data_4983 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 15N, 13C and side chain 13C assignment of YUH1-Ub in a 35 kDa complex ; _BMRB_accession_number 4983 _BMRB_flat_file_name bmr4983.str _Entry_type original _Submission_date 2001-03-29 _Accession_date 2001-04-03 _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 Rajesh Sundaresan . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 293 "13C chemical shifts" 1182 "15N chemical shifts" 293 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2008-07-17 update BMRB 'Updating non-standard residue' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Backbone 1H,13C,15N and side chain 13C assignment of YUH1-Ub in a 35 kDa covalent complex ; _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 Rajesh Sundaresan . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _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_system_Yuh1 _Saveframe_category molecular_system _Mol_system_name YUH1 _Abbreviation_common Yuh1 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'YUH1 monomer' $yuh1_monomer Ubiquitin $Ubiquitin stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'all other bound' _Database_query_date . _Details 'Cys-90 of Yuh1 covalently linked to Gly-76 of Ubiquitin by a thioester bond' save_ ######################## # Monomeric polymers # ######################## save_yuh1_monomer _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Yuh1 _Abbreviation_common Yuh1 _Molecular_mass . _Mol_thiol_state 'all other bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 236 _Mol_residue_sequence ; MSGENRAVVPIESNPEVFTN FAHKLGLKNEWAYFDIYSLT EPELLAFLPRPVKAIVLLFP INEDRKSSTSQQITSSYDVI WFKQSVKNACGLYAILHSLS NNQSLLEPGSDLDNFLKSQS DTSSSKNRFDDVTTDQFVLN VIKENVQTFSTGQSEAPEAT ADTNLHYITYVEENGGIFEL DGRNLSGPLYLGKSDPTATD LIEQELVRVRVASYMENANE EDVLNFAMLGLGPNWE ; loop_ _Residue_seq_code _Residue_label 1 MET 2 SER 3 GLY 4 GLU 5 ASN 6 ARG 7 ALA 8 VAL 9 VAL 10 PRO 11 ILE 12 GLU 13 SER 14 ASN 15 PRO 16 GLU 17 VAL 18 PHE 19 THR 20 ASN 21 PHE 22 ALA 23 HIS 24 LYS 25 LEU 26 GLY 27 LEU 28 LYS 29 ASN 30 GLU 31 TRP 32 ALA 33 TYR 34 PHE 35 ASP 36 ILE 37 TYR 38 SER 39 LEU 40 THR 41 GLU 42 PRO 43 GLU 44 LEU 45 LEU 46 ALA 47 PHE 48 LEU 49 PRO 50 ARG 51 PRO 52 VAL 53 LYS 54 ALA 55 ILE 56 VAL 57 LEU 58 LEU 59 PHE 60 PRO 61 ILE 62 ASN 63 GLU 64 ASP 65 ARG 66 LYS 67 SER 68 SER 69 THR 70 SER 71 GLN 72 GLN 73 ILE 74 THR 75 SER 76 SER 77 TYR 78 ASP 79 VAL 80 ILE 81 TRP 82 PHE 83 LYS 84 GLN 85 SER 86 VAL 87 LYS 88 ASN 89 ALA 90 CYS 91 GLY 92 LEU 93 TYR 94 ALA 95 ILE 96 LEU 97 HIS 98 SER 99 LEU 100 SER 101 ASN 102 ASN 103 GLN 104 SER 105 LEU 106 LEU 107 GLU 108 PRO 109 GLY 110 SER 111 ASP 112 LEU 113 ASP 114 ASN 115 PHE 116 LEU 117 LYS 118 SER 119 GLN 120 SER 121 ASP 122 THR 123 SER 124 SER 125 SER 126 LYS 127 ASN 128 ARG 129 PHE 130 ASP 131 ASP 132 VAL 133 THR 134 THR 135 ASP 136 GLN 137 PHE 138 VAL 139 LEU 140 ASN 141 VAL 142 ILE 143 LYS 144 GLU 145 ASN 146 VAL 147 GLN 148 THR 149 PHE 150 SER 151 THR 152 GLY 153 GLN 154 SER 155 GLU 156 ALA 157 PRO 158 GLU 159 ALA 160 THR 161 ALA 162 ASP 163 THR 164 ASN 165 LEU 166 HIS 167 TYR 168 ILE 169 THR 170 TYR 171 VAL 172 GLU 173 GLU 174 ASN 175 GLY 176 GLY 177 ILE 178 PHE 179 GLU 180 LEU 181 ASP 182 GLY 183 ARG 184 ASN 185 LEU 186 SER 187 GLY 188 PRO 189 LEU 190 TYR 191 LEU 192 GLY 193 LYS 194 SER 195 ASP 196 PRO 197 THR 198 ALA 199 THR 200 ASP 201 LEU 202 ILE 203 GLU 204 GLN 205 GLU 206 LEU 207 VAL 208 ARG 209 VAL 210 ARG 211 VAL 212 ALA 213 SER 214 TYR 215 MET 216 GLU 217 ASN 218 ALA 219 ASN 220 GLU 221 GLU 222 ASP 223 VAL 224 LEU 225 ASN 226 PHE 227 ALA 228 MET 229 LEU 230 GLY 231 LEU 232 GLY 233 PRO 234 ASN 235 TRP 236 GLU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-29 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 15047 denatured_ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 15410 Ubi 98.68 76 97.33 100.00 3.66e-44 BMRB 15592 ubiquitin 98.68 76 98.67 98.67 4.08e-44 BMRB 15866 ubiquitin 98.68 76 97.33 100.00 2.88e-44 BMRB 15907 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 16582 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 16626 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 16763 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 16880 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 16885 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 17024 ubiquitin 98.68 76 98.67 98.67 4.08e-44 BMRB 17059 ubiquitin 98.68 156 97.33 100.00 5.28e-44 BMRB 17181 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 17239 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 17333 UB 98.68 76 97.33 100.00 3.66e-44 BMRB 17439 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 17769 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 17919 entity 98.68 76 97.33 100.00 3.66e-44 BMRB 18582 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 18583 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 18584 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 18610 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 18611 Ubiquitin_A_state 98.68 76 97.33 100.00 3.66e-44 BMRB 18737 UBIQUITIN 98.68 76 97.33 100.00 3.66e-44 BMRB 19394 ubiquitin 98.68 79 97.33 100.00 3.68e-44 BMRB 19399 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 19406 entity 98.68 152 97.33 100.00 3.27e-43 BMRB 19412 entity 98.68 152 97.33 100.00 3.27e-43 BMRB 19447 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 25070 Ubiquitin 98.68 79 97.33 100.00 3.68e-44 BMRB 25230 Ubiquitin 98.68 78 97.33 100.00 3.11e-44 BMRB 4245 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 4375 Ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 4769 yUb 98.68 76 97.33 98.67 1.22e-43 BMRB 5387 ubq 98.68 76 97.33 100.00 3.66e-44 BMRB 6457 Ub 98.68 76 97.33 100.00 3.66e-44 BMRB 6466 Ub 98.68 76 97.33 100.00 3.66e-44 BMRB 6470 Ub 98.68 76 97.33 100.00 3.66e-44 BMRB 6488 Ub 98.68 76 97.33 100.00 3.66e-44 BMRB 68 ubiquitin 98.68 76 97.33 100.00 3.66e-44 BMRB 7111 human_ubiquitin 98.68 76 97.33 100.00 3.66e-44 PDB 1AAR "Structure Of A Diubiquitin Conjugate And A Model For Interaction With Ubiquitin Conjugating Enzyme (E2)" 98.68 76 97.33 100.00 3.66e-44 PDB 1CMX "Structural Basis For The Specificity Of Ubiquitin C- Terminal Hydrolases" 98.68 76 97.33 100.00 3.07e-44 PDB 1D3Z "Ubiquitin Nmr Structure" 98.68 76 97.33 100.00 3.66e-44 PDB 1F9J "Structure Of A New Crystal Form Of Tetraubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 1FXT "Structure Of A Conjugating Enzyme-Ubiquitin Thiolester Complex" 98.68 76 97.33 100.00 3.66e-44 PDB 1G6J "Structure Of Recombinant Human Ubiquitin In Aot Reverse Micelles" 97.37 76 97.30 100.00 3.92e-43 PDB 1NBF "Crystal Structure Of A Ubp-Family Deubiquitinating Enzyme In Isolation And In Complex With Ubiquitin Aldehyde" 98.68 76 97.33 100.00 3.07e-44 PDB 1OTR "Solution Structure Of A Cue-Ubiquitin Complex" 98.68 76 98.67 98.67 4.08e-44 PDB 1P3Q "Mechanism Of Ubiquitin Recognition By The Cue Domain Of Vps9" 98.68 76 97.33 100.00 3.66e-44 PDB 1Q0W "Solution Structure Of Vps27 Amino-Terminal Uim-Ubiquitin Complex" 98.68 76 98.67 98.67 4.08e-44 PDB 1Q5W "Ubiquitin Recognition By Npl4 Zinc-Fingers" 98.68 76 97.33 100.00 3.66e-44 PDB 1S1Q "Tsg101(Uev) Domain In Complex With Ubiquitin" 97.37 76 97.30 100.00 3.92e-43 PDB 1TBE "Structure Of Tetraubiquitin Shows How Multiubiquitin Chains Can Be Formed" 98.68 76 97.33 100.00 3.66e-44 PDB 1UBI "Synthetic Structural And Biological Studies Of The Ubiquitin System. Part 1" 98.68 76 97.33 100.00 3.66e-44 PDB 1UBQ "Structure Of Ubiquitin Refined At 1.8 Angstroms Resolution" 98.68 76 97.33 100.00 3.66e-44 PDB 1UZX "A Complex Of The Vps23 Uev With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 1V80 "Solution Structures Of Ubiquitin At 30 Bar And 3 Kbar" 98.68 76 97.33 100.00 3.66e-44 PDB 1V81 "Solution Structures Of