GLU 60 ASP 61 GLY 62 ARG 63 THR 64 LEU 65 SER 66 GLU 67 TYR 68 ASN 69 ILE 70 GLN 71 LYS 72 GLU 73 SER 74 THR 75 LEU 76 HIS 77 LEU 78 VAL 79 LEU 80 ARG 81 LEU 82 ARG 83 GLY 84 TYR 85 ALA 86 ASP 87 LEU 88 ARG 89 GLU 90 ASP 91 PRO 92 ASP 93 ARG 94 GLN 95 ASP 96 HIS 97 HIS 98 PRO 99 GLY 100 SER 101 GLY 102 ALA 103 GLN 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 72.82 76 97.33 98.67 4.84e-43 BMRB 11547 ubiquitin 72.82 76 97.33 98.67 4.84e-43 BMRB 15047 denatured_ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 15410 Ubi 72.82 76 98.67 100.00 8.41e-44 BMRB 15907 Ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 16582 Ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 16626 Ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 16895 UBB+1 100.00 103 100.00 100.00 2.59e-67 BMRB 17181 ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 17439 ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 17769 Ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 17919 entity 72.82 76 98.67 100.00 8.41e-44 BMRB 18582 ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 18583 ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 18584 ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 18610 Ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 18611 Ubiquitin_A_state 72.82 76 98.67 100.00 8.41e-44 BMRB 18737 UBIQUITIN 72.82 76 98.67 100.00 8.41e-44 BMRB 19406 entity 72.82 152 98.67 100.00 8.78e-43 BMRB 19412 entity 72.82 152 98.67 100.00 8.78e-43 BMRB 25070 Ubiquitin 72.82 79 98.67 100.00 1.11e-43 BMRB 25123 Ubiquitin 69.90 72 98.61 100.00 1.32e-41 BMRB 26604 Ubiquitin_(microcrystalline) 72.82 76 98.67 100.00 8.41e-44 BMRB 4245 ubiquitin 72.82 76 98.67 100.00 8.41e-44 BMRB 4375 Ubiquitin 72.82 76 98.67 100.00 8.41e-44 PDB 1AAR "Structure Of A Diubiquitin Conjugate And A Model For Interaction With Ubiquitin Conjugating Enzyme (E2)" 72.82 76 98.67 100.00 8.41e-44 PDB 1CMX "Structural Basis For The Specificity Of Ubiquitin C- Terminal Hydrolases" 72.82 76 98.67 100.00 8.51e-44 PDB 1D3Z "Ubiquitin Nmr Structure" 72.82 76 98.67 100.00 8.41e-44 PDB 1F9J "Structure Of A New Crystal Form Of Tetraubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 1FXT "Structure Of A Conjugating Enzyme-Ubiquitin Thiolester Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 1G6J "Structure Of Recombinant Human Ubiquitin In Aot Reverse Micelles" 71.84 76 98.65 100.00 1.08e-42 PDB 1GJZ "Solution Structure Of A Dimeric N-Terminal Fragment Of Human Ubiquitin" 51.46 53 100.00 100.00 2.07e-27 PDB 1NBF "Crystal Structure Of A Ubp-Family Deubiquitinating Enzyme In Isolation And In Complex With Ubiquitin Aldehyde" 72.82 76 98.67 100.00 8.51e-44 PDB 1P3Q "Mechanism Of Ubiquitin Recognition By The Cue Domain Of Vps9" 72.82 76 98.67 100.00 8.41e-44 PDB 1Q5W "Ubiquitin Recognition By Npl4 Zinc-Fingers" 72.82 76 98.67 100.00 8.41e-44 PDB 1S1Q "Tsg101(Uev) Domain In Complex With Ubiquitin" 71.84 76 98.65 100.00 1.08e-42 PDB 1TBE "Structure Of Tetraubiquitin Shows How Multiubiquitin Chains Can Be Formed" 72.82 76 98.67 100.00 8.41e-44 PDB 1UBI "Synthetic Structural And Biological Studies Of The Ubiquitin System. Part 1" 72.82 76 98.67 100.00 8.41e-44 PDB 1UBQ "Structure Of Ubiquitin Refined At 1.8 Angstroms Resolution" 72.82 76 98.67 100.00 8.41e-44 PDB 1UZX "A Complex Of The Vps23 Uev With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 1V80 "Solution Structures Of Ubiquitin At 30 Bar And 3 Kbar" 72.82 76 98.67 100.00 8.41e-44 PDB 1V81 "Solution Structures Of Ubiquitin At 30 Bar And 3 Kbar" 72.82 76 98.67 100.00 8.41e-44 PDB 1WR6 "Crystal Structure Of Gga3 Gat Domain In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 1WRD "Crystal Structure Of Tom1 Gat Domain In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 1XD3 "Crystal Structure Of Uchl3-Ubvme Complex" 72.82 75 98.67 100.00 8.28e-44 PDB 1XQQ "Simultaneous Determination Of Protein Structure And Dynamics" 72.82 76 98.67 100.00 8.41e-44 PDB 1YD8 "Complex Of Human Gga3 Gat Domain And Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 1YIW "X-Ray Crystal Structure Of A Chemically Synthesized Ubiquitin" 72.82 76 97.33 100.00 4.59e-43 PDB 1ZGU "Solution Structure Of The Human Mms2-Ubiquitin Complex" 72.82 76 97.33 100.00 3.07e-43 PDB 2AYO "Structure Of Usp14 Bound To Ubquitin Aldehyde" 72.82 76 98.67 100.00 8.51e-44 PDB 2BGF "Nmr Structure Of Lys48-Linked Di-Ubiquitin Using Chemical Shift Perturbation Data Together With Rdcs And 15n- Relaxation Data" 72.82 76 98.67 100.00 8.41e-44 PDB 2C7M "Human Rabex-5 Residues 1-74 In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2C7N "Human Rabex-5 Residues 1-74 In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2D3G "Double Sided Ubiquitin Binding Of Hrs-Uim" 72.82 76 98.67 100.00 8.41e-44 PDB 2DEN "Solution Structure Of The Ubiquitin-Associated Domain Of Human Bmsc-Ubp And Its Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2DX5 "The Complex Structure Between The Mouse Eap45-Glue Domain And Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2FCQ "X-Ray Crystal Structure Of A Chemically Synthesized Ubiquitin With A Cubic Space Group" 72.82 76 97.33 100.00 4.59e-43 PDB 2FID "Crystal Structure Of A Bovine Rabex-5 Fragment Complexed With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2FIF "Crystal Structure Of A Bovine Rabex-5 Fragment Complexed With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2FUH "Solution Structure Of The Ubch5cUB NON-Covalent Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 2G45 "Co-Crystal Structure Of Znf Ubp Domain From The Deubiquitinating Enzyme Isopeptidase T (Isot) In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2GMI Mms2UBC13~UBIQUITIN 72.82 76 98.67 100.00 8.41e-44 PDB 2HD5 "Usp2 In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2HTH "Structural Basis For Ubiquitin Recognition By The Human Eap45ESCRT-Ii Glue Domain" 72.82 76 98.67 100.00 8.41e-44 PDB 2IBI "Covalent Ubiquitin-Usp2 Complex" 72.82 75 98.67 100.00 8.28e-44 PDB 2J7Q "Crystal Structure Of The Ubiquitin-Specific Protease Encoded By Murine Cytomegalovirus Tegument Protein M48 In Complex With A U" 72.82 75 98.67 100.00 8.28e-44 PDB 2JF5 "Crystal Structure Of Lys63-Linked Di-Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2JRI "Solution Structure Of The Josephin Domain Of Ataxin-3 In Complex With Ubiquitin Molecule." 72.82 76 98.67 100.00 8.41e-44 PDB 2JY6 "Solution Structure Of The Complex Of Ubiquitin And Ubiquilin 1 Uba Domain" 72.82 76 98.67 100.00 8.41e-44 PDB 2JZZ "Solid-State Nmr Structure Of Microcrystalline Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2K25 "Automated Nmr Structure Of The Ubb By Fapsy" 100.00 103 100.00 100.00 2.59e-67 PDB 2K39 "Recognition Dynamics Up To Microseconds Revealed From Rdc Derived Ubiquitin Ensemble In Solution" 72.82 76 98.67 100.00 8.41e-44 PDB 2K6D "Cin85 Sh3-C Domain In Complex With Ubiquitin" 72.82 76 98.67 100.00 6.70e-44 PDB 2K8B "Solution Structure Of Plaa Family Ubiquitin Binding Domain (Pfuc) Cis Isomer In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2K8C "Solution Structure Of Plaa Family Ubiquitin Binding Domain (Pfuc) Trans Isomer In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2KDE "Nmr Structure Of Major S5a (196-306):k48 Linked Diubiquitin Species" 72.82 76 98.67 100.00 8.41e-44 PDB 2KDF "Nmr Structure Of Minor S5a (196-306):k48 Linked Diubiquitin Species" 72.82 76 98.67 100.00 8.41e-44 PDB 2KHW "Solution Structure Of The Human Polymerase Iota Ubm2- Ubiquitin Complex" 72.82 79 98.67 100.00 1.11e-43 PDB 2KJH "Nmr Based Structural Model Of The Ubch8-Ubiquitin Complex" 72.82 76 98.67 100.00 6.70e-44 PDB 2KLG "Pere Nmr Structure Of Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2KN5 "A Correspondence Between Solution-State Dynamics Of An Individual Protein And The Sequence And Conformational Diversity Of Its " 72.82 76 98.67 100.00 8.41e-44 PDB 2KOX "Nmr Residual Dipolar Couplings Identify Long Range Correlated Motions In The Backbone Of The Protein Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2KTF "Solution Nmr Structure Of Human Polymerase Iota Ubm2 In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2KWU "Solution Structure Of Ubm2 Of Murine Polymerase Iota In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2KWV "Solution Structure Of Ubm1 