Ubiquitin At 30 Bar And 3 Kbar" 98.68 76 97.33 100.00 3.66e-44 PDB 1VW8 "S. Cerevisiae 80s Ribosome Bound With Taura Syndrome Virus (tsv) Ires, 5 Degree Rotation (class Ii). This Entry Contains The La" 98.68 128 98.67 98.67 4.67e-44 PDB 1VW9 "S. Cerevisiae 80s Ribosome Bound With Taura Syndrome Virus (tsv) Ires, 5 Degree Rotation (class Ii). This Entry Contains The Sm" 98.68 152 98.67 98.67 5.24e-44 PDB 1VWU "S. Cerevisiae 80s Ribosome Bound With Taura Syndrome Virus (tsv) Ires, 2 Degree Rotation (class I). This Entry Contains The Lar" 98.68 128 98.67 98.67 4.67e-44 PDB 1VWV "S. Cerevisiae 80s Ribosome Bound With Taura Syndrome Virus (tsv) Ires, 2 Degree Rotation (class I). This Entry Contains The Sma" 98.68 152 98.67 98.67 5.24e-44 PDB 1VXV "Structures Of Yeast 80s Ribosome-trna Complexes In The Rotated And Non-rotated Conformations (class Ii - Rotated Ribosome With " 98.68 128 98.67 98.67 4.67e-44 PDB 1VXW "Structures Of Yeast 80s Ribosome-trna Complexes In The Rotated And Non-rotated Conformations (class Ii - Rotated Ribosome With " 98.68 152 98.67 98.67 5.24e-44 PDB 1VXY "Structures Of Yeast 80s Ribosome-trna Complexes In The Rotated And Non-rotated Conformations (class I - Non-rotated Ribosome Wi" 98.68 128 98.67 98.67 4.67e-44 PDB 1VXZ "Structures Of Yeast 80s Ribosome-trna Complexes In The Rotated And Non-rotated Conformations (class I - Non-rotated Ribosome Wi" 98.68 152 98.67 98.67 5.24e-44 PDB 1WR1 "The Complex Sturcture Of Dsk2p Uba With Ubiquitin" 98.68 76 98.67 98.67 4.08e-44 PDB 1WR6 "Crystal Structure Of Gga3 Gat Domain In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 1WRD "Crystal Structure Of Tom1 Gat Domain In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 1XD3 "Crystal Structure Of Uchl3-Ubvme Complex" 98.68 75 97.33 100.00 2.99e-44 PDB 1XQQ "Simultaneous Determination Of Protein Structure And Dynamics" 98.68 76 97.33 100.00 3.66e-44 PDB 1YD8 "Complex Of Human Gga3 Gat Domain And Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 1YX5 "Solution Structure Of S5a Uim-1UBIQUITIN COMPLEX" 98.68 98 97.33 100.00 1.80e-44 PDB 1YX6 "Solution Structure Of S5a Uim-2UBIQUITIN COMPLEX" 98.68 98 97.33 100.00 1.80e-44 PDB 2AYO "Structure Of Usp14 Bound To Ubquitin Aldehyde" 98.68 76 97.33 100.00 3.07e-44 PDB 2BGF "Nmr Structure Of Lys48-Linked Di-Ubiquitin Using Chemical Shift Perturbation Data Together With Rdcs And 15n- Relaxation Data" 98.68 76 97.33 100.00 3.66e-44 PDB 2C7M "Human Rabex-5 Residues 1-74 In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2C7N "Human Rabex-5 Residues 1-74 In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2D3G "Double Sided Ubiquitin Binding Of Hrs-Uim" 98.68 76 97.33 100.00 3.66e-44 PDB 2DEN "Solution Structure Of The Ubiquitin-Associated Domain Of Human Bmsc-Ubp And Its Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2DX5 "The Complex Structure Between The Mouse Eap45-Glue Domain And Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2FID "Crystal Structure Of A Bovine Rabex-5 Fragment Complexed With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2FIF "Crystal Structure Of A Bovine Rabex-5 Fragment Complexed With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2FUH "Solution Structure Of The Ubch5cUB NON-Covalent Complex" 98.68 76 97.33 100.00 3.66e-44 PDB 2G3Q "Solution Structure Of Ede1 Uba-Ubiquitin Complex" 98.68 76 98.67 98.67 4.08e-44 PDB 2G45 "Co-Crystal Structure Of Znf Ubp Domain From The Deubiquitinating Enzyme Isopeptidase T (Isot) In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2GMI Mms2UBC13~UBIQUITIN 98.68 76 97.33 100.00 3.66e-44 PDB 2HD5 "Usp2 In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2HTH "Structural Basis For Ubiquitin Recognition By The Human Eap45ESCRT-Ii Glue Domain" 98.68 76 97.33 100.00 3.66e-44 PDB 2IBI "Covalent Ubiquitin-Usp2 Complex" 98.68 75 97.33 100.00 2.99e-44 PDB 2J7Q "Crystal Structure Of The Ubiquitin-Specific Protease Encoded By Murine Cytomegalovirus Tegument Protein M48 In Complex With A U" 98.68 75 97.33 100.00 2.99e-44 PDB 2JF5 "Crystal Structure Of Lys63-Linked Di-Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2JRI "Solution Structure Of The Josephin Domain Of Ataxin-3 In Complex With Ubiquitin Molecule." 98.68 76 97.33 100.00 3.66e-44 PDB 2JT4 "Solution Structure Of The Sla1 Sh3-3-Ubiquitin Complex" 98.68 76 98.67 98.67 4.08e-44 PDB 2JWZ "Mutations In The Hydrophobic Core Of Ubiquitin Differentially Affect Its Recognition By Receptor Proteins" 98.68 76 97.33 97.33 3.55e-43 PDB 2JY6 "Solution Structure Of The Complex Of Ubiquitin And Ubiquilin 1 Uba Domain" 98.68 76 97.33 100.00 3.66e-44 PDB 2JZZ "Solid-State Nmr Structure Of Microcrystalline Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2K39 "Recognition Dynamics Up To Microseconds Revealed From Rdc Derived Ubiquitin Ensemble In Solution" 98.68 76 97.33 100.00 3.66e-44 PDB 2K6D "Cin85 Sh3-C Domain In Complex With Ubiquitin" 98.68 76 97.33 100.00 2.88e-44 PDB 2K8B "Solution Structure Of Plaa Family Ubiquitin Binding Domain (Pfuc) Cis Isomer In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2K8C "Solution Structure Of Plaa Family Ubiquitin Binding Domain (Pfuc) Trans Isomer In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2KDE "Nmr Structure Of Major S5a (196-306):k48 Linked Diubiquitin Species" 98.68 76 97.33 100.00 3.66e-44 PDB 2KDF "Nmr Structure Of Minor S5a (196-306):k48 Linked Diubiquitin Species" 98.68 76 97.33 100.00 3.66e-44 PDB 2KHW "Solution Structure Of The Human Polymerase Iota Ubm2- Ubiquitin Complex" 98.68 79 97.33 100.00 3.68e-44 PDB 2KJH "Nmr Based Structural Model Of The Ubch8-Ubiquitin Complex" 98.68 76 97.33 100.00 2.88e-44 PDB 2KLG "Pere Nmr Structure Of Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2KN5 "A Correspondence Between Solution-State Dynamics Of An Individual Protein And The Sequence And Conformational Diversity Of Its " 98.68 76 97.33 100.00 3.66e-44 PDB 2KOX "Nmr Residual Dipolar Couplings Identify Long Range Correlated Motions In The Backbone Of The Protein Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2KTF "Solution Nmr Structure Of Human Polymerase Iota Ubm2 In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2KWU "Solution Structure Of Ubm2 Of Murine Polymerase Iota In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2KWV "Solution Structure Of Ubm1 Of Murine Polymerase Iota In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2L00 "Solution Structure Of The Non-Covalent Complex Of The Znf216 A20 Domain With Ubiquitin" 98.68 76 98.67 98.67 4.08e-44 PDB 2L0F "Solution Nmr Structure Of Human Polymerase Iota Ubm2 (P692a Mutant) In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2L0T "Solution Structure Of The Complex Of Ubiquitin And The Vhs Domain Of Stam2" 98.68 76 97.33 100.00 3.66e-44 PDB 2L3Z "Proton-Detected 4d Dream Solid-State Nmr Structure Of Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2LD9 "Backbone Structure Of Ubiquitin Determined Using Backbone Amide Noes And Backbone N-H And N-C Rdcs" 98.68 77 97.33 100.00 4.57e-44 PDB 2LJ5 "Description Of The Structural Fluctuations Of Proteins From Structure- Based Calculations Of Residual Dipolar Couplings" 98.68 76 97.33 100.00 3.66e-44 PDB 2LVO "Structure Of The Gp78cue Domain Bound To Monubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2LVP "Gp78cue Domain Bound To The Distal Ubiquitin Of K48-Linked Diubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2LVQ "Gp78cue Domain Bound To The Proximal Ubiquitin Of K48-Linked Diubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2LZ6 "Distinct Ubiquitin Binding Modes Exhibited By Sh3 Domains: Molecular Determinants And Functional Implications" 98.68 76 97.33 100.00 3.66e-44 PDB 2MBB "Solution Structure Of The Human Polymerase Iota Ubm1-ubiquitin Complex" 98.68 78 97.33 100.00 3.11e-44 PDB 2MBH "Nmr Structure Of Eklf(22-40)/ubiquitin Complex" 98.68 76 97.33 100.00 3.66e-44 PDB 2MBO "K11-linked Diubiquitin Average Solution Structure At Ph 6.8, 0 Mm Nacl" 98.68 76 97.33 100.00 3.66e-44 PDB 2MBQ "K11-linked Diubiquitin Average Solution Structure At Ph 6.8, 150 Mm Nacl" 98.68 76 97.33 100.00 3.66e-44 PDB 2MCN "Distinct Ubiquitin Binding Modes Exhibited By Sh3 Domains: Molecular Determinants And Functional Implications" 98.68 76 97.33 100.00 3.66e-44 PDB 2MJ5 "Structure Of The Uba Domain Of Human Nbr1 In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2MJB "Solution Nmr Structure Of Ubiquitin Refined Against Dipolar Couplings In 4 Media" 98.68 76 97.33 100.00 3.66e-44 PDB 2MOR "A Tensor-free Method For The Structural And Dynamical Refinement Of Proteins Using Residual Dipolar Couplings" 98.68 76 97.33 100.00 3.66e-44 PDB 2MRE "Nmr Structure Of The Rad18-ubz/ubiquitin Complex" 98.68 79 97.33 100.00 3.68e-44 PDB 2MUR "Solution Structure Of The Human Faap20 Ubz-ubiquitin Complex" 98.68 78 97.33 100.00 3.11e-44 PDB 2NR2 "The Mumo (Minimal Under-Restraining Minimal Over- Restraining) Method For The Determination Of Native States Ensembles Of Prote" 98.68 76 97.33 100.00 3.66e-44 PDB 2O6V "Crystal Structure And Solution Nmr Studies Of Lys48-Linked Tetraubiquitin At Neutral Ph" 98.68 76 97.33 100.00 3.66e-44 PDB 2OJR "Structure Of Ubiquitin Solved By Sad Using The Lanthanide- Binding Tag" 98.68 111 97.33 100.00 1.40e-43 PDB 2OOB "Crystal Structure Of The Uba Domain From Cbl-B Ubiquitin Ligase In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2PE9 "Nmr Based Structure Of The Open Conformation Of Lys48- Linked Di-Ubiquitin Using Experimental Global Rotational Diffusion Tenso" 98.68 76 97.33 100.00 3.66e-44 PDB 2PEA "Nmr Based Structure Of The Closed Conformation Of Lys48- Linked Di-Ubiquitin Using Experimental Global Rotational Diffusion Ten" 98.68 76 97.33 100.00 3.66e-44 PDB 2QHO "Crystal Structure Of The Uba Domain From Edd Ubiquitin Ligase In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2RR9 "The Solution Structure Of The K63-Ub2:tuims Complex" 98.68 76 97.33 100.00 3.66e-44 PDB 2W9N "Crystal Structure Of Linear Di-Ubiquitin" 97.37 152 97.30 100.00 3.01e-42 PDB 2WDT "Crystal Structure Of Plasmodium Falciparum Uchl3 In Complex With The Suicide Inhibitor Ubvme" 98.68 76 97.33 100.00 3.07e-44 PDB 2WWZ "Tab2 Nzf Domain In Complex With Lys63-Linked Di-Ubiquitin, P212121" 98.68 76 97.33 100.00 3.66e-44 PDB 2WX0 "Tab2 Nzf Domain In Complex With Lys63-Linked Di-Ubiquitin, P21" 98.68 76 97.33 100.00 3.66e-44 PDB 2WX1 "Tab2 Nzf Domain In Complex With Lys63-Linked Tri-Ubiquitin, P212121" 98.68 76 97.33 100.00 3.66e-44 PDB 2XBB "Nedd4 Hect:ub Complex" 98.68 76 97.33 100.00 3.66e-44 PDB 2XEW "Crystal Structure Of K11-Linked Diubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2XK5 "Crystal Structure Of K6-Linked Diubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2Y5B "Structure Of Usp21 In Complex With Linear Diubiquitin-Aldehyde" 98.68 152 97.33 100.00 2.81e-43 PDB 2Z59 "Complex Structures Of Mouse Rpn13 (22-130aa) And Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 2ZCC "Ubiquitin Crystallized Under High Pressure" 98.68 76 97.33 100.00 3.66e-44 PDB 2ZNV "Crystal Structure Of Human Amsh-Lp Dub Domain In Complex With Lys63-Linked Ubiquitin Dimer" 98.68 77 97.33 100.00 4.57e-44 PDB 2ZVN "Nemo Cozi Domain Incomplex With Diubiquitin In P212121 Space Group" 98.68 154 97.33 100.00 3.07e-43 PDB 2ZVO "Nemo Cozi Domain In Complex With Diubiquitin In C2 Space Group" 98.68 154 97.33 100.00 3.07e-43 PDB 3A1Q "Crystal Structure Of The Mouse Rap80 Uims In Complex With Lys63-Linked Di-Ubiquitin" 98.68 77 97.33 100.00 4.57e-44 PDB 3A33 "Ubch5b~ubiquitin Conjugate" 98.68 76 97.33 100.00 3.66e-44 PDB 3A9J "Crystal Structure Of The Mouse Tab2-Nzf In Complex With Lys63-Linked Di-Ubiquitin" 98.68 77 97.33 100.00 4.57e-44 PDB 3A9K "Crystal Structure Of The Mouse Tab3-Nzf In Complex With Lys63-Linked Di-Ubiquitin" 98.68 77 97.33 100.00 4.57e-44 PDB 3AI5 "Crystal Structure Of Yeast Enhanced Green Fluorescent Protein- Ubiquitin Fusion Protein" 97.37 307 97.30 100.00 1.04e-40 PDB 3ALB "Cyclic Lys48-Linked Tetraubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3AUL "Crystal Structure Of Wild-Type Lys48-Linked Diubiquitin In An Open Conformation" 98.68 76 97.33 100.00 3.66e-44 PDB 3AXC "Crystal Structure Of Linear Diubiquitin" 98.68 154 97.33 100.00 3.07e-43 PDB 3B08 "Crystal Structure Of The Mouse Hoil1-l-nzf In Complex With Linear Di- Ubiquitin" 98.68 152 97.33 100.00 3.27e-43 PDB 3B0A "Crystal Structure Of The Mouse Hoil1-l-nzf In Complex With Linear Di- Ubiquitin" 98.68 152 97.33 100.00 3.27e-43 PDB 3BY4 "Structure Of Ovarian Tumor (Otu) Domain In Complex With Ubiquitin" 98.68 75 97.33 100.00 2.99e-44 PDB 3C0R "Structure Of Ovarian Tumor (Otu) Domain In Complex With Ubiquitin" 98.68 75 97.33 100.00 2.99e-44 PDB 3CMM "Crystal Structure Of The Uba1-Ubiquitin Complex" 98.68 76 98.67 98.67 4.08e-44 PDB 3DVG "Crystal Structure Of K63-Specific Fab Apu.3a8 Bound To K63-Linked Di- Ubiquitin" 98.68 80 97.33 100.00 4.80e-44 PDB 3DVN "Crystal Structure Of K63-specific Fab Apu2.16 Bound To K63-linked Di- Ubiquitin" 98.68 80 97.33 100.00 4.80e-44 PDB 3EEC "X-Ray Structure Of Human Ubiquitin Cd(Ii) Adduct" 98.68 76 97.33 100.00 3.66e-44 PDB 3EFU "X-Ray Structure Of Human Ubiquitin-Hg(Ii) Adduct" 98.68 76 97.33 100.00 3.66e-44 PDB 3EHV "X-Ray Structure Of Human Ubiquitin Zn(Ii) Adduct" 98.68 76 97.33 100.00 3.66e-44 PDB 3H1U "Structure Of Ubiquitin In Complex With Cd Ions" 98.68 76 97.33 100.00 3.66e-44 PDB 3H7P "Crystal Structure Of K63-Linked Di-Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3HM3 "The Structure And Conformation Of Lys-63 Linked Tetra-Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3I3T "Crystal Structure Of Covalent Ubiquitin-usp21 Complex" 98.68 75 97.33 100.00 2.99e-44 PDB 3IFW "Crystal Structure Of The S18y Variant Of Ubiquitin Carboxy T Hydrolase L1 Bound To Ubiquitin Vinylmethylester." 98.68 75 97.33 100.00 2.99e-44 PDB 3IHP "Covalent Ubiquitin-Usp5 Complex" 98.68 75 97.33 100.00 2.99e-44 PDB 3J80 "Cryoem Structure Of 40s-eif1-eif1a Preinitiation Complex" 98.68 150 98.67 98.67 1.74e-43 PDB 3J81 "Cryoem Structure Of A Partial Yeast 48s Preinitiation Complex" 98.68 150 98.67 98.67 1.74e-43 PDB 3JSV "Crystal Structure Of Mouse Nemo Cozi In Complex With Lys63- Linked Di-Ubiquitin" 98.68 77 97.33 100.00 4.57e-44 PDB 3JVZ E2~ubiquitin-Hect 98.68 81 97.33 100.00 3.53e-44 PDB 3JW0 E2~ubiquitin-Hect 98.68 81 97.33 100.00 3.53e-44 PDB 3K9O "The Crystal Structure Of E2-25k And Ubb+1 Complex" 98.68 96 97.33 100.00 9.80e-44 PDB 3K9P "The Crystal Structure Of E2-25k And Ubiquitin Complex" 98.68 79 97.33 100.00 3.68e-44 PDB 3KVF "Crystal Structure Of The I93m Mutant Of Ubiquitin Carboxy Te Hydrolase L1 Bound To Ubiquitin Vinylmethylester" 98.68 75 97.33 100.00 2.99e-44 PDB 3KW5 "Crystal Structure Of Ubiquitin Carboxy Terminal Hydrolase L1 Ubiquitin Vinylmethylester" 98.68 75 97.33 100.00 2.99e-44 PDB 3L0W "Structure Of Split Monoubiquitinated Pcna With Ubiquitin In Position Two" 98.68 169 98.67 98.67 8.47e-43 PDB 3L10 "Structure Of Split Monoubiquitinated Pcna With Ubiquitin In Position One" 98.68 169 98.67 98.67 8.47e-43 PDB 3LDZ "Crystal Structure Of Human Stam1 Vhs Domain In Complex With Ubiquitin" 96.05 73 97.26 100.00 1.39e-42 PDB 3M3J "A New Crystal Form Of Lys48-Linked Diubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3MHS "Structure Of The Saga Ubp8SGF11SUS1SGF73 DUB MODULE BOUND Ubiquitin Aldehyde" 98.68 76 97.33 100.00 3.07e-44 PDB 3N30 "Crystal Structure Of Cubic Zn3-Hub (Human Ubiquitin) Adduct" 98.68 76 97.33 100.00 3.66e-44 PDB 3N32 "The Crystal Structure Of Human Ubiquitin Adduct With Zeise's Salt" 98.68 76 97.33 100.00 3.66e-44 