Of Murine Polymerase Iota In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2KX0 "The Solution Structure Of Ubb+1, Frameshift Mutant Of Ubiquitin B" 100.00 103 100.00 100.00 2.59e-67 PDB 2L0F "Solution Nmr Structure Of Human Polymerase Iota Ubm2 (P692a Mutant) In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2L0T "Solution Structure Of The Complex Of Ubiquitin And The Vhs Domain Of Stam2" 72.82 76 98.67 100.00 8.41e-44 PDB 2L3Z "Proton-Detected 4d Dream Solid-State Nmr Structure Of Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2LD9 "Backbone Structure Of Ubiquitin Determined Using Backbone Amide Noes And Backbone N-H And N-C Rdcs" 72.82 77 98.67 100.00 1.12e-43 PDB 2LJ5 "Description Of The Structural Fluctuations Of Proteins From Structure- Based Calculations Of Residual Dipolar Couplings" 72.82 76 98.67 100.00 8.41e-44 PDB 2LVO "Structure Of The Gp78cue Domain Bound To Monubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2LVP "Gp78cue Domain Bound To The Distal Ubiquitin Of K48-Linked Diubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2LVQ "Gp78cue Domain Bound To The Proximal Ubiquitin Of K48-Linked Diubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2LZ6 "Distinct Ubiquitin Binding Modes Exhibited By Sh3 Domains: Molecular Determinants And Functional Implications" 72.82 76 98.67 100.00 8.41e-44 PDB 2MBB "Solution Structure Of The Human Polymerase Iota Ubm1-ubiquitin Complex" 72.82 78 98.67 100.00 1.04e-43 PDB 2MBH "Nmr Structure Of Eklf(22-40)/ubiquitin Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 2MBO "K11-linked Diubiquitin Average Solution Structure At Ph 6.8, 0 Mm Nacl" 72.82 76 98.67 100.00 8.41e-44 PDB 2MBQ "K11-linked Diubiquitin Average Solution Structure At Ph 6.8, 150 Mm Nacl" 72.82 76 98.67 100.00 8.41e-44 PDB 2MCN "Distinct Ubiquitin Binding Modes Exhibited By Sh3 Domains: Molecular Determinants And Functional Implications" 72.82 76 98.67 100.00 8.41e-44 PDB 2MJ5 "Structure Of The Uba Domain Of Human Nbr1 In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2MJB "Solution Nmr Structure Of Ubiquitin Refined Against Dipolar Couplings In 4 Media" 72.82 76 98.67 100.00 8.41e-44 PDB 2MOR "A Tensor-free Method For The Structural And Dynamical Refinement Of Proteins Using Residual Dipolar Couplings" 72.82 76 98.67 100.00 8.41e-44 PDB 2MRE "Nmr Structure Of The Rad18-ubz/ubiquitin Complex" 72.82 79 98.67 100.00 1.11e-43 PDB 2MRO "Structure Of The Complex Of Ubiquitin And The Uba Domain From Dna- Damage-inducible 1 Protein (ddi1)" 72.82 76 98.67 100.00 8.41e-44 PDB 2MSG "Solid-state Nmr Structure Of Ubiquitin" 69.90 72 98.61 100.00 1.32e-41 PDB 2MUR "Solution Structure Of The Human Faap20 Ubz-ubiquitin Complex" 72.82 78 98.67 100.00 1.04e-43 PDB 2MWS "Structure Of The Complex Of Ubiquitin And The Ubiquitin-like (ubl) Domain Of Ddi1" 72.82 76 97.33 98.67 7.01e-43 PDB 2N2K "Ensemble Structure Of The Closed State Of Lys63-linked Diubiquitin In The Absence Of A Ligand" 68.93 71 98.59 100.00 9.78e-41 PDB 2NR2 "The Mumo (Minimal Under-Restraining Minimal Over- Restraining) Method For The Determination Of Native States Ensembles Of Prote" 72.82 76 98.67 100.00 8.41e-44 PDB 2O6V "Crystal Structure And Solution Nmr Studies Of Lys48-Linked Tetraubiquitin At Neutral Ph" 72.82 76 98.67 100.00 8.41e-44 PDB 2OJR "Structure Of Ubiquitin Solved By Sad Using The Lanthanide- Binding Tag" 73.79 111 97.37 100.00 1.46e-43 PDB 2OOB "Crystal Structure Of The Uba Domain From Cbl-B Ubiquitin Ligase In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2PE9 "Nmr Based Structure Of The Open Conformation Of Lys48- Linked Di-Ubiquitin Using Experimental Global Rotational Diffusion Tenso" 72.82 76 98.67 100.00 8.41e-44 PDB 2PEA "Nmr Based Structure Of The Closed Conformation Of Lys48- Linked Di-Ubiquitin Using Experimental Global Rotational Diffusion Ten" 72.82 76 98.67 100.00 8.41e-44 PDB 2QHO "Crystal Structure Of The Uba Domain From Edd Ubiquitin Ligase In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2RR9 "The Solution Structure Of The K63-Ub2:tuims Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 2RSU "Alternative Structure Of Ubiquitin" 72.82 76 97.33 98.67 4.84e-43 PDB 2RU6 "The Pure Alternative State Of Ubiquitin" 72.82 76 97.33 98.67 4.84e-43 PDB 2W9N "Crystal Structure Of Linear Di-Ubiquitin" 71.84 152 98.65 100.00 9.09e-42 PDB 2WDT "Crystal Structure Of Plasmodium Falciparum Uchl3 In Complex With The Suicide Inhibitor Ubvme" 72.82 76 98.67 100.00 8.51e-44 PDB 2WWZ "Tab2 Nzf Domain In Complex With Lys63-Linked Di-Ubiquitin, P212121" 72.82 76 98.67 100.00 8.41e-44 PDB 2WX0 "Tab2 Nzf Domain In Complex With Lys63-Linked Di-Ubiquitin, P21" 72.82 76 98.67 100.00 8.41e-44 PDB 2WX1 "Tab2 Nzf Domain In Complex With Lys63-Linked Tri-Ubiquitin, P212121" 72.82 76 98.67 100.00 8.41e-44 PDB 2XBB "Nedd4 Hect:ub Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 2XEW "Crystal Structure Of K11-Linked Diubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2XK5 "Crystal Structure Of K6-Linked Diubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2Z59 "Complex Structures Of Mouse Rpn13 (22-130aa) And Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 2ZCC "Ubiquitin Crystallized Under High Pressure" 72.82 76 98.67 100.00 8.41e-44 PDB 2ZNV "Crystal Structure Of Human Amsh-Lp Dub Domain In Complex With Lys63-Linked Ubiquitin Dimer" 72.82 77 98.67 100.00 1.01e-43 PDB 2ZVN "Nemo Cozi Domain Incomplex With Diubiquitin In P212121 Space Group" 74.76 154 98.70 100.00 2.73e-44 PDB 2ZVO "Nemo Cozi Domain In Complex With Diubiquitin In C2 Space Group" 74.76 154 98.70 100.00 2.73e-44 PDB 3A1Q "Crystal Structure Of The Mouse Rap80 Uims In Complex With Lys63-Linked Di-Ubiquitin" 72.82 77 98.67 100.00 1.01e-43 PDB 3A33 "Ubch5b~ubiquitin Conjugate" 72.82 76 98.67 100.00 8.41e-44 PDB 3A9J "Crystal Structure Of The Mouse Tab2-Nzf In Complex With Lys63-Linked Di-Ubiquitin" 72.82 77 98.67 100.00 1.01e-43 PDB 3A9K "Crystal Structure Of The Mouse Tab3-Nzf In Complex With Lys63-Linked Di-Ubiquitin" 72.82 77 98.67 100.00 1.01e-43 PDB 3AI5 "Crystal Structure Of Yeast Enhanced Green Fluorescent Protein- Ubiquitin Fusion Protein" 73.79 307 98.68 100.00 8.99e-42 PDB 3ALB "Cyclic Lys48-Linked Tetraubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3AUL "Crystal Structure Of Wild-Type Lys48-Linked Diubiquitin In An Open Conformation" 72.82 76 98.67 100.00 8.41e-44 PDB 3AXC "Crystal Structure Of Linear Diubiquitin" 74.76 154 98.70 100.00 2.73e-44 PDB 3B08 "Crystal Structure Of The Mouse Hoil1-l-nzf In Complex With Linear Di- Ubiquitin" 72.82 152 98.67 100.00 8.78e-43 PDB 3B0A "Crystal Structure Of The Mouse Hoil1-l-nzf In Complex With Linear Di- Ubiquitin" 72.82 152 98.67 100.00 8.78e-43 PDB 3BY4 "Structure Of Ovarian Tumor (Otu) Domain In Complex With Ubiquitin" 72.82 75 98.67 100.00 8.28e-44 PDB 3C0R "Structure Of Ovarian Tumor (Otu) Domain In Complex With Ubiquitin" 72.82 75 98.67 100.00 8.28e-44 PDB 3DVG "Crystal Structure Of K63-Specific Fab Apu.3a8 Bound To K63-Linked Di- Ubiquitin" 72.82 80 98.67 100.00 1.36e-43 PDB 3DVN "Crystal Structure Of K63-specific Fab Apu2.16 Bound To K63-linked Di- Ubiquitin" 72.82 80 98.67 100.00 1.36e-43 PDB 3EEC "X-Ray Structure Of Human Ubiquitin Cd(Ii) Adduct" 72.82 76 98.67 100.00 8.41e-44 PDB 3EFU "X-Ray Structure Of Human Ubiquitin-Hg(Ii) Adduct" 72.82 76 98.67 100.00 8.41e-44 PDB 3EHV "X-Ray Structure Of Human Ubiquitin Zn(Ii) Adduct" 72.82 76 98.67 100.00 8.41e-44 PDB 3H1U "Structure Of Ubiquitin In Complex With Cd Ions" 72.82 76 98.67 100.00 8.41e-44 PDB 3H7P "Crystal Structure Of K63-Linked Di-Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3H7S "Crystal Structures Of K63-Linked Di- And Tri-Ubiquitin Reveal A Highly Extended Chain Architecture" 73.79 76 97.37 98.68 5.40e-42 PDB 3HM3 "The Structure And Conformation Of Lys-63 Linked Tetra-Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3I3T "Crystal Structure Of Covalent Ubiquitin-usp21 Complex" 72.82 75 98.67 100.00 8.28e-44 PDB 3IFW "Crystal Structure Of The S18y Variant Of Ubiquitin Carboxy T Hydrolase L1 Bound To Ubiquitin Vinylmethylester." 