PDB 3NHE "High Resolution Structure (1.26a) Of Usp2a In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3NOB "Structure Of K11-linked Di-ubiquitin" 98.68 78 97.33 100.00 3.11e-44 PDB 3NS8 "Crystal Structure Of An Open Conformation Of Lys48-Linked Diubiquitin At Ph 7.5" 98.68 76 97.33 100.00 3.66e-44 PDB 3O65 "Crystal Structure Of A Josephin-Ubiquitin Complex: Evolutionary Restraints On Ataxin-3 Deubiquitinating Activity" 98.68 76 97.33 100.00 3.07e-44 PDB 3OFI "Crystal Structure Of Human Insulin-Degrading Enzyme In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3OJ3 "Crystal Structure Of The A20 Znf4 And Ubiquitin Complex" 98.68 79 97.33 100.00 3.68e-44 PDB 3OJ4 "Crystal Structure Of The A20 Znf4, Ubiquitin And Ubch5a Complex" 98.68 79 97.33 100.00 3.68e-44 PDB 3OLM "Structure And Function Of A Ubiquitin Binding Site Within The Catalytic Domain Of A Hect Ubiquitin Ligase" 98.68 79 98.67 98.67 2.63e-44 PDB 3ONS "Crystal Structure Of Human Ubiquitin In A New Crystal Form" 94.74 72 97.22 100.00 6.15e-42 PDB 3PHD "Crystal Structure Of Human Hdac6 In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3PHW "Otu Domain Of Crimean Congo Hemorrhagic Fever Virus In Complex With Ubiquitin" 98.68 75 97.33 100.00 2.99e-44 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 97.33 100.00 2.99e-44 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 97.33 100.00 2.99e-44 PDB 3PT2 "Structure Of A Viral Otu Domain Protease Bound To Ubiquitin" 98.68 75 97.33 100.00 2.99e-44 PDB 3PTF "X-Ray Structure Of The Non-Covalent Complex Between Ubch5a And Ubiquitin" 98.68 79 97.33 100.00 3.68e-44 PDB 3Q3F "Engineering Domain-Swapped Binding Interfaces By Mutually Exclusive Folding: Insertion Of Ubiquitin Into Position 103 Of Barnas" 97.37 189 97.30 100.00 3.06e-42 PDB 3RUL "New Strategy To Analyze Structures Of Glycopeptide-Target Complexes" 98.68 79 97.33 100.00 2.80e-44 PDB 3TBL "Structure Of Mono-ubiquitinated Pcna: Implications For Dna Polymerase Switching And Okazaki Fragment Maturation" 98.68 76 97.33 100.00 3.66e-44 PDB 3TMP "The Catalytic Domain Of Human Deubiquitinase Duba In Complex With Ubiquitin Aldehyde" 98.68 76 97.33 100.00 3.07e-44 PDB 3U30 "Crystal Structure Of A Linear-Specific Ubiquitin Fab Bound To Linear Ubiquitin" 98.68 172 97.33 100.00 4.28e-43 PDB 3U5C "The Structure Of The Eukaryotic Ribosome At 3.0 A Resolution. This Entry Contains Proteins Of The 40s Subunit, Ribosome A" 98.68 152 98.67 98.67 8.08e-44 PDB 3U5E "The Structure Of The Eukaryotic Ribosome At 3.0 A Resolution. This Entry Contains Proteins Of The 60s Subunit, Ribosome A" 98.68 128 98.67 98.67 4.67e-44 PDB 3U5G "The Structure Of The Eukaryotic Ribosome At 3.0 A Resolution. This Entry Contains Proteins Of The 40s Subunit, Ribosome B" 98.68 152 98.67 98.67 7.57e-44 PDB 3U5I "The Structure Of The Eukaryotic Ribosome At 3.0 A Resolution. This Entry Contains Proteins Of The 60s Subunit, Ribosome B" 98.68 128 98.67 98.67 4.67e-44 PDB 3UGB "Ubch5c~ubiquitin Conjugate" 98.68 76 97.33 100.00 3.66e-44 PDB 3VDZ "Tailoring Encodable Lanthanide-Binding Tags As Mri Contrast Agents: Xq-Dse3-Ubiquitin At 2.4 Angstroms" 98.68 111 97.33 100.00 9.38e-44 PDB 3VFK "The Structure Of Monodechloro-teicoplanin In Complex With Its Ligand, Using Ubiquitin As A Ligand Carrier" 98.68 79 97.33 100.00 2.80e-44 PDB 3VHT "Crystal Structure Of Gfp-Wrnip1 Ubz Domain Fusion Protein In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3VUW "Crystal Structure Of A20 Zf7 In Complex With Linear Ubiquitin, Form I" 98.68 76 97.33 100.00 3.66e-44 PDB 3VUX "Crystal Structure Of A20 Zf7 In Complex With Linear Ubiquitin, Form Ii" 98.68 76 97.33 100.00 3.66e-44 PDB 3VUY "Crystal Structure Of A20 Zf7 In Complex With Linear Tetraubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 3ZNH "Crimean Congo Hemorrhagic Fever Virus Otu Domain In Complex With Ubiquitin-propargyl." 98.68 76 97.33 100.00 3.07e-44 PDB 3ZNI "Structure Of Phosphotyr363-cbl-b - Ubch5b-ub - Zap-70 Peptide Complex" 98.68 81 97.33 100.00 3.53e-44 PDB 3ZNZ "Crystal Structure Of Otulin Otu Domain (c129a) In Complex With Met1-di Ubiquitin" 98.68 152 97.33 100.00 3.27e-43 PDB 4AP4 "Rnf4 - Ubch5a - Ubiquitin Heterotrimeric Complex" 98.68 80 97.33 100.00 3.21e-44 PDB 4AUQ "Structure Of Birc7-Ubch5b-Ub Complex." 98.68 81 97.33 100.00 3.53e-44 PDB 4B6A "Cryo-Em Structure Of The 60s Ribosomal Subunit In Complex With Arx1 And Rei1" 98.68 128 98.67 98.67 4.67e-44 PDB 4BBN "Nedd4 Hect-ub:ub Complex" 98.68 76 97.33 100.00 2.88e-44 PDB 4BOS "Structure Of Otud2 Otu Domain In Complex With Ubiquitin K11- Linked Peptide" 98.68 76 97.33 100.00 3.66e-44 PDB 4BOZ "Structure Of Otud2 Otu Domain In Complex With K11-linked Di Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 4BVU "Structure Of Shigella Effector Ospg In Complex With Host Ubch5c-ubiquitin Conjugate" 98.68 76 97.33 100.00 3.66e-44 PDB 4BYL "Cryo-em Reconstruction Of The 80s-eif5b-met-itrnamet Eukaryotic Translation Initiation Complex" 98.68 152 98.67 98.67 8.08e-44 PDB 4BYN "Cryo-em Reconstruction Of The 80s-eif5b-met-itrnamet Eukaryotic Translation Initiation Complex" 98.68 128 98.67 98.67 4.67e-44 PDB 4BYT "Cryo-em Reconstruction Of The 80s-eif5b-met-itrnamet Eukaryotic Translation Initiation Complex" 98.68 152 98.67 98.67 8.08e-44 PDB 4BYU "Cryo-em Reconstruction Of The 80s-eif5b-met-itrnamet Eukaryotic Translation Initiation Complex" 98.68 128 98.67 98.67 4.67e-44 PDB 4CUW "Kluyveromyces Lactis 80s Ribosome In Complex With Crpv-ires" 98.68 128 98.67 98.67 4.67e-44 PDB 4CXC "Regulation Of The Mammalian Elongation Cycle By 40s Subunit Rolling: A Eukaryotic-specific Ribosome Rearrangement" 98.68 156 97.33 100.00 5.28e-44 PDB 4CXD "Regulation Of The Mammalian Elongation Cycle By 40s Subunit Rolling: A Eukaryotic-specific Ribosome Rearrangement" 98.68 128 97.33 100.00 2.63e-44 PDB 4DDG "Crystal Structure Of Human Otub1UBCH5B~UBUB" 98.68 76 97.33 100.00 3.66e-44 PDB 4DDI "Crystal Structure Of Human Otub1UBCH5B~UBUB" 98.68 76 97.33 100.00 3.66e-44 PDB 4DHJ "The Structure Of A Ceotub1 Ubiquitin Aldehyde Ubc13~ub Complex" 98.68 76 97.33 100.00 2.88e-44 PDB 4DHZ "The Structure Of HCEOTUB1-Ubiquitin Aldehyde-Ubc13~ub" 98.68 76 97.33 100.00 2.88e-44 PDB 4FJV "Crystal Structure Of Human Otubain2 And Ubiquitin Complex" 98.68 86 97.33 100.00 6.33e-44 PDB 4HCN "Crystal Structure Of Burkholderia Pseudomallei Effector Protein Chbp In Complex With Ubiquitin" 98.68 98 98.67 98.67 4.75e-44 PDB 4HXD "Diversity Of Ubiquitin And Isg15 Specificity Amongst Nairoviruses Viral Ovarian Tumor Domain Proteases" 98.68 75 97.33 100.00 2.99e-44 PDB 4I6N "Crystal Structure Of Trichinella Spiralis Uch37 Catalytic Domain Bound To Ubiquitin Vinyl Methyl Ester" 97.37 75 97.30 100.00 2.97e-43 PDB 4IG7 "Crystal Structure Of Trichinella Spiralis Uch37 Bound To Ubiquitin Vinyl Methyl Ester" 98.68 75 97.33 100.00 2.99e-44 PDB 4II3 "Crystal Structure Of S. Pombe Ubiquitin Activating Enzyme 1 (uba1) In Complex With Ubiquitin And Atp/mg" 98.68 96 98.67 98.67 2.66e-44 PDB 4IUM "Equine Arteritis Virus Papain-like Protease 2 (plp2) Covalently Bound To Ubiquitin" 98.68 76 97.33 100.00 3.07e-44 PDB 4JIO "Bro1 V Domain And Ubiquitin" 98.68 76 97.33 98.67 1.18e-43 PDB 4JQW "Crystal Structure Of A Complex Of Nod1 Card And Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 4K1R "Crystal Structure Of Schizosaccharomyces Pombe Sst2 Catalytic Domain And Ubiquitin" 98.68 81 97.33 100.00 5.57e-44 PDB 4K7S "Crystal Structure Of Zn2-hub (human Ubiquitin) Adduct From A Solution 35 Mm Zinc Acetate/1.3 Mm Hub" 98.68 76 97.33 100.00 3.66e-44 PDB 4K7U "Crystal Structure Of Zn2.3-hub (human Ubiquitin) Adduct From A Solution 70 Mm Zinc Acetate/1.3 Mm Hub" 98.68 76 97.33 100.00 3.66e-44 PDB 4K7W "Crystal Structure Of Zn3-hub(human Ubiquitin) Adduct From A Solution 100 Mm Zinc Acetate/1.3 Mm Hub" 98.68 76 97.33 100.00 3.66e-44 PDB 4KSK "Gumby/fam105b In Complex With Ubiquitin" 98.68 80 97.33 100.00 3.21e-44 PDB 4KSL "Gumby/fam105b In Complex With Linear Di-ubiquitin" 98.68 156 97.33 100.00 3.26e-43 PDB 4KZX "Rabbit 40s Ribosomal Subunit In Complex With Eif1." 