72.82 75 98.67 100.00 8.28e-44 PDB 3IHP "Covalent Ubiquitin-Usp5 Complex" 72.82 75 98.67 100.00 8.28e-44 PDB 3JSV "Crystal Structure Of Mouse Nemo Cozi In Complex With Lys63- Linked Di-Ubiquitin" 72.82 77 98.67 100.00 1.01e-43 PDB 3JVZ E2~ubiquitin-Hect 74.76 81 98.70 100.00 3.01e-45 PDB 3JW0 E2~ubiquitin-Hect 74.76 81 98.70 100.00 3.01e-45 PDB 3K9O "The Crystal Structure Of E2-25k And Ubb+1 Complex" 92.23 96 98.95 100.00 1.89e-60 PDB 3K9P "The Crystal Structure Of E2-25k And Ubiquitin Complex" 72.82 79 98.67 100.00 1.11e-43 PDB 3KVF "Crystal Structure Of The I93m Mutant Of Ubiquitin Carboxy Te Hydrolase L1 Bound To Ubiquitin Vinylmethylester" 72.82 75 98.67 100.00 8.28e-44 PDB 3KW5 "Crystal Structure Of Ubiquitin Carboxy Terminal Hydrolase L1 Ubiquitin Vinylmethylester" 72.82 75 98.67 100.00 8.28e-44 PDB 3LDZ "Crystal Structure Of Human Stam1 Vhs Domain In Complex With Ubiquitin" 70.87 73 98.63 100.00 3.30e-42 PDB 3M3J "A New Crystal Form Of Lys48-Linked Diubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3MHS "Structure Of The Saga Ubp8SGF11SUS1SGF73 DUB MODULE BOUND Ubiquitin Aldehyde" 72.82 76 98.67 100.00 8.51e-44 PDB 3N30 "Crystal Structure Of Cubic Zn3-Hub (Human Ubiquitin) Adduct" 72.82 76 98.67 100.00 8.41e-44 PDB 3N32 "The Crystal Structure Of Human Ubiquitin Adduct With Zeise's Salt" 72.82 76 98.67 100.00 8.41e-44 PDB 3NHE "High Resolution Structure (1.26a) Of Usp2a In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3NOB "Structure Of K11-linked Di-ubiquitin" 72.82 78 98.67 100.00 1.04e-43 PDB 3NS8 "Crystal Structure Of An Open Conformation Of Lys48-Linked Diubiquitin At Ph 7.5" 72.82 76 98.67 100.00 8.41e-44 PDB 3O65 "Crystal Structure Of A Josephin-Ubiquitin Complex: Evolutionary Restraints On Ataxin-3 Deubiquitinating Activity" 72.82 76 98.67 100.00 8.51e-44 PDB 3OFI "Crystal Structure Of Human Insulin-Degrading Enzyme In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3OJ3 "Crystal Structure Of The A20 Znf4 And Ubiquitin Complex" 72.82 79 98.67 100.00 1.11e-43 PDB 3OJ4 "Crystal Structure Of The A20 Znf4, Ubiquitin And Ubch5a Complex" 72.82 79 98.67 100.00 1.11e-43 PDB 3ONS "Crystal Structure Of Human Ubiquitin In A New Crystal Form" 69.90 72 98.61 100.00 1.32e-41 PDB 3PHD "Crystal Structure Of Human Hdac6 In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3PHW "Otu Domain Of Crimean Congo Hemorrhagic Fever Virus In Complex With Ubiquitin" 72.82 75 98.67 100.00 8.28e-44 PDB 3PRM "Structural Analysis Of A Viral Otu Domain Protease From The Crimean- Congo Hemorrhagic Fever Virus In Complex With Human Ubiqui" 72.82 75 98.67 100.00 8.28e-44 PDB 3PRP "Structural Analysis Of A Viral Otu Domain Protease From The Crimean- Congo Hemorrhagic Fever Virus In Complex With Human Ubiqui" 72.82 75 98.67 100.00 8.28e-44 PDB 3PT2 "Structure Of A Viral Otu Domain Protease Bound To Ubiquitin" 72.82 75 98.67 100.00 8.28e-44 PDB 3PTF "X-Ray Structure Of The Non-Covalent Complex Between Ubch5a And Ubiquitin" 72.82 79 98.67 100.00 1.11e-43 PDB 3Q3F "Engineering Domain-Swapped Binding Interfaces By Mutually Exclusive Folding: Insertion Of Ubiquitin Into Position 103 Of Barnas" 71.84 189 98.65 100.00 5.88e-42 PDB 3RUL "New Strategy To Analyze Structures Of Glycopeptide-Target Complexes" 72.82 79 98.67 100.00 8.75e-44 PDB 3TBL "Structure Of Mono-ubiquitinated Pcna: Implications For Dna Polymerase Switching And Okazaki Fragment Maturation" 72.82 76 98.67 100.00 8.41e-44 PDB 3TMP "The Catalytic Domain Of Human Deubiquitinase Duba In Complex With Ubiquitin Aldehyde" 72.82 76 98.67 100.00 8.51e-44 PDB 3U30 "Crystal Structure Of A Linear-Specific Ubiquitin Fab Bound To Linear Ubiquitin" 75.73 172 97.44 98.72 3.73e-44 PDB 3UGB "Ubch5c~ubiquitin Conjugate" 72.82 76 98.67 100.00 8.41e-44 PDB 3VDZ "Tailoring Encodable Lanthanide-Binding Tags As Mri Contrast Agents: Xq-Dse3-Ubiquitin At 2.4 Angstroms" 73.79 111 97.37 100.00 7.07e-44 PDB 3VFK "The Structure Of Monodechloro-teicoplanin In Complex With Its Ligand, Using Ubiquitin As A Ligand Carrier" 72.82 79 98.67 100.00 8.75e-44 PDB 3VHT "Crystal Structure Of Gfp-Wrnip1 Ubz Domain Fusion Protein In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3VUW "Crystal Structure Of A20 Zf7 In Complex With Linear Ubiquitin, Form I" 72.82 76 98.67 100.00 8.41e-44 PDB 3VUX "Crystal Structure Of A20 Zf7 In Complex With Linear Ubiquitin, Form Ii" 72.82 76 98.67 100.00 8.41e-44 PDB 3VUY "Crystal Structure Of A20 Zf7 In Complex With Linear Tetraubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 3WWQ "Crystal Structure Of Faap20 Ubz Domain In Complex With Lys63-linked Diubiquitin" 72.82 77 98.67 100.00 1.01e-43 PDB 3WXE "Crystal Structure Of Cyld Usp Domain (c596s) In Complex With Met1- Linked Diubiquitin" 72.82 148 97.33 98.67 3.30e-42 PDB 3WXF "Crystal Structure Of Cyld Usp Domain (c596s E674q) In Complex With Met1-linked Diubiquitin" 72.82 148 97.33 98.67 3.30e-42 PDB 3WXG "Crystal Structure Of Cyld Usp Domain (c596a) In Complex With Lys63- Linked Diubiquitin" 69.90 72 98.61 100.00 1.32e-41 PDB 3ZLZ "Lys6-linked Tri-ubiquitin" 72.82 76 97.33 100.00 3.07e-43 PDB 3ZNH "Crimean Congo Hemorrhagic Fever Virus Otu Domain In Complex With Ubiquitin-propargyl." 72.82 76 98.67 100.00 8.51e-44 PDB 3ZNI "Structure Of Phosphotyr363-cbl-b - Ubch5b-ub - Zap-70 Peptide Complex" 74.76 81 98.70 100.00 3.01e-45 PDB 3ZNZ "Crystal Structure Of Otulin Otu Domain (c129a) In Complex With Met1-di Ubiquitin" 72.82 152 98.67 100.00 8.78e-43 PDB 4AP4 "Rnf4 - Ubch5a - Ubiquitin Heterotrimeric Complex" 72.82 80 98.67 100.00 8.43e-44 PDB 4AUQ "Structure Of Birc7-Ubch5b-Ub Complex." 74.76 81 98.70 100.00 3.01e-45 PDB 4BBN "Nedd4 Hect-ub:ub Complex" 72.82 76 98.67 100.00 6.70e-44 PDB 4BOS "Structure Of Otud2 Otu Domain In Complex With Ubiquitin K11- Linked Peptide" 72.82 76 98.67 100.00 8.41e-44 PDB 4BOZ "Structure Of Otud2 Otu Domain In Complex With K11-linked Di Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4BVU "Structure Of Shigella Effector Ospg In Complex With Host Ubch5c-ubiquitin Conjugate" 72.82 76 98.67 100.00 8.41e-44 PDB 4CXC "Regulation Of The Mammalian Elongation Cycle By 40s Subunit Rolling: A Eukaryotic-specific Ribosome Rearrangement" 74.76 156 97.40 98.70 2.14e-43 PDB 4CXD "Regulation Of The Mammalian Elongation Cycle By 40s Subunit Rolling: A Eukaryotic-specific Ribosome Rearrangement" 72.82 128 98.67 100.00 9.67e-44 PDB 4D5L "Cryo-em Structures Of Ribosomal 80s Complexes With Termination Factors And Cricket Paralysis Virus Ires Reveal The Ires In The " 74.76 156 97.40 98.70 2.14e-43 PDB 4D61 "Cryo-em Structures Of Ribosomal 80s Complexes With Termination Factors And Cricket Paralysis Virus Ires Reveal The Ires In The " 74.76 156 97.40 98.70 2.14e-43 PDB 4DDG "Crystal Structure Of Human Otub1UBCH5B~UBUB" 72.82 76 98.67 100.00 8.41e-44 PDB 4DDI "Crystal Structure Of Human Otub1UBCH5B~UBUB" 72.82 76 98.67 100.00 8.41e-44 PDB 4DHJ "The Structure Of A Ceotub1 Ubiquitin Aldehyde Ubc13~ub Complex" 72.82 76 98.67 100.00 6.70e-44 PDB 4DHZ "The Structure Of HCEOTUB1-Ubiquitin Aldehyde-Ubc13~ub" 72.82 76 98.67 100.00 6.70e-44 PDB 4FJV "Crystal Structure Of Human Otubain2 And Ubiquitin Complex" 72.82 86 98.67 100.00 1.93e-43 PDB 4HXD "Diversity Of Ubiquitin And Isg15 Specificity Amongst Nairoviruses Viral Ovarian Tumor Domain Proteases" 72.82 75 98.67 100.00 8.28e-44 PDB 4I6N "Crystal Structure Of Trichinella Spiralis Uch37 Catalytic Domain Bound To Ubiquitin Vinyl Methyl Ester" 71.84 75 98.65 100.00 9.44e-43 PDB 4IG7 "Crystal Structure Of Trichinella Spiralis Uch37 Bound To Ubiquitin Vinyl Methyl Ester" 72.82 75 98.67 100.00 8.28e-44 PDB 4IUM "Equine Arteritis Virus Papain-like Protease 2 (plp2) Covalently Bound To Ubiquitin" 72.82 76 98.67 100.00 8.51e-44 PDB 4JIO "Bro1 V Domain And Ubiquitin" 72.82 76 97.33 98.67 5.64e-43 PDB 4JQW "Crystal Structure Of A Complex Of Nod1 Card And Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4K1R "Crystal Structure Of Schizosaccharomyces Pombe Sst2 Catalytic Domain And Ubiquitin" 76.70 81 97.47 98.73 8.08e-46 PDB 4K7S "Crystal Structure Of Zn2-hub (human Ubiquitin) Adduct From A Solution 35 Mm Zinc Acetate/1.3 Mm Hub" 72.82 76 98.67 100.00 8.41e-44 PDB 4K7U "Crystal Structure Of Zn2.3-hub (human Ubiquitin) Adduct From A Solution 70 Mm Zinc Acetate/1.3 Mm Hub" 72.82 76 98.67 100.00 8.41e-44 PDB 4K7W "Crystal Structure Of Zn3-hub(human Ubiquitin) Adduct From A Solution 100 Mm Zinc Acetate/1.3 Mm Hub" 72.82 76 98.67 100.00 8.41e-44 PDB 4KSK "Gumby/fam105b In Complex With Ubiquitin" 72.82 80 98.67 100.00 8.43e-44 PDB 4KSL "Gumby/fam105b In Complex With Linear Di-ubiquitin" 72.82 156 98.67 100.00 1.02e-42 PDB 4KZX "Rabbit 40s Ribosomal Subunit In Complex With Eif1." 74.76 156 97.40 98.70 2.14e-43 PDB 4KZY "Rabbit 40s Ribosomal Subunit In Complex With Eif1 And Eif1a." 74.76 156 97.40 98.70 2.14e-43 PDB 4KZZ "Rabbit 40s Ribosomal Subunit In Complex With Mrna, Initiator Trna And Eif1a" 74.76 156 97.40 98.70 2.14e-43 PDB 4LCD "Structure Of An Rsp5xubxsna3 Complex: Mechanism Of Ubiquitin Ligation And Lysine Prioritization By A Hect E3" 71.84 83 98.65 100.00 5.16e-43 PDB 4LDT "The Structure Of H/ceotub1-ubiquitin Aldehyde-ubch5b~ub" 72.82 76 98.67 100.00 8.41e-44 PDB 4LJO "Structure Of An Active Ligase (hoip)/ubiquitin Transfer Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 4LJP "Structure Of An Active Ligase (hoip-h889a)/ubiquitin Transfer Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 4M0W "Crystal Structure Of Sars-cov Papain-like Protease C112s Mutant In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4MDK "Cdc34-ubiquitin-cc0651 Complex" 72.82 80 98.67 100.00 8.43e-44 PDB 4MM3 "Crystal Structure Of Sars-cov Papain-like Protease Plpro In Complex With Ubiquitin Aldehyde" 72.82 76 98.67 100.00 8.51e-44 PDB 4MSM "Crystal Structure Of Schizosaccharomyces Pombe Amsh-like Protease Sst2 E286a Mutant Bound To Ubiquitin" 76.70 81 97.47 98.73 8.08e-46 PDB 4MSQ "Crystal Structure Of Schizosaccharomyces Pombe Amsh-like Protease Sst2 Catalytic Domain Bound To Ubiquitin" 76.70 81 97.47 98.73 8.08e-46 PDB 4NQK "Structure Of An Ubiquitin Complex" 72.82 79 98.67 100.00 1.93e-43 PDB 4NQL "The Crystal Structure Of The Dub Domain Of Amsh Orthologue, Sst2 From S. Pombe, In Complex With Lysine 63-linked Diubiquitin" 72.82 77 98.67 100.00 1.01e-43 PDB 4P4H "Caught-in-action Signaling Complex Of Rig-i 2card Domain And Mavs Card Domain" 72.82 79 98.67 100.00 1.93e-43 PDB 4PIG "Crystal Structure Of The Ubiquitin K11s Mutant" 72.82 76 97.33 98.67 4.69e-43 PDB 4PIH "X-ray Crystal Structure Of The K33s Mutant Of Ubiquitin" 72.82 76 97.33 98.67 4.69e-43 PDB 4PQT "Insights Into The Mechanism Of Deubiquitination By Jamm Deubiquitinases From Co-crystal Structures Of Enzyme With Substrate And" 76.70 81 97.47 98.73 8.08e-46 PDB 4R62 "Structure Of Rad6~ub" 72.82 78 98.67 100.00 1.07e-43 PDB 4RF0 "Crystal Structure Of The Middle-east Respiratory Syndrome Coronavirus Papain-like Protease In Complex With Ubiquitin (space Gro" 72.82 75 98.67 100.00 8.28e-44 PDB 4RF1 "Crystal Structure Of The Middle-east Respiratory Syndrome Coronavirus Papain-like Protease In Complex With Ubiquitin (space Gro" 72.82 75 98.67 100.00 8.28e-44 PDB 4S1Z "Crystal Structure Of Trabid Nzf1 In Complex With K29 Linked Di- Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4S22 "Crystal Structure Of K29 Linked Di-ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4UEL "Uch-l5 In Complex With Ubiquitin-propargyl Bound To The Rpn13 Deubad Domain" 72.82 76 98.67 100.00 8.51e-44 PDB 4UF6 "Uch-l5 In Complex With Ubiquitin-propargyl Bound To An Activating Fragment Of Ino80g" 72.82 76 98.67 100.00 8.51e-44 PDB 4UN2 "Crystal Structure Of The Uba Domain Of Dsk2 In Complex With Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4UPX "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Pre-like State" 72.82 128 98.67 100.00 9.67e-44 PDB 4UQ1 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Post-like State" 72.82 128 98.67 100.00 9.67e-44 PDB 4UQ4 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Post-like State" 74.76 156 97.40 98.70 2.14e-43 PDB 4UQ5 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Pre-like State" 74.76 156 97.40 98.70 2.14e-43 PDB 4V3K "Rnf38-ubch5b-ub Complex" 74.76 81 98.70 100.00 3.01e-45 PDB 4V3L "Rnf38-ub-ubch5b-ub Complex" 74.76 81 98.70 100.00 3.01e-45 PDB 4W20 "Structure Of The Mammalian 60s Ribosomal Subunit (this Entry Contains The Large Ribosomal Proteins)" 72.82 128 98.67 100.00 9.67e-44 PDB 4W22 "Structure Of The 80s Mammalian Ribosome Bound To Eef2 (this Entry Contains The Large Ribosomal Subunit Proteins)" 72.82 128 98.67 100.00 9.67e-44 PDB 4W23 "Structure Of The 80s Mammalian Ribosome Bound To Eef2 (this Entry Contains The Small Ribosomal Subunit)" 74.76 156 97.40 98.70 2.14e-43 PDB 4W25 "Structure Of The Idle Mammalian Ribosome-sec61 Complex (this Entry Contains The Large Ribosomal Subunit Proteins)" 72.82 128 98.67 100.00 9.67e-44 PDB 4W27 "Structure Of The Translating Mammalian Ribosome-sec61 Complex (this Entry Contains The Large Ribosomal Subunit Proteins)" 72.82 128 98.67 100.00 9.67e-44 PDB 4W28 "Structure Of The Translating Mammalian Ribosome-sec61 Complex (this Entry Contains The Small Ribosomal Subunit)" 74.76 156 97.40 98.70 2.14e-43 PDB 4WHV Rnf8/ubc13c87k~ub 72.82 83 98.67 100.00 2.93e-43 PDB 4WLR "Crystal Structure Of Much37-hrpn13 Ctd-hub Complex" 72.82 76 98.67 100.00 8.41e-44 PDB 4WUR "The Crystal Structure Of The Mers-cov Papain-like Protease (c111s) With Human Ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4WZP "Ser65 Phosphorylated Ubiquitin, Major Conformation" 72.82 76 97.33 98.67 6.35e-43 PDB 4XKL "Crystal Structure Of Ndp52 Zf2 In Complex With Mono-ubiquitin" 74.76 80 98.70 100.00 5.05e-45 PDB 4XOF "Observing The Overall Rocking Motion Of A Protein In A Crystal - Orthorhombic Ubiquitin Crystals Without Zinc." 72.82 76 98.67 100.00 8.41e-44 PDB 4XOK "Observing The Overall Rocking Motion Of A Protein In A Crystal." 72.82 76 98.67 100.00 8.41e-44 PDB 4XOL "Observing The Overall Rocking Motion Of A Protein In A Crystal - Cubic Ubiquitin Crystals." 72.82 76 98.67 100.00 8.41e-44 PDB 4XYZ "Crystal Structure Of K33 Linked Di-ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4Y1H "Crystal Structure Of K33 Linked Tri-ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4Z9S "Non-covalent Assembly Of Monoubiquitin That Mimics K11 Poly-ubiquitin" 72.82 76 98.67 100.00 8.41e-44 PDB 4ZFR "Catalytic Domain Of Sst2 F403a Mutant Bound To Ubiquitin" 76.70 81 97.47 98.73 8.08e-46 PDB 4ZFT "Catalytic Domain Of Sst2 F403w Mutant Bound To Ubiquitin" 76.70 81 97.47 98.73 8.08e-46 PDB 5A5B "Structure Of The 26s Proteasome-ubp6 Complex" 72.82 76 98.67 100.00 8.51e-44 PDB 5AF4 "Structure Of Lys33-linked Diub" 72.82 76 97.33 100.00 3.07e-43 PDB 5AF5 "Structure Of Lys33-linked Triub S.g. P 212121" 70.87 73 97.26 100.00 8.96e-42 PDB 5AF6 "Structure Of Lys33-linked Diub Bound To Trabid Nzf1" 72.82 76 97.33 100.00 3.07e-43 PDB 5AIT "A Complex Of Of Rnf4-ring Domain, Ubev2, Ubc13-ub (isopeptide Crosslink)" 72.82 76 98.67 100.00 8.41e-44 PDB 5AIU "A Complex Of Rnf4-ring Domain, Ubc13-ub (isopeptide Crosslink)" 72.82 76 98.67 100.00 8.41e-44 PDB 5CAW "Structure Of Pediculus Humanus Parkin Bound To Phospho-ubiquitin" 72.82 76 97.33 98.67 5.28e-43 DBJ BAA03983 "polyubiquitin [Rattus norvegicus]" 72.82 305 98.67 100.00 4.97e-41 DBJ BAA09860 "polyubiquitin [Homo sapiens]" 72.82 611 98.67 100.00 1.49e-39 DBJ BAA11842 "ubiquitin [Cavia porcellus]" 72.82 311 98.67 100.00 5.61e-41 DBJ BAA11843 "ubiquitin extention protein [Cavia porcellus]" 74.76 156 97.40 98.70 2.14e-43 DBJ BAA23486 "polyubiquitin [Homo sapiens]" 72.82 609 98.67 100.00 1.71e-39 EMBL CAA28495 "ubiquitin [Homo sapiens]" 72.82 229 98.67 100.00 7.27e-42 EMBL CAA30815 "unnamed protein product [Cricetulus sp.]" 71.84 223 97.30 98.65 1.90e-40 EMBL CAA35999 "ubiquitin [Mus musculus]" 72.82 305 98.67 100.00 4.97e-41 EMBL CAA37227 "unnamed protein product [Drosophila melanogaster]" 72.82 128 98.67 100.00 9.57e-44 EMBL CAA37599 "unnamed protein product [Manduca sexta]" 74.76 155 97.40 98.70 2.08e-43 GB AAA28154 "polyubiquitin [Caenorhabditis elegans]" 72.82 838 97.33 98.67 3.59e-38 GB AAA28997 "ubiquitin [Drosophila melanogaster]" 72.82 231 98.67 100.00 7.33e-42 GB AAA28998 "ubiquitin-hybrid protein precursor [Drosophila melanogaster]" 74.76 156 97.40 98.70 3.06e-43 GB AAA28999 "ubiquitin, partial [Drosophila melanogaster]" 72.82 76 98.67 100.00 8.41e-44 GB AAA29000 "ubiquitin, partial [Drosophila melanogaster]" 72.82 76 97.33 98.67 5.52e-43 PIR I50437 "polyubiquitin 4 - chicken [Gallus gallus]" 72.82 305 98.67 100.00 4.97e-41 PIR I51568 "polyubiquitin - African clawed frog (fragment)" 75.73 167 97.44 98.72 3.41e-44 PIR I65237 "ubiquitin / ribosomal protein L40, cytosolic [validated] - rat" 72.82 128 98.67 100.00 9.67e-44 PIR S13928 "ubiquitin precursor - chicken [Gallus gallus]" 72.82 229 98.67 100.00 6.96e-42 PIR S21083 "polyubiquitin 5 - Chinese hamster" 72.82 381 98.67 100.00 2.25e-40 PRF 0412265A ubiquitin 72.82 75 97.33 98.67 2.89e-43 PRF 1212243A "ubiquitin S1" 72.82 76 98.67 100.00 8.41e-44 PRF 1212243B "ubiquitin S5" 67.96 77 97.14 98.57 2.40e-39 PRF 1212243C "ubiquitin S3" 72.82 76 98.67 100.00 8.41e-44 PRF 1212243D "ubiquitin S2" 67.96 77 97.14 98.57 3.05e-39 REF NP_001005123 "ubiquitin-60S ribosomal protein L40 [Xenopus (Silurana) tropicalis]" 72.82 128 98.67 100.00 9.67e-44 REF NP_001006688 "ubiquitin C [Xenopus (Silurana) tropicalis]" 72.82 609 98.67 100.00 1.73e-39 REF NP_001009117 "polyubiquitin-B [Pan troglodytes]" 72.82 229 98.67 100.00 7.27e-42 REF NP_001009202 "polyubiquitin-B [Ovis aries]" 72.82 305 97.33 100.00 9.21e-41 REF NP_001009286 "ubiquitin-60S ribosomal protein L40 [Ovis aries]" 72.82 128 98.67 100.00 9.67e-44 SP P0C273 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 72.82 128 98.67 100.00 9.67e-44 SP P0C275 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 72.82 128 98.67 100.00 9.67e-44 SP P0C276 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 72.82 128 98.67 100.00 9.67e-44 SP P0CG47 "RecName: Full=Polyubiquitin-B; Contains: RecName: Full=Ubiquitin; Flags: Precursor" 72.82 229 98.67 100.00 7.27e-42 SP P0CG48 "RecName: Full=Polyubiquitin-C; Contains: RecName: Full=Ubiquitin; Flags: Precursor" 72.82 685 98.67 100.00 2.80e-39 TPE CEL68433 "TPA: ubiquitin / ribosomal protein CEP52 fusion protein, putative [Neospora caninum Liverpool]" 72.82 129 97.33 100.00 3.86e-43 TPE CEL70397 "TPA: Ubiquitin, related [Neospora caninum Liverpool]" 72.82 535 97.33 100.00 3.89e-39 TPE CEL75964 "TPA: ubiquitin / ribosomal protein CEP52 fusion protein, putative [Toxoplasma gondii VEG]" 72.82 129 97.33 100.00 3.86e-43 TPE CEL78064 "TPA: polyubiquitin, putative [Toxoplasma gondii VEG]" 72.82 307 97.33 100.00 1.84e-40 TPG DAA18802 "TPA: polyubiquitin [Bos taurus]" 72.82 305 98.67 100.00 5.03e-41 TPG DAA20663 "TPA: ubiquitin C [Bos taurus]" 72.82 314 97.33 98.67 2.56e-40 TPG DAA20672 "TPA: ubiquitin B-like [Bos taurus]" 72.82 77 97.33 98.67 7.12e-43 TPG DAA24675 "TPA: 40S ribosomal protein S27a [Bos taurus]" 74.76 156 97.40 98.70 2.14e-43 TPG DAA28295 "TPA: ubiquitin and ribosomal protein L40 [Bos taurus]" 72.82 128 98.67 100.00 9.67e-44 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $UBB Human 9606 Eukaryota Metazoa Homo sapiens TA0895 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $UBB 'recombinant technology' . ESCHERICHIA COLI BL21(DE3) PLASMID PET stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $UBB 1 mM '[U-98% 13C; U-98% 15N]' stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert P.' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 50 . mM pH 7.0 . 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 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCACB' '3D HNCA' '3D HBHA(CO)NH' '3D HCCH-TOCSY' '3D 1H-13C NOESY' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name UBB _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 GLY HA2 H 3.920 0.020 2 2 1 1 GLY HA3 H 3.920 0.020 2 3 1 1 GLY CA C 45.200 0.200 1 4 2 2 SER H H 8.160 0.020 1 5 2 2 SER HA H 4.370 0.020 1 6 2 2 SER HB2 H 3.760 0.020 2 7 2 2 SER HB3 H 3.762 0.020 2 8 2 2 SER HG H 5.044 0.020 1 9 2 2 SER CA C 58.300 0.200 1 10 2 2 SER CB C 63.900 0.200 1 11 2 2 SER N N 115.600 0.200 1 12 3 3 LEU H H 8.250 0.020 1 13 3 3 LEU HA H 4.280 0.020 1 14 3 3 LEU HB2 H 3.760 0.020 2 15 3 3 LEU HB3 H 1.500 0.020 2 16 3 3 LEU HG H 1.500 0.020 1 17 3 3 LEU CA C 55.200 0.200 1 18 3 3 LEU CB C 42.100 0.200 1 19 3 3 LEU N N 124.100 0.200 1 20 4 4 VAL H H 7.950 0.020 1 21 4 4 VAL HA H 4.680 0.020 1 22 4 4 VAL HB H 1.920 0.020 1 23 4 4 VAL HG2 H 1.500 0.020 2 24 4 4 VAL CA C 59.800 0.200 1 25 4 4 VAL CB C 32.500 0.200 1 26 4 4 VAL N N 122.600 0.200 1 27 5 5 PRO CA C 63.100 0.200 1 28 5 5 PRO CB C 32.000 0.200 1 29 5 5 PRO CG C 32.050 0.200 1 30 6 6 ARG H H 8.360 0.020 1 31 6 6 ARG HA H 4.250 0.020 1 32 6 6 ARG HB2 H 1.760 0.020 2 33 6 6 ARG HB3 H 1.650 0.020 2 34 6 6 ARG CA C 56.000 0.200 1 35 6 6 ARG CB C 30.900 0.200 1 36 6 6 ARG N N 121.800 0.200 1 37 7 7 GLY H H 8.460 0.020 1 38 7 7 GLY HA2 H 3.940 0.020 2 39 7 7 GLY HA3 H 3.760 0.020 2 40 7 7 GLY CA C 45.000 0.200 1 41 7 7 GLY N N 110.700 0.200 1 42 8 8 SER H H 7.990 0.020 1 43 8 8 SER HA H 4.450 0.020 1 44 8 8 SER HB2 H 3.745 0.020 2 45 8 8 SER HB3 H 3.745 0.020 2 46 8 8 SER CA C 58.900 0.200 1 47 8 8 SER CB C 64.200 0.200 1 48 8 8 SER N N 115.500 0.200 1 49 9 9 MET H H 9.040 0.020 1 50 9 9 MET HA H 4.610 0.020 1 51 9 9 MET HB2 H 1.840 0.020 2 52 9 9 MET HB3 H 1.979 0.020 2 53 9 9 MET HE H 1.850 0.020 . 54 9 9 MET HG2 H 2.263 0.020 2 55 9 9 MET HG3 H 2.238 0.020 2 56 9 9 MET CA C 54.400 0.200 1 57 9 9 MET CB C 35.400 0.200 1 58 9 9 MET CE C 27.010 0.200 1 59 9 9 MET CG C 31.631 0.200 1 60 9 9 MET N N 120.500 0.200 1 61 10 10 GLN H H 8.270 0.020 1 62 10 10 GLN HA H 5.270 0.020 1 63 10 10 GLN HB2 H 1.840 0.020 2 64 10 10 GLN HB3 H 2.113 0.020 2 65 10 10 GLN HG2 H 1.715 0.020 2 66 10 10 GLN HG3 H 1.512 0.020 2 67 10 10 GLN CA C 54.200 0.200 1 68 10 10 GLN CB C 30.500 0.200 1 69 10 10 GLN CG C 34.363 0.200 1 70 10 10 GLN N N 121.000 0.200 1 71 11 11 ILE H H 8.270 0.020 1 72 11 11 ILE HA H 4.100 0.020 1 73 11 11 ILE HB H 1.720 0.020 1 74 11 11 ILE HD1 H 4.104 0.020 1 75 11 11 ILE HG12 H 1.669 0.020 2 76 11 11 ILE HG13 H 0.535 0.020 2 77 11 11 ILE HG2 H 0.504 0.020 1 78 11 11 ILE CA C 59.400 0.200 1 79 11 11 ILE CB C 41.800 0.200 1 80 11 11 ILE CD1 C 14.132 0.200 1 81 11 11 ILE CG1 C 17.817 0.200 1 82 11 11 ILE CG2 C 17.817 0.200 1 83 11 11 ILE N N 114.600 0.200 1 84 12 12 PHE H H 8.520 0.020 1 85 12 12 PHE HA H 5.540 0.020 1 86 12 12 PHE HB2 H 2.950 0.020 2 87 12 12 PHE HB3 H 2.789 0.020 2 88 12 12 PHE CA C 55.000 0.200 1 89 12 12 PHE CB C 41.200 0.200 1 90 12 12 PHE N N 118.600 0.200 1 91 13 13 VAL H H 9.230 0.020 1 92 13 13 VAL HA H 4.740 0.020 1 93 13 13 VAL HB H 1.810 0.020 1 94 13 13 VAL HG1 H 0.639 0.020 2 95 13 13 VAL HG2 H 0.595 0.020 2 96 13 13 VAL CA C 60.300 0.200 1 97 13 13 VAL CB C 34.100 0.200 1 98 13 13 VAL CG1 C 22.416 0.200 2 99 13 13 VAL CG2 C 20.773 0.200 2 100 13 13 VAL N N 121.400 0.200 1 101 14 14 LYS H H 8.910 0.020 1 102 14 14 LYS HA H 5.190 0.020 1 103 14 14 LYS HB2 H 1.810 0.020 2 104 14 14 LYS HD2 H 1.609 0.020 2 105 14 14 LYS HD3 H 1.377 0.020 2 106 14 14 LYS HE2 H 2.798 0.020 2 107 14 14 LYS HE3 H 2.798 0.020 2 108 14 14 LYS HG2 H 1.322 0.020 2 109 14 14 LYS HG3 H 1.182 0.020 2 110 14 14 LYS CA C 54.600 0.200 1 111 14 14 LYS CB C 34.300 0.200 1 112 14 14 LYS CD C 29.123 0.200 1 113 14 14 LYS CG C 24.949 0.200 1 114 14 14 LYS N N 128.000 0.200 1 115 15 15 THR H H 8.650 0.020 1 116 15 15 THR HA H 4.870 0.020 1 117 15 15 THR HB H 4.700 0.020 1 118 15 15 THR HG2 H 1.086 0.020 . 119 15 15 THR CA C 60.300 0.200 1 120 15 15 THR CB C 70.600 0.200 1 121 15 15 THR CG2 C 21.486 0.200 1 122 15 15 THR N N 115.300 0.200 1 123 16 16 LEU H H 9.070 0.020 1 124 16 16 LEU HA H 4.210 0.020 1 125 16 16 LEU HB2 H 1.843 0.020 2 126 16 16 LEU HB3 H 1.789 0.020 2 127 16 16 LEU HD1 H 0.875 0.020 2 128 16 16 LEU HD2 H 0.945 0.020 2 129 16 16 LEU HG H 1.665 0.020 1 130 16 16 LEU CA C 57.400 0.200 1 131 16 16 LEU CB C 41.800 0.200 1 132 16 16 LEU CD1 C 25.241 0.200 2 133 16 16 LEU CD2 C 23.640 0.200 2 134 16 16 LEU CG C 27.315 0.200 1 135 16 16 LEU N N 121.400 0.200 1 136 17 17 THR H H 7.560 0.020 1 137 17 17 THR HA H 4.330 0.020 1 138 17 17 THR HB H 4.480 0.020 1 139 17 17 THR HG2 H 1.159 0.020 . 140 17 17 THR CA C 61.400 0.200 1 141 17 17 THR CB C 68.900 0.200 1 142 17 17 THR CG2 C 21.750 0.200 1 143 17 17 THR N N 105.900 0.200 1 144 18 18 GLY H H 7.750 0.020 1 145 18 18 GLY HA2 H 4.250 0.020 2 146 18 18 GLY HA3 H 3.520 0.020 2 147 18 18 GLY CA C 45.300 0.200 1 148 18 18 GLY N N 109.300 0.200 1 149 19 19 LYS H H 7.210 0.020 1 150 19 19 LYS HA H 4.260 0.020 1 151 19 19 LYS HB2 H 1.710 0.020 2 152 19 19 LYS HB3 H 1.600 0.020 2 153 19 19 LYS HG2 H 1.319 0.020 2 154 19 19 LYS HG3 H 1.152 0.020 2 155 19 19 LYS CA C 56.300 0.200 1 156 19 19 LYS CB C 33.200 0.200 1 157 19 19 LYS CD C 29.320 0.200 1 158 19 19 LYS CG C 24.998 0.200 1 159 19 19 LYS N N 122.000 0.200 1 160 20 20 THR H H 8.570 0.020 1 161 20 20 THR HA H 4.950 0.020 1 162 20 20 THR HB H 3.830 0.020 1 163 20 20 THR HG2 H 0.968 0.020 . 