98.68 156 97.33 100.00 5.28e-44 PDB 4KZY "Rabbit 40s Ribosomal Subunit In Complex With Eif1 And Eif1a." 98.68 156 97.33 100.00 5.28e-44 PDB 4KZZ "Rabbit 40s Ribosomal Subunit In Complex With Mrna, Initiator Trna And Eif1a" 98.68 156 97.33 100.00 5.28e-44 PDB 4LCD "Structure Of An Rsp5xubxsna3 Complex: Mechanism Of Ubiquitin Ligation And Lysine Prioritization By A Hect E3" 97.37 83 97.30 100.00 1.27e-43 PDB 4LDT "The Structure Of H/ceotub1-ubiquitin Aldehyde-ubch5b~ub" 98.68 76 97.33 100.00 3.07e-44 PDB 4LJO "Structure Of An Active Ligase (hoip)/ubiquitin Transfer Complex" 98.68 76 97.33 100.00 3.66e-44 PDB 4LJP "Structure Of An Active Ligase (hoip-h889a)/ubiquitin Transfer Complex" 98.68 76 97.33 100.00 3.66e-44 PDB 4M0W "Crystal Structure Of Sars-cov Papain-like Protease C112s Mutant In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 4MDK "Cdc34-ubiquitin-cc0651 Complex" 98.68 80 97.33 100.00 3.21e-44 PDB 4MM3 "Crystal Structure Of Sars-cov Papain-like Protease Plpro In Complex With Ubiquitin Aldehyde" 98.68 76 97.33 100.00 3.07e-44 PDB 4MSM "Crystal Structure Of Schizosaccharomyces Pombe Amsh-like Protease Sst2 E286a Mutant Bound To Ubiquitin" 98.68 81 97.33 100.00 5.57e-44 PDB 4MSQ "Crystal Structure Of Schizosaccharomyces Pombe Amsh-like Protease Sst2 Catalytic Domain Bound To Ubiquitin" 98.68 81 97.33 100.00 5.57e-44 PDB 4NNJ "Crystal Structure Of Uba1 In Complex With Ubiquitin-amp And Thioesterified Ubiquitin" 98.68 79 98.67 98.67 2.14e-44 PDB 4NQK "Structure Of An Ubiquitin Complex" 98.68 79 97.33 100.00 6.00e-44 PDB 4NQL "The Crystal Structure Of The Dub Domain Of Amsh Orthologue, Sst2 From S. Pombe, In Complex With Lysine 63-linked Diubiquitin" 98.68 77 97.33 100.00 4.57e-44 PDB 4P4H "Caught-in-action Signaling Complex Of Rig-i 2card Domain And Mavs Card Domain" 98.68 79 97.33 100.00 6.00e-44 PDB 4PQT "Insights Into The Mechanism Of Deubiquitination By Jamm Deubiquitinases From Co-crystal Structures Of Enzyme With Substrate And" 98.68 81 97.33 100.00 5.57e-44 PDB 4Q5E "Shigella Effector Kinase Ospg Bound To E2-ub Ubch7-ub Conjugate" 98.68 76 97.33 98.67 7.92e-44 PDB 4Q5H "Shigella Effector Kinase Ospg Bound To Amppnp And E2-ub Ubch7-ub Conjugate" 98.68 76 97.33 98.67 7.92e-44 PDB 4RF0 "Crystal Structure Of The Middle-east Respiratory Syndrome Coronavirus Papain-like Protease In Complex With Ubiquitin (space Gro" 98.68 75 97.33 100.00 2.99e-44 PDB 4RF1 "Crystal Structure Of The Middle-east Respiratory Syndrome Coronavirus Papain-like Protease In Complex With Ubiquitin (space Gro" 98.68 75 97.33 100.00 2.99e-44 PDB 4UN2 "Crystal Structure Of The Uba Domain Of Dsk2 In Complex With Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 PDB 4UPX "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Pre-like State" 98.68 128 97.33 100.00 2.63e-44 PDB 4UQ1 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Post-like State" 98.68 128 97.33 100.00 2.63e-44 PDB 4UQ4 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Post-like State" 98.68 156 97.33 100.00 5.28e-44 PDB 4UQ5 "Mammalian 80s Hcv-ires Initiation Complex With Eif5b Pre-like State" 98.68 156 97.33 100.00 5.28e-44 PDB 4W20 "Structure Of The Mammalian 60s Ribosomal Subunit (this Entry Contains The Large Ribosomal Proteins)" 98.68 128 97.33 100.00 2.63e-44 PDB 4W22 "Structure Of The 80s Mammalian Ribosome Bound To Eef2 (this Entry Contains The Large Ribosomal Subunit Proteins)" 98.68 128 97.33 100.00 2.63e-44 PDB 4W23 "Structure Of The 80s Mammalian Ribosome Bound To Eef2 (this Entry Contains The Small Ribosomal Subunit)" 98.68 156 97.33 100.00 5.28e-44 PDB 4W25 "Structure Of The Idle Mammalian Ribosome-sec61 Complex (this Entry Contains The Large Ribosomal Subunit Proteins)" 98.68 128 97.33 100.00 2.63e-44 PDB 4W27 "Structure Of The Translating Mammalian Ribosome-sec61 Complex (this Entry Contains The Large Ribosomal Subunit Proteins)" 98.68 128 97.33 100.00 2.63e-44 PDB 4W28 "Structure Of The Translating Mammalian Ribosome-sec61 Complex (this Entry Contains The Small Ribosomal Subunit)" 98.68 156 97.33 100.00 5.28e-44 PDB 4WUR "The Crystal Structure Of The Mers-cov Papain-like Protease (c111s) With Human Ubiquitin" 98.68 76 97.33 100.00 3.66e-44 DBJ BAA03983 "polyubiquitin [Rattus norvegicus]" 98.68 305 97.33 100.00 1.67e-41 DBJ BAA11842 "ubiquitin [Cavia porcellus]" 98.68 311 97.33 100.00 1.86e-41 DBJ BAA11843 "ubiquitin extention protein [Cavia porcellus]" 98.68 156 97.33 100.00 5.28e-44 DBJ BAA23632 "polyubiquitin UbC [Homo sapiens]" 98.68 685 97.33 100.00 8.03e-40 DBJ BAA76889 "ubiquitin [Trichophyton mentagrophytes]" 98.68 153 97.33 98.67 1.07e-42 EMBL CAA07773 "polyubiquitin [Fusarium sambucinum]" 98.68 305 98.67 98.67 1.76e-41 EMBL CAA11267 "polyubiquitin [Nicotiana tabacum]" 98.68 305 98.67 98.67 1.76e-41 EMBL CAA21278 "ubiquitin [Schizosaccharomyces pombe]" 98.68 382 98.67 98.67 7.18e-41 EMBL CAA28495 "ubiquitin [Homo sapiens]" 98.68 229 97.33 100.00 2.97e-42 EMBL CAA29195 "ubiquitin [Saccharomyces cerevisiae]" 98.68 128 98.67 98.67 4.67e-44 GB AAA03351 "ubiquitin/ribosomal protein S27a fusion protein [Neurospora crassa]" 98.68 154 97.33 97.33 6.29e-43 GB AAA28997 "ubiquitin [Drosophila melanogaster]" 98.68 231 97.33 100.00 2.50e-42 GB AAA28998 "ubiquitin-hybrid protein precursor [Drosophila melanogaster]" 98.68 156 97.33 100.00 6.77e-44 GB AAA28999 "ubiquitin, partial [Drosophila melanogaster]" 98.68 76 97.33 100.00 3.66e-44 GB AAA29001 "ubiquitin, partial [Drosophila melanogaster]" 98.68 76 97.33 100.00 3.66e-44 PIR I50437 "polyubiquitin 4 - chicken [Gallus gallus]" 98.68 305 97.33 100.00 1.67e-41 PIR I51568 "polyubiquitin - African clawed frog (fragment)" 98.68 167 97.33 100.00 4.51e-43 PIR I65237 "ubiquitin / ribosomal protein L40, cytosolic [validated] - rat" 98.68 128 97.33 100.00 2.63e-44 PIR S13928 "ubiquitin precursor - chicken [Gallus gallus]" 98.68 229 97.33 100.00 2.76e-42 PIR S21083 "polyubiquitin 5 - Chinese hamster" 98.68 381 97.33 100.00 6.76e-41 PRF 1212243A "ubiquitin S1" 98.68 76 97.33 100.00 3.66e-44 PRF 1212243C "ubiquitin S3" 98.68 76 97.33 100.00 3.66e-44 PRF 1212243J "ubiquitin S7(2)" 98.68 76 97.33 100.00 3.66e-44 PRF 1604470A poly-ubiquitin 53.95 272 97.56 100.00 1.73e-18 PRF 1911411A ubiquitin 97.37 74 97.30 100.00 2.02e-43 REF NP_001005123 "ubiquitin A-52 residue ribosomal protein fusion product 1 [Xenopus (Silurana) tropicalis]" 98.68 128 97.33 100.00 2.63e-44 REF NP_001006688 "ubiquitin C [Xenopus (Silurana) tropicalis]" 98.68 609 97.33 100.00 4.83e-40 REF NP_001009117 "polyubiquitin-B [Pan troglodytes]" 98.68 229 97.33 100.00 2.97e-42 REF NP_001009286 "ubiquitin-60S ribosomal protein L40 [Ovis aries]" 98.68 128 97.33 100.00 2.63e-44 REF NP_001013290 "ubiquitin [Danio rerio]" 98.68 610 97.33 100.00 5.00e-40 SP P05759 "RecName: Full=Ubiquitin-40S ribosomal protein S31; Contains: RecName: Full=Ubiquitin; Contains: RecName: Full=40S ribosomal pro" 98.68 152 98.67 98.67 5.24e-44 SP P0C016 "RecName: Full=Ubiquitin-40S ribosomal protein S27a; Contains: RecName: Full=Ubiquitin; Contains: RecName: Full=40S ribosomal pr" 98.68 150 98.67 98.67 8.78e-44 SP P0C224 "RecName: Full=Ubiquitin-60S ribosomal protein L40; Contains: RecName: Full=Ubiquitin; Contains: RecName: Full=60S ribosomal pro" 98.68 128 97.33 97.33 3.71e-43 SP P0C273 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 98.68 128 97.33 100.00 2.63e-44 SP P0C275 "RecName: Full=Ubiquitin-60S ribosomal protein L40; AltName: Full=Ubiquitin A-52 residue ribosomal protein fusion product 1; Con" 98.68 128 97.33 100.00 2.63e-44 TPD FAA00316 "TPA: polyubiquitin [Eremothecium gossypii]" 98.68 380 98.67 98.67 6.93e-41 TPD FAA00317 "TPA: polyubiquitin [Aspergillus nidulans FGSC A4]" 98.68 304 97.33 98.67 5.73e-41 TPD FAA00318 "TPA: polyubiquitin [Saccharomyces paradoxus NRRL Y-17217]" 98.68 380 98.67 98.67 6.93e-41 TPD FAA00319 "TPA: polyubiquitin [Cryptococcus neoformans var. neoformans B-3501A]" 98.68 456 97.33 98.67 4.80e-40 TPE CBF76581 "TPA: Putative uncharacterized proteinUBI1 ; [Source:UniProtKB/TrEMBL;Acc:Q9UV58] [Aspergillus nidulans FGSC A4]" 98.68 154 97.33 98.67 5.34e-43 TPE CBF85986 "TPA: Polyubiquitin Fragment [Source:UniProtKB/TrEMBL;Acc:A2RVC1] [Aspergillus nidulans FGSC A4]" 98.68 305 97.33 98.67 5.21e-41 TPG DAA08405 "TPA: ubiquitin-ribosomal 60S subunit protein L40A fusion protein [Saccharomyces cerevisiae S288c]" 98.68 128 98.67 98.67 4.67e-44 TPG DAA09244 "TPA: ubiquitin-ribosomal 60S subunit protein L40B fusion protein [Saccharomyces cerevisiae S288c]" 98.68 128 98.67 98.67 4.67e-44 TPG DAA09283 "TPA: ubiquitin [Saccharomyces cerevisiae S288c]" 98.68 381 98.67 98.67 7.36e-41 TPG DAA09489 "TPA: ubiquitin-ribosomal 40S subunit protein S31 fusion protein [Saccharomyces cerevisiae S288c]" 98.68 152 98.67 98.67 5.24e-44 TPG DAA18802 "TPA: polyubiquitin [Bos taurus]" 98.68 305 97.33 100.00 1.78e-41 stop_ save_ save_Ubiquitin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Ubiquitin _Abbreviation_common Ubiquitin _Molecular_mass . _Mol_thiol_state 'not present' _Details . _Residue_count 76 _Mol_residue_sequence ; MQIFVKTLTGKTITLEVEPS DTIDNVKSKIQDKEGIPPDQ QRLIFAGKQLEDGRTLSDYN IQKESTLHLVLRLRGX ; 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 ASP 25 ASN 26 VAL 27 LYS 28 SER 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 GLZ stop_ _Sequence_homology_query_date 2008-03-24 _Sequence_homology_query_revised_last_date 2008-03-03 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 TPD FAA00318.1 'TPA: polyubiquitin [Saccharomycesparadoxus NRRL Y-17217]' 20.00 380 99 99 4e-34 TPD FAA00316.1 'TPA: polyubiquitin [Eremotheciumgossypii]' 20.00 380 99 99 4e-34 TPD FAA00316.1 'TPA: polyubiquitin [Eremotheciumgossypii]' 20.00 380 99 99 4e-34 TPD FAA00316.1 'TPA: polyubiquitin [Eremotheciumgossypii]' 20.00 380 99 99 4e-34 TPD FAA00316.1 'TPA: polyubiquitin [Eremotheciumgossypii]' 20.00 380 99 99 4e-34 REF XP_001643983.1 'hypothetical protein Kpol_1070p6[Vanderwaltozyma polyspora DSM 70294]' 14.26 533 99 99 4e-34 REF XP_001643983.1 'hypothetical protein Kpol_1070p6[Vanderwaltozyma polyspora DSM 70294]' 14.26 533 99 99 4e-34 REF XP_001643983.1 'hypothetical protein Kpol_1070p6[Vanderwaltozyma polyspora DSM 70294]' 14.26 533 99 99 4e-34 REF XP_001643983.1 'hypothetical protein Kpol_1070p6[Vanderwaltozyma polyspora DSM 70294]' 14.26 533 99 99 4e-34 REF XP_001645736.1 'hypothetical proteinKpol_1043p69 [Vanderwaltozyma polyspora DSM 70294]' 59.38 128 99 99 4e-34 GenBank AAD44041.1 'AF104024_1 polyprotein [Bovine viraldiarrhea virus genotype 2]' 20.82 365 98 98 5e-16 GenBank AAA36787.1 'ubiquitin precursor' 28.25 269 100 100 10e-15 GenBank ABC94632.1 'ubiquitin C [Ictalurus punctatus]' 39.58 192 100 100 1e-13 GenBank EDM13556.1 'rCG21222, isoform CRA_b [Rattusnorvegicus]' 42.46 179 98 100 2e-16 GenBank EDO17878.1 'hypothetical protein Kpol_1043p69[Vanderwaltozyma polyspora DSM 70294]' 59.38 128 99 99 4e-34 EMBL CAK44245.1 'unnamed protein product [Aspergillusniger]' 49.35 154 99 99 4e-34 EMBL CAB90826.1 'ubiquitin [Cyanidium caldarium]' 49.67 153 99 100 10e-35 EMBL CAB90826.1 'ubiquitin [Cyanidium caldarium]' 49.67 153 99 100 10e-35 EMBL CAI77901.1 'polyubiquitine protein [Collozouminerme]' 67.86 112 99 100 10e-35 stop_ save_ ###################### # Polymer residues # ###################### save_chem_comp_GLZ _Saveframe_category polymer_residue _Mol_type 'L-PEPTIDE LINKING' _Name_common AMINO-ACETALDEHYDE _BMRB_code . _PDB_code GLZ _Standard_residue_derivative . _Molecular_mass 59.067 _Mol_paramagnetic . _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Thu Jul 21 11:38:08 2011 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons N N N . 0 . ? CA CA C . 0 . ? C C C . 0 . ? O O O . 0 . ? H H H . 0 . ? H2 H2 H . 0 . ? HA1 HA1 H . 0 . ? HA2 HA2 H . 0 . ? HXT HXT H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name SING N CA ? ? SING N H ? ? SING N H2 ? ? SING CA C ? ? SING CA HA1 ? ? SING CA HA2 ? ? DOUB C O ? ? SING C HXT ? ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $yuh1_monomer 'Baker's yeast' 4932 Eukaryota Fungi Saccharomyces cerevisiae $Ubiquitin 'Baker's yeast' 4932 Eukaryota Fungi Saccharomyces cerevisiae 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 $yuh1_monomer 'recombinant technology' . . . . . $Ubiquitin 'recombinant technology' . . . . . 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 $yuh1_monomer 2 mM '[U-95% 2H; U-13C; U-15N]' $Ubiquitin 2 mM '[U-95% 2H; U-13C; U-15N]' stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N HSQC' _Sample_label $sample_1 save_ save_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label $sample_1 save_ save_HN(CA)CO_3 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CA)CO _Sample_label $sample_1 save_ save_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label $sample_1 save_ save_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CO)CA _Sample_label $sample_1 save_ save_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label $sample_1 save_ save_HN(COCA)CB_7 _Saveframe_category NMR_applied_experiment _Experiment_name HN(COCA)CB _Sample_label $sample_1 save_ save_CCNNH_8 _Saveframe_category NMR_applied_experiment _Experiment_name CCNNH _Sample_label $sample_1 save_ save_CC(CO)NNH_9 _Saveframe_category NMR_applied_experiment _Experiment_name CC(CO)NNH _Sample_label $sample_1 save_ save_NMR_applied_experiment _Saveframe_category NMR_applied_experiment _Experiment_name NMR_applied_experiment _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N HSQC' _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CA)CO _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_5 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CO)CA _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_6 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_7 _Saveframe_category NMR_applied_experiment _Experiment_name HN(COCA)CB _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_8 _Saveframe_category NMR_applied_experiment _Experiment_name CCNNH _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ save_NMR_spec_expt__0_9 _Saveframe_category NMR_applied_experiment _Experiment_name CC(CO)NNH _BMRB_pulse_sequence_accession_number . _Details ; The CCNNH and CC(CO)NNH experiments were modified to start the magnetisation transfer from the side-shain 13C nuclei. ; save_ ####################### # Sample conditions # ####################### save_Cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.0 0.2 n/a temperature 303 1 K 'ionic strength' 0.10 . M stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $entry_citation $entry_citation DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $entry_citation $entry_citation 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_yuh1_complex_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '1H-15N HSQC' HNCO HN(CA)CO HNCA HN(CO)CA HNCACB HN(COCA)CB CCNNH CC(CO)NNH stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'YUH1 monomer' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 3 GLY C C 174.02 . 1 2 . 3 GLY CA C 44.88 . 1 3 . 4 GLU N N 122.22 . 1 4 . 4 GLU H H 8.59 . 1 5 . 4 GLU C C 176.22 . 1 6 . 4 GLU CA C 56.73 . 1 7 . 4 GLU CB C 29.79 . 1 8 . 4 GLU CG C 35.25 . 1 9 . 5 ASN N N 120.71 . 1 10 . 5 ASN H H 8.46 . 1 11 . 5 ASN C C 174.68 . 1 12 . 5 ASN CA C 52.88 . 1 13 . 5 ASN CB C 37.84 . 1 14 . 6 ARG N N 122.75 . 1 15 . 6 ARG H H 8.18 . 1 16 . 6 ARG C C 174.35 . 1 17 . 6 ARG CA C 54.90 . 1 18 . 6 ARG CB C 29.99 . 1 19 . 6 ARG CG C 21.11 . 1 20 . 6 ARG CD C 42.32 . 1 21 . 7 ALA N N 125.46 . 1 22 . 7 ALA H H 7.79 . 1 23 . 7 ALA C C 175.83 . 1 24 . 7 ALA CA C 51.01 . 1 25 . 7 ALA CB C 21.34 . 1 26 . 8 VAL N N 115.35 . 1 27 . 8 VAL H H 7.47 . 1 28 . 8 VAL C C 172.94 . 1 29 . 8 VAL CA C 57.82 . 1 30 . 8 VAL CB C 33.61 . 1 31 . 9 VAL N N 122.98 . 1 32 . 9 VAL H H 7.43 . 1 33 . 9 VAL CA C 60.21 . 1 34 . 9 VAL CB C 32.31 . 1 35 . 9 VAL CG1 C 21.11 . 1 36 . 9 VAL CG2 C 21.11 . 1 37 . 10 PRO C C 176.03 . 1 38 . 10 PRO CA C 62.37 . 1 39 . 10 PRO CB C 31.75 . 1 40 . 10 PRO CG C 26.34 . 1 41 . 10 PRO CD C 49.41 . 1 42 . 11 ILE N N 124.09 . 1 43 . 11 ILE H H 7.61 . 1 44 . 11 ILE C C 177.27 . 1 45 . 11 ILE CA C 61.60 . 1 46 . 11 ILE CB C 39.76 . 1 47 . 11 ILE CG1 C 28.16 . 1 48 . 12 GLU N N 134.24 . 1 49 . 12 GLU H H 9.46 . 1 50 . 12 GLU C C 176.18 . 1 51 . 12 GLU CA C 56.07 . 1 52 . 12 GLU CB C 32.01 . 1 53 . 12 GLU CG C 38.80 . 1 54 . 13 SER N N 124.30 . 1 55 . 13 SER H H 9.33 . 1 56 . 13 SER C C 173.78 . 1 57 . 13 SER CA C 56.76 . 1 58 . 13 SER CB C 62.26 . 1 59 . 14 ASN N N 125.47 . 1 60 . 14 ASN H H 8.47 . 1 61 . 14 ASN CA C 48.16 . 1 62 . 14 ASN CB C 40.31 . 1 63 . 15 PRO C C 178.08 . 1 64 . 15 PRO CA C 65.16 . 1 65 . 15 PRO CB C 31.43 . 1 66 . 15 PRO CG C 26.10 . 1 67 . 15 PRO CD C 50.36 . 1 68 . 16 GLU N N 122.27 . 1 69 . 16 GLU H H 8.15 . 1 70 . 16 GLU C C 178.31 . 1 71 . 16 GLU CA C 59.31 . 1 72 . 16 GLU CB C 29.19 . 1 73 . 16 GLU CG C 35.61 . 1 74 . 17 VAL N N 122.12 . 1 75 . 17 VAL H H 6.83 . 1 76 . 17 VAL C C 178.24 . 1 77 . 17 VAL CA C 65.15 . 1 78 . 17 VAL CB C 32.48 . 1 79 . 17 VAL CG1 C 19.67 . 1 80 . 17 VAL CG2 C 19.67 . 1 81 . 18 PHE N N 120.25 . 1 82 . 18 PHE H H 8.10 . 1 83 . 18 PHE C C 177.76 . 1 84 . 18 PHE CA C 61.51 . 1 85 . 18 PHE CB C 38.05 . 1 86 . 19 THR N N 116.28 . 1 87 . 19 THR H H 8.36 . 1 88 . 19 THR C C 174.66 . 1 89 . 19 THR CB C 68.05 . 1 90 . 19 THR CG2 C 21.94 . 1 91 . 20 ASN N N 122.74 . 1 92 . 20 ASN H H 8.03 . 1 93 . 20 ASN C C 178.21 . 1 94 . 20 ASN CA C 55.96 . 1 95 . 20 ASN CB C 37.31 . 1 96 . 21 PHE N N 119.91 . 1 97 . 21 PHE H H 7.90 . 1 98 . 21 PHE C C 178.10 . 1 99 . 21 PHE CA C 59.76 . 1 100 . 21 PHE CB C 39.3 . 1 101 . 22 ALA N N 119.56 . 1 102 . 22 ALA H H 8.50 . 1 103 . 22 ALA C C 180.54 . 1 104 . 22 ALA CA C 54.88 . 1 105 . 22 ALA CB C 19.37 . 1 106 . 23 HIS N N 119.03 . 1 107 . 23 HIS H H 9.15 . 1 108 . 23 HIS C C 178.11 . 1 109 . 23 HIS CA C 57.08 . 1 110 . 23 HIS CB C 28.08 . 1 111 . 24 LYS N N 122.54 . 1 112 . 24 LYS H H 7.86 . 1 113 . 24 LYS C C 179.08 . 1 114 . 24 LYS CA C 58.15 . 1 115 . 24 LYS CB C 30.91 . 1 116 . 24 LYS CG C 23.00 . 1 117 . 24 LYS CD C 30.48 . 1 118 . 25 LEU N N 119.80 . 1 119 . 25 LEU H H 7.59 . 1 120 . 25 LEU C C 175.78 . 1 121 . 25 LEU CA C 56.13 . 1 122 . 25 LEU CB C 43.05 . 1 123 . 25 LEU CG C 24.84 . 1 124 . 25 LEU CD1 C 21.40 . 1 125 . 25 LEU CD2 C 21.40 . 1 126 . 26 GLY N N 103.25 . 1 127 . 26 GLY H H 7.33 . 1 128 . 26 GLY C C 173.88 . 1 129 . 26 GLY CA C 44.24 . 1 130 . 27 LEU N N 124.46 . 1 131 . 27 LEU H H 8.33 . 1 132 . 27 LEU C C 176.50 . 1 133 . 27 LEU CA C 55.55 . 1 134 . 27 LEU CB C 41.23 . 1 135 . 27 LEU CG C 25.33 . 1 136 . 28 LYS N N 129.54 . 1 137 . 28 LYS H H 8.83 . 1 138 . 28 LYS C C 177.37 . 1 139 . 28 LYS CA C 57.71 . 1 140 . 28 LYS CB C 33.84 . 1 141 . 28 LYS CG C 25.56 . 1 142 . 28 LYS CD C 28.73 . 1 143 . 28 LYS CE C 41.11 . 1 144 . 29 ASN N N 120.16 . 1 145 . 29 ASN H H 8.79 . 1 146 . 29 ASN C C 175.38 . 1 147 . 29 ASN CA C 55.67 . 1 148 . 29 ASN CB C 38.62 . 1 149 . 30 GLU N N 116.24 . 1 150 . 30 GLU H H 8.71 . 1 151 . 30 GLU C C 174.16 . 1 152 . 30 GLU CA C 57.67 . 1 153 . 30 GLU CB C 27.69 . 1 154 . 30 GLU CG C 36.08 . 1 155 . 31 TRP N N 124.91 . 1 156 . 31 TRP H H 8.14 . 1 157 . 31 TRP C C 173.43 . 1 158 . 31 TRP CA C 56.52 . 1 159 . 31 TRP CB C 32.54 . 1 160 . 32 ALA N N 122.88 . 1 161 . 32 ALA H H 9.58 . 1 162 . 32 ALA C C 175.07 . 1 163 . 32 ALA CA C 51.47 . 1 164 . 32 ALA CB C 22.3 . 1 165 . 33 TYR N N 117.57 . 1 166 . 33 TYR H H 8.16 . 1 167 . 33 TYR C C 175.34 . 1 168 . 33 TYR CA C 56.53 . 1 169 . 33 TYR CB C 40.47 . 1 170 . 34 PHE N N 115.62 . 1 171 . 34 PHE H H 8.48 . 1 172 . 34 PHE C C 175.09 . 1 173 . 34 PHE CA C 55.45 . 1 174 . 34 PHE CB C 41.58 . 1 175 . 35 ASP N N 121.49 . 1 176 . 35 ASP H H 9.00 . 1 177 . 35 ASP C C 175.13 . 1 178 . 35 ASP CA C 56.40 . 1 179 . 35 ASP CB C 43.32 . 1 180 . 36 ILE N N 120.40 . 1 181 . 36 ILE H H 7.80 . 1 182 . 36 ILE C C 174.48 . 1 183 . 36 ILE CA C 60.74 . 1 184 . 36 ILE CB C 38.44 . 1 185 . 36 ILE CG2 C 15.99 . 2 186 . 36 ILE CD1 C 12.64 . 2 187 . 37 TYR N N 124.23 . 1 188 . 37 TYR H H 7.36 . 1 189 . 37 TYR C C 174.56 . 1 190 . 37 TYR CA C 56.08 . 1 191 . 37 TYR CB C 38.54 . 1 192 . 38 SER N N 112.98 . 1 193 . 38 SER H H 7.16 . 1 194 . 38 SER C C 173.45 . 1 195 . 38 SER CA C 57.39 . 1 196 . 38 SER CB C 64.95 . 1 197 . 39 LEU N N 124.35 . 1 198 . 39 LEU H H 8.97 . 1 199 . 39 LEU C C 176.79 . 1 200 . 39 LEU CA C 54.30 . 1 201 . 39 LEU CB C 42.65 . 1 202 . 39 LEU CG C 25.55 . 1 203 . 39 LEU CD1 C 22.19 . 2 204 . 39 LEU CD2 C 23.98 . 2 205 . 40 THR N N 106.73 . 1 206 . 40 THR H H 7.91 . 1 207 . 40 THR C C 174.94 . 1 208 . 40 THR CA C 61.28 . 1 209 . 40 THR CB C 70.08 . 1 210 . 40 THR CG2 C 20.68 . 1 211 . 41 GLU N N 124.82 . 1 212 . 41 GLU H H 7.45 . 1 213 . 41 GLU CA C 53.73 . 1 214 . 41 GLU CB C 29.25 . 1 215 . 41 GLU CG C 35.42 . 1 216 . 42 PRO C C 179.01 . 1 217 . 42 PRO CA C 65.26 . 1 218 . 42 PRO CB C 31.71 . 1 219 . 43 GLU N N 119.02 . 1 220 . 43 GLU H H 9.38 . 1 221 . 43 GLU C C 177.48 . 1 222 . 43 GLU CA C 58.48 . 1 223 . 43 GLU CB C 28.36 . 1 224 . 43 GLU CG C 35.43 . 1 225 . 44 LEU N N 117.62 . 1 226 . 44 LEU H H 7.16 . 1 227 . 44 LEU C C 179.81 . 1 228 . 44 LEU CA C 54.92 . 1 229 . 44 LEU CB C 40.45 . 1 230 . 44 LEU CD1 C 21.17 . 2 231 . 44 LEU CD2 C 24.48 . 2 232 . 45 LEU N N 122.42 . 1 233 . 45 LEU H H 7.86 . 1 234 . 45 LEU C C 178.92 . 1 235 . 45 LEU CA C 56.52 . 1 236 . 45 LEU CB C 40.63 . 1 237 . 45 LEU CG C 25.83 . 1 238 . 46 ALA N N 120.62 . 1 239 . 46 ALA H H 7.12 . 1 240 . 46 ALA C C 177.88 . 1 241 . 46 ALA CA C 53.42 . 1 242 . 46 ALA CB C 17.85 . 1 243 . 47 PHE N N 114.91 . 1 244 . 47 PHE H H 6.97 . 1 245 . 47 PHE C C 175.35 . 1 246 . 47 PHE CA C 56.86 . 1 247 . 47 PHE CB C 39.04 . 1 248 . 48 LEU N N 123.13 . 1 249 . 48 LEU H H 7.35 . 1 250 . 48 LEU CA C 51.80 . 1 251 . 48 LEU CB C 40.82 . 1 252 . 48 LEU CG C 24.85 . 1 253 . 48 LEU CD1 C 22.71 . 1 254 . 48 LEU CD2 C 22.71 . 1 255 . 49 PRO C C 173.44 . 1 256 . 49 PRO CA C 62.02 . 1 257 . 49 PRO CB C 31.82 . 1 258 . 49 PRO CG C 26.54 . 1 259 . 50 ARG N N 117.02 . 1 260 . 50 ARG H H 6.99 . 1 261 . 50 ARG CA C 50.28 . 1 262 . 50 ARG CB C 29.17 . 1 263 . 50 ARG CG C 25.11 . 1 264 . 50 ARG CD C 40.26 . 1 265 . 51 PRO C C 174.59 . 1 266 . 51 PRO CA C 61.10 . 1 267 . 51 PRO CB C 34.45 . 1 268 . 51 PRO CD C 49.69 . 1 269 . 52 VAL N N 122.12 . 1 270 . 52 VAL H H 9.69 . 1 271 . 52 VAL C C 177.71 . 1 272 . 52 VAL CA C 61.77 . 1 273 . 52 VAL CB C 31.12 . 1 274 . 52 VAL CG1 C 21.98 . 1 275 . 52 VAL CG2 C 21.98 . 1 276 . 53 LYS N N 127.25 . 1 277 . 53 LYS H H 8.98 . 1 278 . 53 LYS C C 177.14 . 1 279 . 53 LYS CA C 54.59 . 1 280 . 53 LYS CB C 31.84 . 1 281 . 53 LYS CG C 23.27 . 1 282 . 53 LYS CD C 26.13 . 1 283 . 53 LYS CE C 40.85 . 1 284 . 54 ALA N N 120.47 . 1 285 . 54 ALA H H 7.73 . 1 286 . 54 ALA C C 175.09 . 1 287 . 54 ALA CA C 52.01 . 1 288 . 54 ALA CB C 21 . 1 289 . 55 ILE N N 121.45 . 1 290 . 55 ILE H H 8.34 . 1 291 . 55 ILE C C 173.49 . 1 292 . 55 ILE CA C 59.79 . 1 293 . 55 ILE CB C 38.29 . 1 294 . 55 ILE CG1 C 25.75 . 1 295 . 55 ILE CG2 C 16.2 . 2 296 . 56 VAL N N 129.79 . 1 297 . 56 VAL H H 9.56 . 1 298 . 56 VAL C C 173.52 . 1 299 . 56 VAL CA C 60.31 . 1 300 . 56 VAL CB C 33.05 . 1 301 . 57 LEU N N 131.78 . 1 302 . 