164 20 20 THR CA C 62.200 0.200 1 165 20 20 THR CB C 69.700 0.200 1 166 20 20 THR CG2 C 21.839 0.200 1 167 20 20 THR N N 120.700 0.200 1 168 21 21 ILE H H 9.510 0.020 1 169 21 21 ILE HA H 4.390 0.020 1 170 21 21 ILE HB H 1.770 0.020 1 171 21 21 ILE HD1 H 0.628 0.020 1 172 21 21 ILE HG12 H 1.361 0.020 2 173 21 21 ILE HG13 H 0.991 0.020 2 174 21 21 ILE HG2 H 0.781 0.020 1 175 21 21 ILE CA C 60.000 0.200 1 176 21 21 ILE CB C 40.700 0.200 1 177 21 21 ILE CD1 C 14.385 0.200 1 178 21 21 ILE CG1 C 26.996 0.200 1 179 21 21 ILE CG2 C 17.666 0.200 1 180 21 21 ILE N N 128.200 0.200 1 181 22 22 THR H H 8.700 0.020 1 182 22 22 THR HA H 4.860 0.020 1 183 22 22 THR HB H 3.930 0.020 1 184 22 22 THR HG2 H 1.017 0.020 . 185 22 22 THR CA C 62.100 0.200 1 186 22 22 THR CB C 69.500 0.200 1 187 22 22 THR CG2 C 21.660 0.200 1 188 22 22 THR N N 122.300 0.200 1 189 23 23 LEU H H 8.720 0.020 1 190 23 23 LEU HA H 4.690 0.020 1 191 23 23 LEU HB2 H 1.290 0.020 2 192 23 23 LEU HB3 H 1.332 0.020 2 193 23 23 LEU HD1 H 0.678 0.020 2 194 23 23 LEU HD2 H 0.623 0.020 2 195 23 23 LEU HG H 1.119 0.020 1 196 23 23 LEU CA C 52.700 0.200 1 197 23 23 LEU CB C 46.600 0.200 1 198 23 23 LEU CD1 C 24.065 0.200 2 199 23 23 LEU CD2 C 24.065 0.200 2 200 23 23 LEU CG C 26.970 0.200 1 201 23 23 LEU N N 125.400 0.200 1 202 24 24 GLU H H 8.080 0.020 1 203 24 24 GLU HA H 4.800 0.020 1 204 24 24 GLU HB2 H 1.800 0.020 2 205 24 24 GLU HB3 H 2.057 0.020 2 206 24 24 GLU CA C 55.400 0.200 1 207 24 24 GLU CB C 30.100 0.200 1 208 24 24 GLU CG C 36.477 0.200 1 209 24 24 GLU N N 121.800 0.200 1 210 25 25 VAL H H 8.800 0.020 1 211 25 25 VAL HA H 4.640 0.020 1 212 25 25 VAL HB H 2.290 0.020 1 213 25 25 VAL HG1 H 0.599 0.020 2 214 25 25 VAL HG2 H 0.359 0.020 2 215 25 25 VAL CA C 58.600 0.200 1 216 25 25 VAL CB C 36.300 0.200 1 217 25 25 VAL CG1 C 22.075 0.200 2 218 25 25 VAL CG2 C 19.315 0.200 2 219 25 25 VAL N N 116.700 0.200 1 220 26 26 GLU H H 8.500 0.020 1 221 26 26 GLU HA H 4.900 0.020 1 222 26 26 GLU HB2 H 2.290 0.020 2 223 26 26 GLU HB3 H 2.020 0.020 2 224 26 26 GLU CA C 53.000 0.200 1 225 26 26 GLU CB C 31.200 0.200 1 226 26 26 GLU N N 117.900 0.200 1 227 27 27 PRO HA H 4.040 0.020 1 228 27 27 PRO HB2 H 2.331 0.020 2 229 27 27 PRO HB3 H 2.065 0.020 2 230 27 27 PRO HD2 H 4.041 0.020 2 231 27 27 PRO HD3 H 4.041 0.020 2 232 27 27 PRO HG2 H 1.984 0.020 2 233 27 27 PRO HG3 H 1.901 0.020 2 234 27 27 PRO CA C 65.400 0.200 1 235 27 27 PRO CB C 31.700 0.200 1 236 27 27 PRO CD C 58.259 0.200 1 237 27 27 PRO CG C 28.000 0.200 1 238 28 28 SER H H 7.010 0.020 1 239 28 28 SER HA H 4.280 0.020 1 240 28 28 SER HB2 H 3.690 0.020 2 241 28 28 SER HB3 H 4.054 0.020 2 242 28 28 SER CA C 57.400 0.200 1 243 28 28 SER CB C 63.400 0.200 1 244 28 28 SER N N 103.800 0.200 1 245 29 29 ASP H H 7.960 0.020 1 246 29 29 ASP HA H 4.600 0.020 1 247 29 29 ASP HB2 H 2.890 0.020 2 248 29 29 ASP HB3 H 2.420 0.020 2 249 29 29 ASP CA C 55.900 0.200 1 250 29 29 ASP CB C 41.000 0.200 1 251 29 29 ASP N N 123.700 0.200 1 252 30 30 THR H H 7.780 0.020 1 253 30 30 THR HA H 4.850 0.020 1 254 30 30 THR HB H 4.104 0.020 1 255 30 30 THR HG2 H 1.132 0.020 . 256 30 30 THR CA C 59.400 0.200 1 257 30 30 THR CB C 71.100 0.200 1 258 30 30 THR CG2 C 22.087 0.200 1 259 30 30 THR N N 108.800 0.200 1 260 31 31 ILE H H 8.320 0.020 1 261 31 31 ILE HA H 3.580 0.020 1 262 31 31 ILE HB H 2.480 0.020 1 263 31 31 ILE HD1 H 0.481 0.020 1 264 31 31 ILE HG12 H 1.878 0.020 2 265 31 31 ILE HG13 H 1.222 0.020 2 266 31 31 ILE HG2 H 0.700 0.020 1 267 31 31 ILE CA C 62.200 0.200 1 268 31 31 ILE CB C 34.300 0.200 1 269 31 31 ILE CD1 C 9.419 0.200 1 270 31 31 ILE CG1 C 27.578 0.200 1 271 31 31 ILE CG2 C 17.931 0.200 1 272 31 31 ILE N N 121.300 0.200 1 273 32 32 GLU H H 9.850 0.020 1 274 32 32 GLU HA H 3.780 0.020 1 275 32 32 GLU HB2 H 2.480 0.020 2 276 32 32 GLU HB3 H 1.930 0.020 2 277 32 32 GLU HG2 H 2.215 0.020 2 278 32 32 GLU HG3 H 2.215 0.020 2 279 32 32 GLU CA C 60.500 0.200 1 280 32 32 GLU CB C 28.800 0.200 1 281 32 32 GLU CG C 36.050 0.200 1 282 32 32 GLU N N 121.600 0.200 1 283 33 33 ASN H H 7.810 0.020 1 284 33 33 ASN HA H 4.440 0.020 1 285 33 33 ASN HB2 H 2.750 0.020 2 286 33 33 ASN HB3 H 2.639 0.020 2 287 33 33 ASN CA C 55.800 0.200 1 288 33 33 ASN CB C 38.100 0.200 1 289 33 33 ASN N N 121.000 0.200 1 290 34 34 VAL H H 8.000 0.020 1 291 34 34 VAL HA H 3.300 0.020 1 292 34 34 VAL HB H 2.260 0.020 1 293 34 34 VAL HG1 H 0.891 0.020 2 294 34 34 VAL HG2 H 0.612 0.020 2 295 34 34 VAL CA C 67.600 0.200 1 296 34 34 VAL CB C 30.700 0.200 1 297 34 34 VAL CG1 C 21.582 0.200 2 298 34 34 VAL CG2 C 23.690 0.200 2 299 34 34 VAL N N 122.200 0.200 1 300 35 35 LYS H H 8.490 0.020 1 301 35 35 LYS HA H 4.500 0.020 1 302 35 35 LYS HB2 H 1.920 0.020 2 303 35 35 LYS HB3 H 1.920 0.020 2 304 35 35 LYS HG2 H 1.349 0.020 2 305 35 35 LYS HG3 H 1.349 0.020 2 306 35 35 LYS CA C 59.300 0.200 1 307 35 35 LYS CB C 33.500 0.200 1 308 35 35 LYS N N 119.200 0.200 1 309 36 36 ALA H H 7.880 0.020 1 310 36 36 ALA HA H 4.060 0.020 1 311 36 36 ALA HB H 1.350 0.020 1 312 36 36 ALA CA C 55.300 0.200 1 313 36 36 ALA CB C 17.600 0.200 1 314 36 36 ALA N N 123.300 0.200 1 315 37 37 LYS H H 7.790 0.020 1 316 37 37 LYS HA H 4.110 0.020 1 317 37 37 LYS HB2 H 2.054 0.020 2 318 37 37 LYS HB3 H 1.937 0.020 2 319 37 37 LYS HD2 H 1.937 0.020 2 320 37 37 LYS HD3 H 1.937 0.020 2 321 37 37 LYS HE2 H 2.905 0.020 2 322 37 37 LYS HE3 H 2.905 0.020 2 323 37 37 LYS HG2 H 1.839 0.020 2 324 37 37 LYS HG3 H 1.748 0.020 2 325 37 37 LYS CA C 59.700 0.200 1 326 37 37 LYS CB C 33.100 0.200 1 327 37 37 LYS CD C 31.631 0.200 1 328 37 37 LYS CE C 35.447 0.200 1 329 37 37 LYS CG C 30.508 0.200 1 330 37 37 LYS N N 120.400 0.200 1 331 38 38 ILE H H 8.240 0.020 1 332 38 38 ILE HA H 3.410 0.020 1 333 38 38 ILE HB H 1.860 0.020 1 334 38 38 ILE HD1 H 0.605 0.020 1 335 38 38 ILE HG12 H 1.923 0.020 2 336 38 38 ILE HG13 H 0.800 0.020 2 337 38 38 ILE HG2 H 0.800 0.020 1 338 38 38 ILE CA C 66.200 0.200 1 339 38 38 ILE CB C 36.800 0.200 1 340 38 38 ILE CD1 C 15.100 0.200 1 341 38 38 ILE CG1 C 31.118 0.200 1 342 38 38 ILE CG2 C 17.043 0.200 1 343 38 38 ILE N N 121.400 0.200 1 344 39 39 GLN H H 8.460 0.020 1 345 39 39 GLN HA H 3.730 0.020 1 346 39 39 GLN HB2 H 1.860 0.020 2 347 39 39 GLN HB3 H 2.180 0.020 2 348 39 39 GLN HG2 H 2.392 0.020 2 349 39 39 GLN HG3 H 2.392 0.020 2 350 39 39 GLN CA C 60.000 0.200 1 351 39 39 GLN CB C 27.600 0.200 1 352 39 39 GLN CG C 33.777 0.200 1 353 39 39 GLN N N 123.500 0.200 1 354 40 40 ASP H H 7.970 0.020 1 355 40 40 ASP HA H 4.240 0.020 1 356 40 40 ASP HB2 H 2.750 0.020 2 357 40 40 ASP HB3 H 2.657 0.020 2 358 40 40 ASP CA C 57.400 0.200 1 359 40 40 ASP CB C 41.000 0.200 1 360 40 40 ASP N N 119.900 0.200 1 361 41 41 LYS H H 7.420 0.020 1 362 41 41 LYS HA H 4.200 0.020 1 363 41 41 LYS HB2 H 1.750 0.020 2 364 41 41 LYS HB3 H 1.754 0.020 2 365 41 41 LYS HD2 H 1.916 0.020 2 366 41 41 LYS HD3 H 1.916 0.020 2 367 41 41 LYS HE2 H 3.073 0.020 2 368 41 41 LYS HE3 H 3.020 0.020 2 369 41 41 LYS HG2 H 1.511 0.020 2 370 41 41 LYS HG3 H 1.511 0.020 2 371 41 41 LYS CA C 58.200 0.200 1 372 41 41 LYS CB C 33.900 0.200 1 373 41 41 LYS CD C 28.784 0.200 1 374 41 41 LYS CG C 25.231 0.200 1 375 41 41 LYS N N 115.700 0.200 1 376 42 42 GLU H H 8.650 0.020 1 377 42 42 GLU HA H 4.470 0.020 1 378 42 42 GLU HB2 H 1.920 0.020 2 379 42 42 GLU HB3 H 2.059 0.020 2 380 42 42 GLU HG2 H 2.168 0.020 2 381 42 42 GLU HG3 H 2.168 0.020 2 382 42 42 GLU CA C 55.300 0.200 1 383 42 42 GLU CB C 33.200 0.200 1 384 42 42 GLU CG C 36.444 0.200 1 385 42 42 GLU N N 114.200 0.200 1 386 43 43 GLY H H 8.400 0.020 1 387 43 43 GLY HA2 H 4.040 0.020 2 388 43 43 GLY HA3 H 3.820 0.020 2 389 43 43 GLY CA C 45.900 0.200 1 390 43 43 GLY N N 109.000 0.200 1 391 44 44 ILE H H 6.080 0.020 1 392 44 44 ILE HA H 4.290 0.020 1 393 44 44 ILE HB H 1.330 0.020 1 394 44 44 ILE CA C 57.700 0.200 1 395 44 44 ILE CB C 40.400 0.200 1 396 44 44 ILE N N 120.500 0.200 1 397 46 46 PRO HA H 4.030 0.020 1 398 46 46 PRO HB2 H 2.143 0.020 2 399 46 46 PRO HB3 H 2.082 0.020 2 400 46 46 PRO HG2 H 1.944 0.020 2 401 46 46 PRO HG3 H 1.546 0.020 2 402 46 46 PRO CA C 66.100 0.200 1 403 46 46 PRO CB C 32.600 0.200 1 404 46 46 PRO CD C 58.259 0.200 1 405 46 46 PRO CG C 27.546 0.200 1 406 47 47 ASP H H 8.470 0.020 1 407 47 47 ASP HA H 4.310 0.020 1 408 47 47 ASP HB2 H 2.660 0.020 2 409 47 47 ASP HB3 H 2.580 0.020 2 410 47 47 ASP CA C 55.700 0.200 1 411 47 47 ASP CB C 39.700 0.200 1 412 47 47 ASP N N 113.700 0.200 1 413 48 48 GLN H H 7.720 0.020 1 414 48 48 GLN HA H 4.340 0.020 1 415 48 48 GLN HB2 H 2.320 0.020 2 416 48 48 GLN HB3 H 2.292 0.020 2 417 48 48 GLN HG2 H 1.716 0.020 2 418 48 48 GLN HG3 H 1.716 0.020 2 419 48 48 GLN CA C 55.500 0.200 1 420 48 48 GLN CB C 29.900 0.200 1 421 48 48 GLN CG C 34.282 0.200 1 422 48 48 GLN N N 116.900 0.200 1 423 49 49 GLN H H 7.410 0.020 1 424 49 49 GLN HA H 4.110 0.020 1 425 49 49 GLN HB2 H 1.830 0.020 2 426 49 49 GLN HB3 H 1.834 0.020 2 427 49 49 GLN HG2 H 2.217 0.020 2 428 49 49 GLN HG3 H 2.217 0.020 2 429 49 49 GLN CA C 56.600 0.200 1 430 49 49 GLN CB C 31.300 0.200 1 431 49 49 GLN CG C 33.984 0.200 1 432 49 49 GLN N N 118.000 0.200 1 433 50 50 ARG H H 8.400 0.020 1 434 50 50 ARG HA H 4.380 0.020 1 435 50 50 ARG HB2 H 1.830 0.020 2 436 50 50 ARG HB3 H 1.619 0.020 2 437 50 50 ARG HG2 H 1.542 0.020 2 438 50 50 ARG HG3 H 1.400 0.020 2 439 50 50 ARG CA C 55.100 0.200 1 440 50 50 ARG CB C 31.600 0.200 1 441 50 50 ARG CG C 26.960 0.200 1 442 50 50 ARG N N 123.100 0.200 1 443 51 51 LEU H H 8.710 0.020 1 444 51 51 LEU HA H 5.300 0.020 1 445 51 51 LEU HB2 H 1.620 0.020 2 446 51 51 LEU HB3 H 1.458 0.020 2 447 51 51 LEU HD1 H 0.712 0.020 2 448 51 51 LEU HD2 H 0.675 0.020 2 449 51 51 LEU HG H 1.067 0.020 1 450 51 51 LEU CA C 52.900 0.200 1 451 51 51 LEU CB C 45.700 0.200 1 452 51 51 LEU CD1 C 24.226 0.200 2 453 51 51 LEU CD2 C 24.226 0.200 2 454 51 51 LEU CG C 26.591 0.200 1 455 51 51 LEU N N 124.400 0.200 1 456 52 52 ILE H H 9.060 0.020 1 457 52 52 ILE HA H 4.840 0.020 1 458 52 52 ILE HB H 1.650 0.020 1 459 52 52 ILE HD1 H 0.581 0.020 1 460 52 52 ILE HG12 H 1.251 0.020 2 461 52 52 ILE HG13 H 1.251 0.020 2 462 52 52 ILE HG2 H 0.954 0.020 1 463 52 52 ILE CA C 58.900 0.200 1 464 52 52 ILE CB C 41.200 0.200 1 465 52 52 ILE CD1 C 12.752 0.200 1 466 52 52 ILE CG1 C 27.831 0.200 1 467 52 52 ILE CG2 C 17.550 0.200 1 468 52 52 ILE N N 122.500 0.200 1 469 53 53 PHE H H 8.730 0.020 1 470 53 53 PHE HA H 5.100 0.020 1 471 53 53 PHE HB2 H 2.930 0.020 2 472 53 53 PHE HB3 H 2.709 0.020 2 473 53 53 PHE HE1 H 7.408 0.020 3 474 53 53 PHE HE2 H 7.408 0.020 3 475 53 53 PHE CA C 56.300 0.200 1 476 53 53 PHE CB C 43.500 0.200 1 477 53 53 PHE N N 124.800 0.200 1 478 54 54 ALA H H 8.940 0.020 1 479 54 54 ALA HA H 3.610 0.020 1 480 54 54 ALA HB H 0.778 0.020 1 481 54 54 ALA CA C 52.500 0.200 1 482 54 54 ALA CB C 16.300 0.200 1 483 54 54 ALA N N 133.100 0.200 1 484 55 55 GLY H H 8.070 0.020 1 485 55 55 GLY HA2 H 4.000 0.020 2 486 55 55 GLY HA3 H 3.340 0.020 2 487 55 55 GLY CA C 45.200 0.200 1 488 55 55 GLY N N 102.500 0.200 1 489 56 56 LYS H H 7.860 0.020 1 490 56 56 LYS HA H 4.510 0.020 1 491 56 56 LYS HB2 H 1.790 0.020 2 492 56 56 LYS HE2 H 3.065 0.020 2 493 56 56 LYS HE3 H 3.065 0.020 2 494 56 56 LYS HG2 H 1.412 0.020 2 495 56 56 LYS HG3 H 1.412 0.020 2 496 56 56 LYS CA C 54.500 0.200 1 497 56 56 LYS CB C 34.400 0.200 1 498 56 56 LYS CG C 24.361 0.200 1 499 56 56 LYS N N 121.800 0.200 1 500 57 57 GLN H H 8.600 0.020 1 501 57 57 GLN HA H 4.410 0.020 1 502 57 57 GLN HB2 H 1.900 0.020 2 503 57 57 GLN HB3 H 1.790 0.020 2 504 57 57 GLN HG2 H 2.150 0.020 2 505 57 57 GLN HG3 H 2.150 0.020 2 506 57 57 GLN CA C 55.900 0.200 1 507 57 57 GLN CB C 28.800 0.200 1 508 57 57 GLN CG C 34.551 0.200 1 509 57 57 GLN N N 123.200 0.200 1 510 58 58 LEU H H 8.480 0.020 1 511 58 58 LEU HA H 4.060 0.020 1 512 58 58 LEU HB2 H 1.410 0.020 2 513 58 58 LEU HB3 H 1.834 0.020 2 514 58 58 LEU HD1 H 0.432 0.020 2 515 58 58 LEU HD2 H 0.432 0.020 2 516 58 58 LEU HG H 0.974 0.020 1 517 58 58 LEU CA C 54.100 0.200 1 518 58 58 LEU CB C 41.500 0.200 1 519 58 58 LEU CD1 C 25.956 0.200 2 520 58 58 LEU CD2 C 19.444 0.200 2 521 58 58 LEU CG C 31.323 0.200 1 522 58 58 LEU N N 125.900 0.200 1 523 59 59 GLU H H 8.400 0.020 1 524 59 59 GLU HA H 4.400 0.020 1 525 59 59 GLU HB2 H 2.140 0.020 2 526 59 59 GLU HB3 H 1.908 0.020 2 527 59 59 GLU HG2 H 2.325 0.020 2 528 59 59 GLU HG3 H 2.325 0.020 2 529 59 59 GLU CA C 55.900 0.200 1 530 59 59 GLU CB C 31.900 0.200 1 531 59 59 GLU CG C 36.397 0.200 1 532 59 59 GLU N N 123.100 0.200 1 533 60 60 ASP H H 8.110 0.020 1 534 60 60 ASP HA H 4.270 0.020 1 535 60 60 ASP HB2 H 2.520 0.020 2 536 60 60 ASP HB3 H 2.430 0.020 2 537 60 60 ASP CA C 57.100 0.200 1 538 60 60 ASP CB C 40.800 0.200 1 539 60 60 ASP N N 120.300 0.200 1 540 61 61 GLY HA2 H 4.000 0.020 2 541 61 61 GLY HA3 H 3.830 0.020 2 542 61 61 GLY CA C 45.000 0.200 1 543 62 62 ARG H H 7.350 0.020 1 544 62 62 ARG HA H 4.640 0.020 1 545 62 62 ARG HB2 H 2.020 0.020 2 546 62 62 ARG HB3 H 1.500 0.020 2 547 62 62 ARG HG2 H 1.622 0.020 2 548 62 62 ARG HG3 H 1.622 0.020 2 549 62 62 ARG CA C 54.400 0.200 1 550 62 62 ARG CB C 32.600 0.200 1 551 62 62 ARG CG C 27.545 0.200 1 552 62 62 ARG N N 119.300 0.200 1 553 63 63 THR H H 8.460 0.020 1 554 63 63 THR HA H 5.060 0.020 1 555 63 63 THR HB H 4.460 0.020 1 556 63 63 THR HG2 H 1.073 0.020 . 557 63 63 THR CA C 59.700 0.200 1 558 63 63 THR CB C 72.000 0.200 1 559 63 63 THR CG2 C 22.261 0.200 1 560 63 63 THR N N 109.100 0.200 1 561 64 64 LEU H H 8.190 0.020 1 562 64 64 LEU HA H 3.920 0.020 1 563 64 64 LEU HB2 H 1.970 0.020 2 564 64 64 LEU HB3 H 1.699 0.020 2 565 64 64 LEU HD1 H 0.670 0.020 2 566 64 64 LEU HD2 H 0.532 0.020 2 567 64 64 LEU HG H 1.105 0.020 1 568 64 64 LEU CA C 58.400 0.200 1 569 64 64 LEU CB C 40.200 0.200 1 570 64 64 LEU CD1 C 23.005 0.200 2 571 64 64 LEU CD2 C 23.005 0.200 2 572 64 64 LEU CG C 26.599 0.200 1 573 64 64 LEU N N 118.100 0.200 1 574 65 65 SER H H 8.370 0.020 1 575 65 65 SER HA H 4.150 0.020 1 576 65 65 SER HB2 H 3.750 0.020 2 577 65 65 SER HB3 H 3.664 0.020 2 578 65 65 SER CA C 60.900 0.200 1 579 65 65 SER CB C 62.500 0.200 1 580 65 65 SER N N 112.200 0.200 1 581 66 66 GLU H H 7.780 0.020 1 582 66 66 GLU HA H 3.890 0.020 1 583 66 66 GLU HB2 H 2.060 0.020 2 584 66 66 GLU HB3 H 1.683 0.020 2 585 66 66 GLU HG2 H 2.199 0.020 2 586 66 66 GLU HG3 H 2.199 0.020 2 587 66 66 GLU CA C 59.200 0.200 1 588 66 66 GLU CB C 29.400 0.200 1 589 66 66 GLU CG C 38.039 0.200 1 590 66 66 GLU N N 123.600 0.200 1 591 67 67 TYR H H 7.290 0.020 1 592 67 67 TYR HA H 4.590 0.020 1 593 67 67 TYR HB2 H 2.480 0.020 2 594 67 67 TYR HB3 H 3.342 0.020 2 595 67 67 TYR HD1 H 6.798 0.020 3 596 67 67 TYR HD2 H 6.798 0.020 3 597 67 67 TYR CA C 58.400 0.200 1 598 67 67 TYR CB C 39.800 0.200 1 599 67 67 TYR N N 116.400 0.200 1 600 68 68 ASN H H 8.040 0.020 1 601 68 68 ASN HA H 4.240 0.020 1 602 68 68 ASN HB2 H 2.730 0.020 2 603 68 68 ASN HB3 H 2.732 0.020 2 604 68 68 ASN CA C 54.100 0.200 1 605 68 68 ASN CB C 37.200 0.200 1 606 68 68 ASN N N 115.600 0.200 1 607 69 69 ILE H H 7.200 0.020 1 608 69 69 ILE HA H 3.280 0.020 1 609 69 69 ILE HB H 1.300 0.020 1 610 69 69 ILE HD1 H 0.315 0.020 1 611 69 69 ILE HG12 H 1.296 0.020 2 612 69 69 ILE HG13 H 1.296 0.020 2 613 69 69 ILE HG2 H 0.982 0.020 1 614 69 69 ILE CA C 59.800 0.200 1 615 69 69 ILE CB C 36.600 0.200 1 616 69 69 ILE CD1 C 14.302 0.200 1 617 69 69 ILE CG1 C 28.112 0.200 1 618 69 69 ILE CG2 C 17.322 0.200 1 619 69 69 ILE N N 119.100 0.200 1 620 70 70 GLN H H 7.570 0.020 1 621 70 70 GLN HA H 4.410 0.020 1 622 70 70 GLN HB2 H 2.160 0.020 2 623 70 70 GLN HB3 H 1.777 0.020 2 624 70 70 GLN HG2 H 2.235 0.020 2 625 70 70 GLN HG3 H 2.235 0.020 2 626 70 70 GLN CA C 53.500 0.200 1 627 70 70 GLN CB C 31.500 0.200 1 628 70 70 GLN CG C 36.424 0.200 1 629 70 70 GLN N N 124.800 0.200 1 630 71 71 LYS H H 8.370 0.020 1 631 71 71 LYS HA H 3.870 0.020 1 632 71 71 LYS HB2 H 1.945 0.020 2 633 71 71 LYS HB3 H 1.790 0.020 2 634 71 71 LYS HD2 H 1.790 0.020 2 635 71 71 LYS HD3 H 1.790 0.020 2 636 71 71 LYS HE2 H 2.940 0.020 2 637 71 71 LYS HE3 H 2.940 0.020 2 638 71 71 LYS HG2 H 1.423 0.020 2 639 71 71 LYS HG3 H 1.423 0.020 2 640 71 71 LYS CA C 58.000 0.200 1 641 71 71 LYS CB C 32.500 0.200 1 642 71 71 LYS CD C 29.658 0.200 1 643 71 71 LYS CG C 24.277 0.200 1 644 71 71 LYS N N 120.200 0.200 1 645 72 72 GLU H H 9.230 0.020 1 646 72 72 GLU HA H 3.240 0.020 1 647 72 72 GLU HB2 H 1.950 0.020 2 648 72 72 GLU HB3 H 2.141 0.020 2 649 72 72 GLU HG2 H 2.309 0.020 2 650 72 72 GLU HG3 H 2.443 0.020 2 651 72 72 GLU CA C 58.300 0.200 1 652 72 72 GLU CB C 26.000 0.200 1 653 72 72 GLU CG C 37.366 0.200 1 654 72 72 GLU N N 115.100 0.200 1 655 73 73 SER H H 7.690 0.020 1 656 73 73 SER HA H 4.520 0.020 1 657 73 73 SER HB2 H 3.810 0.020 2 658 73 73 SER HB3 H 3.577 0.020 2 659 73 73 SER CA C 61.100 0.200 1 660 73 73 SER CB C 64.800 0.200 1 661 73 73 SER N N 115.300 0.200 1 662 74 74 THR H H 8.620 0.020 1 663 74 74 THR HA H 5.200 0.020 1 664 74 74 THR HB H 3.960 0.020 1 665 74 74 THR HG2 H 0.840 0.020 . 666 74 74 THR CA C 62.400 0.200 1 667 74 74 THR CB C 70.200 0.200 1 668 74 74 THR CG2 C 21.406 0.200 1 669 74 74 THR N N 117.500 0.200 1 670 75 75 LEU H H 9.350 0.020 1 671 75 75 LEU HA H 4.990 0.020 1 672 75 75 LEU HB2 H 3.960 0.020 2 673 75 75 LEU HB3 H 1.530 0.020 2 674 75 75 LEU HD1 H 0.597 0.020 2 675 75 75 LEU HD2 H 0.559 0.020 2 676 75 75 LEU HG H 1.671 0.020 1 677 75 75 LEU CA C 53.800 0.200 1 678 75 75 LEU CB C 44.400 0.200 1 679 75 75 LEU CD1 C 24.908 0.200 2 680 75 75 LEU CD2 C 25.255 0.200 2 681 75 75 LEU CG C 29.635 0.200 1 682 75 75 LEU N N 128.000 0.200 1 683 76 76 HIS H H 9.140 0.020 1 684 76 76 HIS HA H 5.040 0.020 1 685 76 76 HIS HB2 H 2.950 0.020 2 686 76 76 HIS HB3 H 2.761 0.020 2 687 76 76 HIS CA C 56.200 0.200 1 688 76 76 HIS CB C 32.500 0.200 1 689 76 76 HIS N N 119.600 0.200 1 690 77 77 LEU H H 8.240 0.020 1 691 77 77 LEU HA H 5.080 0.020 1 692 77 77 LEU HB2 H 1.234 0.020 2 693 77 77 LEU HB3 H 1.500 0.020 2 694 77 77 LEU HD1 H 0.765 0.020 2 695 77 77 LEU HD2 H 0.643 0.020 2 696 77 77 LEU HG H 1.018 0.020 1 697 77 77 LEU CA C 53.600 0.200 1 698 77 77 LEU CB C 44.100 0.200 1 699 77 77 LEU CD1 C 26.068 0.200 2 700 77 77 LEU CD2 C 24.047 0.200 2 701 77 77 LEU CG C 27.520 0.200 1 702 77 77 LEU N N 123.800 0.200 1 703 78 78 VAL H H 9.110 0.020 1 704 78 78 VAL HA H 4.260 0.020 1 705 78 78 VAL HB H 1.910 0.020 1 706 78 78 VAL HG1 H 0.832 0.020 2 707 78 78 VAL HG2 H 0.748 0.020 2 708 78 78 VAL CA C 60.400 0.200 1 709 78 78 VAL CB C 34.700 0.200 1 710 78 78 VAL CG1 C 21.111 0.200 2 711 78 78 VAL CG2 C 20.693 0.200 2 712 78 78 VAL N N 127.100 0.200 1 713 79 79 LEU H H 8.050 0.020 1 714 79 79 LEU HA H 4.950 0.020 1 715 79 79 LEU HB2 H 1.580 0.020 2 716 79 79 LEU HD1 H 0.756 0.020 2 717 79 79 LEU HD2 H 0.864 0.020 2 718 79 79 LEU HG H 1.421 0.020 1 719 79 79 LEU CA C 53.800 0.200 1 720 79 79 LEU CB C 42.700 0.200 1 721 79 79 LEU CD1 C 25.003 0.200 2 722 79 79 LEU CD2 C 23.904 0.200 2 723 79 79 LEU CG C 27.528 0.200 1 724 79 79 LEU N N 123.400 0.200 1 725 80 80 ARG H H 8.540 0.020 1 726 80 80 ARG HA H 4.170 0.020 1 727 80 80 ARG HB2 H 1.670 0.020 2 728 80 80 ARG HB3 H 1.670 0.020 2 729 80 80 ARG HD2 H 2.946 0.020 2 730 80 80 ARG HD3 H 2.761 0.020 2 731 80 80 ARG HG2 H 1.442 0.020 2 732 80 80 ARG HG3 H 1.388 0.020 2 733 80 80 ARG CA C 55.800 0.200 1 734 80 80 ARG CB C 31.100 0.200 1 735 80 80 ARG CG C 27.283 0.200 1 736 80 80 ARG N N 123.500 0.200 1 737 81 81 LEU H H 8.250 0.020 1 738 81 81 LEU HA H 4.270 0.020 1 739 81 81 LEU HB2 H 1.670 0.020 2 740 81 81 LEU HB3 H 1.525 0.020 2 741 81 81 LEU HD1 H 0.765 0.020 2 742 81 81 LEU HD2 H 0.808 0.020 2 743 81 81 LEU HG H 1.132 0.020 1 744 81 81 LEU CA C 55.000 0.200 1 745 81 81 LEU CB C 42.200 0.200 1 746 81 81 LEU CD1 C 24.800 0.200 2 747 81 81 LEU CD2 C 23.000 0.200 2 748 81 81 LEU CG C 26.908 0.200 1 749 81 81 LEU N N 124.100 0.200 1 750 82 82 ARG H H 8.310 0.020 1 751 82 82 ARG HA H 4.200 0.020 1 752 82 82 ARG HB2 H 1.670 0.020 2 753 82 82 ARG HB3 H 1.500 0.020 2 754 82 82 ARG CA C 56.300 0.200 1 755 82 82 ARG CB C 30.700 0.200 1 756 82 82 ARG CG C 26.858 0.200 1 757 82 82 ARG N N 121.500 0.200 1 758 83 83 GLY H H 8.410 0.020 1 759 83 83 GLY HA2 H 3.750 0.020 2 760 83 83 GLY HA3 H 3.754 0.020 2 761 83 83 GLY CA C 45.100 0.200 1 762 83 83 GLY N N 110.200 0.200 1 763 84 84 TYR H H 7.950 0.020 1 764 84 84 TYR HA H 4.400 0.020 1 765 84 84 TYR HB2 H 2.970 0.020 2 766 84 84 TYR HB3 H 2.850 0.020 2 767 84 84 TYR CA C 58.100 0.200 1 768 84 84 TYR CB C 38.800 0.200 1 769 84 84 TYR N N 119.900 0.200 1 770 85 85 ALA H H 8.150 0.020 1 771 85 85 ALA HA H 4.150 0.020 1 772 85 85 ALA HB H 1.240 0.020 1 773 85 85 ALA CA C 52.600 0.200 1 774 85 85 ALA CB C 19.200 0.200 1 775 85 85 ALA N N 124.800 0.200 1 776 86 86 ASP H H 8.020 0.020 1 777 86 86 ASP HA H 4.450 0.020 1 778 86 86 ASP HB2 H 2.640 0.020 2 779 86 86 ASP HB3 H 2.755 0.020 2 780 86 86 ASP CA C 54.100 0.200 1 781 86 86 ASP CB C 41.100 0.200 1 782 86 86 ASP N N 118.900 0.200 1 783 87 87 LEU H H 8.010 0.020 1 784 87 87 LEU HA H 4.210 0.020 1 785 87 87 LEU HB2 H 1.550 0.020 2 786 87 87 LEU HD1 H 0.758 0.020 2 787 87 87 LEU HD2 H 0.813 0.020 2 788 87 87 LEU HG H 1.521 0.020 1 789 87 87 LEU CA C 55.300 0.200 1 790 87 87 LEU CB C 42.000 0.200 1 791 87 87 LEU CD1 C 24.892 0.200 2 792 87 87 LEU CD2 C 23.308 0.200 2 793 87 87 LEU CG C 27.108 0.200 1 794 87 87 LEU N N 122.400 0.200 1 795 88 88 ARG H H 8.170 0.020 1 796 88 88 ARG HA H 4.210 0.020 1 797 88 88 ARG HB2 H 1.770 0.020 2 798 88 88 ARG HB3 H 1.770 0.020 2 799 88 88 ARG CA C 56.300 0.200 1 800 88 88 ARG CB C 30.600 0.200 1 801 88 88 ARG N N 121.200 0.200 1 802 91 91 PRO HA H 4.290 0.020 1 803 91 91 PRO HB2 H 2.176 0.020 2 804 91 91 PRO HB3 H 2.176 0.020 2 805 91 91 PRO HG2 H 1.884 0.020 2 806 91 91 PRO HG3 H 1.884 0.020 2 807 91 91 PRO CA C 63.800 0.200 1 808 91 91 PRO CB C 32.100 0.200 1 809 91 91 PRO CD C 58.259 0.200 1 810 91 91 PRO CG C 27.123 0.200 1 811 92 92 ASP H H 8.280 0.020 1 812 92 92 ASP HA H 4.540 0.020 1 813 92 92 ASP HB2 H 2.650 0.020 2 814 92 92 ASP HB3 H 2.520 0.020 2 815 92 92 ASP CA C 54.600 0.200 1 816 92 92 ASP CB C 41.000 0.200 1 817 92 92 ASP N N 118.700 0.200 1 818 93 93 ARG H H 7.780 0.020 1 819 93 93 ARG HA H 4.190 0.020 1 820 93 93 ARG HB2 H 1.700 0.020 2 821 93 93 ARG HB3 H 1.839 0.020 2 822 93 93 ARG HD2 H 2.263 0.020 2 823 93 93 ARG HD3 H 2.238 0.020 2 824 93 93 ARG HG2 H 1.748 0.020 2 825 93 93 ARG HG3 H 1.508 0.020 2 826 93 93 ARG CA C 56.300 0.200 1 827 93 93 ARG CB C 30.700 0.200 1 828 93 93 ARG CD C 35.447 0.200 1 829 93 93 ARG CG C 27.010 0.200 1 830 93 93 ARG N N 120.700 0.200 1 831 94 94 GLN H H 8.280 0.020 1 832 94 94 GLN HA H 4.210 0.020 1 833 94 94 GLN HB2 H 1.937 0.020 2 834 94 94 GLN HB3 H 1.979 0.020 2 835 94 94 GLN HG2 H 2.263 0.020 2 836 94 94 GLN HG3 H 2.238 0.020 2 837 94 94 GLN CA C 55.800 0.200 1 838 94 94 GLN CB C 29.300 0.200 1 839 94 94 GLN CG C 33.659 0.200 1 840 94 94 GLN N N 121.000 0.200 1 841 95 95 ASP H H 8.270 0.020 1 842 95 95 ASP HA H 4.450 0.020 1 843 95 95 ASP HB2 H 2.495 0.020 2 844 95 95 ASP HB3 H 2.495 0.020 2 845 95 95 ASP CA C 54.300 0.200 1 846 95 95 ASP CB C 41.000 0.200 1 847 95 95 ASP N N 121.000 0.200 1 848 96 96 HIS H H 8.090 0.020 1 849 96 96 HIS HA H 4.470 0.020 1 850 96 96 HIS HB2 H 2.900 0.020 2 851 96 96 HIS HB3 H 2.500 0.020 2 852 96 96 HIS CA C 55.900 0.200 1 853 96 96 HIS CB C 30.500 0.200 1 854 96 96 HIS N N 119.300 0.200 1 855 97 97 HIS H H 8.240 0.020 1 856 97 97 HIS HA H 4.470 0.020 1 857 97 97 HIS HB2 H 2.900 0.020 2 858 97 97 HIS HB3 H 2.900 0.020 2 859 97 97 HIS CA C 56.200 0.200 1 860 97 97 HIS CB C 30.400 0.200 1 861 97 97 HIS N N 121.300 0.200 1 862 98 98 PRO HA H 4.340 0.020 1 863 98 98 PRO HB2 H 2.183 0.020 2 864 98 98 PRO HB3 H 2.183 0.020 2 865 98 98 PRO HD2 H 3.539 0.020 2 866 98 98 PRO HD3 H 3.364 0.020 2 867 98 98 PRO HG2 H 1.877 0.020 2 868 98 98 PRO HG3 H 1.887 0.020 2 869 98 98 PRO CA C 63.700 0.200 1 870 98 98 PRO CB C 31.900 0.200 1 871 98 98 PRO CD C 58.259 0.200 1 872 98 98 PRO CG C 27.254 0.200 1 873 99 99 GLY H H 8.660 0.020 1 874 99 99 GLY HA2 H 3.920 0.020 2 875 99 99 GLY HA3 H 3.920 0.020 2 876 99 99 GLY CA C 45.200 0.200 1 877 99 99 GLY N N 110.000 0.200 1 878 100 100 SER H H 8.170 0.020 1 879 100 100 SER HA H 4.360 0.020 1 880 100 100 SER HB2 H 3.800 0.020 2 881 100 100 SER HB3 H 3.801 0.020 2 882 100 100 SER CA C 58.500 0.200 1 883 100 100 SER CB C 64.000 0.200 1 884 100 100 SER N N 115.600 0.200 1 885 101 101 GLY H H 8.420 0.020 1 886 101 101 GLY HA2 H 3.890 0.020 2 887 101 101 GLY HA3 H 3.920 0.020 2 888 101 101 GLY CA C 45.200 0.200 1 889 101 101 GLY N N 111.000 0.200 1 890 102 102 ALA H H 8.030 0.020 1 891 102 102 ALA HA H 4.250 0.020 1 892 102 102 ALA HB H 1.290 0.020 1 893 102 102 ALA CA C 52.500 0.200 1 894 102 102 ALA CB C 19.200 0.200 1 895 102 102 ALA N N 124.100 0.200 1 stop_ save_