57 LEU H H 9.24 . 1 303 . 57 LEU C C 173.33 . 1 304 . 57 LEU CA C 52.97 . 1 305 . 57 LEU CB C 45.65 . 1 306 . 58 LEU N N 132.04 . 1 307 . 58 LEU H H 9.40 . 1 308 . 58 LEU C C 174.52 . 1 309 . 58 LEU CA C 52.75 . 1 310 . 58 LEU CB C 41.8 . 1 311 . 58 LEU CG C 25.84 . 1 312 . 58 LEU CD1 C 24.18 . 1 313 . 58 LEU CD2 C 24.18 . 1 314 . 59 PHE N N 124.80 . 1 315 . 59 PHE H H 8.69 . 1 316 . 59 PHE CA C 53.08 . 1 317 . 59 PHE CB C 39.72 . 1 318 . 60 PRO C C 176.37 . 1 319 . 60 PRO CA C 60.26 . 1 320 . 60 PRO CB C 29.84 . 1 321 . 61 ILE N N 127.19 . 1 322 . 61 ILE H H 8.40 . 1 323 . 61 ILE C C 176.13 . 1 324 . 61 ILE CA C 61.81 . 1 325 . 61 ILE CB C 38.2 . 1 326 . 61 ILE CG1 C 27.1 . 1 327 . 61 ILE CG2 C 16.30 . 2 328 . 62 ASN N N 126.57 . 1 329 . 62 ASN H H 8.57 . 1 330 . 62 ASN C C 175.66 . 1 331 . 62 ASN CA C 51.99 . 1 332 . 62 ASN CB C 38.87 . 1 333 . 63 GLU N N 124.58 . 1 334 . 63 GLU H H 8.72 . 1 335 . 63 GLU C C 176.28 . 1 336 . 63 GLU CA C 56.77 . 1 337 . 63 GLU CB C 29.38 . 1 338 . 63 GLU CG C 34.88 . 1 339 . 64 ASP N N 121.16 . 1 340 . 64 ASP H H 8.31 . 1 341 . 64 ASP C C 176.29 . 1 342 . 64 ASP CA C 54.35 . 1 343 . 64 ASP CB C 40.73 . 1 344 . 65 ARG N N 122.55 . 1 345 . 65 ARG H H 7.84 . 1 346 . 65 ARG C C 176.02 . 1 347 . 65 ARG CA C 55.22 . 1 348 . 65 ARG CB C 29.64 . 1 349 . 65 ARG CG C 25.92 . 1 350 . 65 ARG CD C 42.47 . 1 351 . 66 LYS N N 124.40 . 1 352 . 66 LYS H H 8.24 . 1 353 . 66 LYS C C 176.77 . 1 354 . 66 LYS CA C 55.86 . 1 355 . 66 LYS CB C 32.47 . 1 356 . 66 LYS CG C 23.35 . 1 357 . 66 LYS CD C 27.87 . 1 358 . 66 LYS CE C 41.30 . 1 359 . 67 SER N N 118.87 . 1 360 . 67 SER H H 8.36 . 1 361 . 67 SER C C 174.53 . 1 362 . 67 SER CA C 57.82 . 1 363 . 67 SER CB C 63.64 . 1 364 . 68 SER N N 119.75 . 1 365 . 68 SER H H 8.40 . 1 366 . 68 SER C C 174.62 . 1 367 . 68 SER CA C 57.80 . 1 368 . 68 SER CB C 63.69 . 1 369 . 69 THR N N 117.59 . 1 370 . 69 THR H H 8.21 . 1 371 . 69 THR C C 174.43 . 1 372 . 69 THR CA C 61.17 . 1 373 . 69 THR CB C 69.57 . 1 374 . 69 THR CG2 C 20.44 . 1 375 . 70 SER N N 119.83 . 1 376 . 70 SER H H 8.31 . 1 377 . 70 SER C C 174.27 . 1 378 . 70 SER CA C 57.83 . 1 379 . 70 SER CB C 63.62 . 1 380 . 71 GLN N N 123.93 . 1 381 . 71 GLN H H 8.37 . 1 382 . 71 GLN C C 175.51 . 1 383 . 71 GLN CA C 55.23 . 1 384 . 71 GLN CB C 29.11 . 1 385 . 71 GLN CG C 32.93 . 1 386 . 72 GLN N N 123.65 . 1 387 . 72 GLN H H 8.36 . 1 388 . 72 GLN C C 175.57 . 1 389 . 72 GLN CA C 55.24 . 1 390 . 72 GLN CB C 28.81 . 1 391 . 72 GLN CG C 32.86 . 1 392 . 73 ILE N N 124.19 . 1 393 . 73 ILE H H 8.24 . 1 394 . 73 ILE C C 176.39 . 1 395 . 73 ILE CA C 60.53 . 1 396 . 73 ILE CB C 38.12 . 1 397 . 73 ILE CG1 C 26.06 . 1 398 . 73 ILE CG2 C 16.30 . 2 399 . 73 ILE CD1 C 11.88 . 2 400 . 74 THR N N 120.00 . 1 401 . 74 THR H H 8.24 . 1 402 . 74 THR C C 174.31 . 1 403 . 74 THR CA C 61.20 . 1 404 . 74 THR CB C 69.35 . 1 405 . 74 THR CG2 C 20.39 . 1 406 . 75 SER N N 119.86 . 1 407 . 75 SER H H 8.09 . 1 408 . 75 SER C C 173.91 . 1 409 . 75 SER CA C 57.62 . 1 410 . 75 SER CB C 63.79 . 1 411 . 76 SER N N 118.08 . 1 412 . 76 SER H H 7.98 . 1 413 . 76 SER C C 173.79 . 1 414 . 76 SER CA C 57.60 . 1 415 . 76 SER CB C 63.3 . 1 416 . 77 TYR N N 122.83 . 1 417 . 77 TYR H H 7.94 . 1 418 . 77 TYR C C 175.62 . 1 419 . 77 TYR CA C 56.70 . 1 420 . 77 TYR CB C 39.52 . 1 421 . 78 ASP N N 123.64 . 1 422 . 78 ASP H H 8.62 . 1 423 . 78 ASP C C 174.05 . 1 424 . 78 ASP CA C 53.75 . 1 425 . 78 ASP CB C 39.93 . 1 426 . 79 VAL N N 119.88 . 1 427 . 79 VAL H H 6.92 . 1 428 . 79 VAL C C 172.95 . 1 429 . 79 VAL CA C 59.86 . 1 430 . 79 VAL CB C 33.01 . 1 431 . 79 VAL CG1 C 19.58 . 1 432 . 79 VAL CG2 C 19.58 . 1 433 . 80 ILE N N 129.13 . 1 434 . 80 ILE H H 9.02 . 1 435 . 80 ILE C C 174.49 . 1 436 . 80 ILE CA C 62.04 . 1 437 . 80 ILE CB C 37.72 . 1 438 . 80 ILE CG1 C 27.70 . 1 439 . 80 ILE CG2 C 17.86 . 2 440 . 81 TRP N N 129.54 . 1 441 . 81 TRP H H 8.01 . 1 442 . 81 TRP C C 172.60 . 1 443 . 81 TRP CA C 54.80 . 1 444 . 81 TRP CB C 33.49 . 1 445 . 82 PHE N N 130.83 . 1 446 . 82 PHE H H 11.09 . 1 447 . 82 PHE C C 172.15 . 1 448 . 82 PHE CA C 55.13 . 1 449 . 82 PHE CB C 41.52 . 1 450 . 83 LYS N N 118.73 . 1 451 . 83 LYS H H 6.46 . 1 452 . 83 LYS C C 176.48 . 1 453 . 83 LYS CA C 54.79 . 1 454 . 83 LYS CB C 32.95 . 1 455 . 83 LYS CG C 23.54 . 1 456 . 83 LYS CD C 28.39 . 1 457 . 84 GLN N N 127.03 . 1 458 . 84 GLN H H 7.96 . 1 459 . 84 GLN C C 175.47 . 1 460 . 84 GLN CA C 54.70 . 1 461 . 84 GLN CB C 26.6 . 1 462 . 84 GLN CG C 32.83 . 1 463 . 85 SER N N 124.61 . 1 464 . 85 SER H H 7.62 . 1 465 . 85 SER C C 173.17 . 1 466 . 85 SER CA C 57.39 . 1 467 . 85 SER CB C 64.21 . 1 468 . 86 VAL N N 122.37 . 1 469 . 86 VAL H H 6.83 . 1 470 . 86 VAL C C 175.00 . 1 471 . 86 VAL CA C 61.26 . 1 472 . 86 VAL CB C 33.73 . 1 473 . 86 VAL CG1 C 19.88 . 1 474 . 86 VAL CG2 C 19.88 . 1 475 . 87 LYS N N 132.23 . 1 476 . 87 LYS H H 8.28 . 1 477 . 87 LYS CA C 57.62 . 1 478 . 87 LYS CB C 31.15 . 1 479 . 88 ASN C C 175.67 . 1 480 . 89 ALA N N 118.62 . 1 481 . 89 ALA H H 7.40 . 1 482 . 89 ALA C C 177.78 . 1 483 . 89 ALA CA C 51.23 . 1 484 . 89 ALA CB C 18.34 . 1 485 . 90 CYS N N 123.19 . 1 486 . 90 CYS H H 8.96 . 1 487 . 90 CYS C C 178.12 . 1 488 . 90 CYS CA C 59.12 . 1 489 . 90 CYS CB C 30.33 . 1 490 . 91 GLY N N 117.26 . 1 491 . 91 GLY H H 10.21 . 1 492 . 91 GLY C C 173.47 . 1 493 . 91 GLY CA C 47.47 . 1 494 . 92 LEU N N 123.32 . 1 495 . 92 LEU H H 6.80 . 1 496 . 92 LEU C C 178.51 . 1 497 . 92 LEU CA C 56.13 . 1 498 . 92 LEU CB C 40.32 . 1 499 . 92 LEU CG C 25.04 . 1 500 . 92 LEU CD1 C 20.71 . 1 501 . 92 LEU CD2 C 20.71 . 1 502 . 93 TYR N N 117.79 . 1 503 . 93 TYR H H 7.53 . 1 504 . 93 TYR C C 176.58 . 1 505 . 93 TYR CA C 62.15 . 1 506 . 93 TYR CB C 37.18 . 1 507 . 94 ALA N N 123.67 . 1 508 . 94 ALA H H 7.83 . 1 509 . 94 ALA C C 181.25 . 1 510 . 94 ALA CA C 54.06 . 1 511 . 94 ALA CB C 17.09 . 1 512 . 95 ILE N N 125.22 . 1 513 . 95 ILE H H 7.38 . 1 514 . 95 ILE C C 178.32 . 1 515 . 95 ILE CA C 65.28 . 1 516 . 95 ILE CB C 37.16 . 1 517 . 95 ILE CG2 C 16.28 . 2 518 . 96 LEU N N 121.61 . 1 519 . 96 LEU H H 8.34 . 1 520 . 96 LEU C C 181.30 . 1 521 . 96 LEU CA C 58.05 . 1 522 . 96 LEU CB C 38.71 . 1 523 . 96 LEU CG C 22.75 . 1 524 . 97 HIS N N 122.48 . 1 525 . 97 HIS H H 9.12 . 1 526 . 97 HIS C C 177.47 . 1 527 . 97 HIS CA C 60.85 . 1 528 . 97 HIS CB C 29.02 . 1 529 . 98 SER N N 116.07 . 1 530 . 98 SER H H 8.20 . 1 531 . 98 SER C C 173.69 . 1 532 . 98 SER CA C 61.39 . 1 533 . 98 SER CB C 63.21 . 1 534 . 99 LEU N N 120.94 . 1 535 . 99 LEU H H 8.06 . 1 536 . 99 LEU C C 179.07 . 1 537 . 99 LEU CA C 56.67 . 1 538 . 99 LEU CB C 41.45 . 1 539 . 99 LEU CG C 26.32 . 1 540 . 99 LEU CD1 C 23.83 . 1 541 . 99 LEU CD2 C 23.83 . 1 542 . 100 SER N N 114.39 . 1 543 . 100 SER H H 8.46 . 1 544 . 100 SER C C 172.69 . 1 545 . 100 SER CA C 61.71 . 1 546 . 100 SER CB C 63.04 . 1 547 . 101 ASN N N 113.72 . 1 548 . 101 ASN H H 6.27 . 1 549 . 101 ASN C C 172.22 . 1 550 . 101 ASN CA C 53.29 . 1 551 . 101 ASN CB C 39.85 . 1 552 . 102 ASN N N 124.40 . 1 553 . 102 ASN H H 7.45 . 1 554 . 102 ASN C C 174.58 . 1 555 . 102 ASN CA C 52.98 . 1 556 . 102 ASN CB C 39.91 . 1 557 . 103 GLN N N 120.23 . 1 558 . 103 GLN H H 8.64 . 1 559 . 103 GLN C C 178.25 . 1 560 . 103 GLN CA C 59.74 . 1 561 . 103 GLN CB C 27.31 . 1 562 . 103 GLN CG C 34.09 . 1 563 . 104 SER N N 115.94 . 1 564 . 104 SER H H 8.50 . 1 565 . 104 SER C C 174.72 . 1 566 . 104 SER CA C 60.20 . 1 567 . 104 SER CB C 62.39 . 1 568 . 105 LEU N N 121.16 . 1 569 . 105 LEU H H 8.06 . 1 570 . 105 LEU C C 175.17 . 1 571 . 105 LEU CA C 53.72 . 1 572 . 105 LEU CB C 39.44 . 1 573 . 105 LEU CG C 24.55 . 1 574 . 105 LEU CD1 C 18.87 . 2 575 . 105 LEU CD2 C 22.43 . 2 576 . 106 LEU N N 118.33 . 1 577 . 106 LEU H H 7.27 . 1 578 . 106 LEU C C 177.38 . 1 579 . 106 LEU CA C 52.02 . 1 580 . 106 LEU CB C 42.07 . 1 581 . 106 LEU CG C 25.26 . 1 582 . 106 LEU CD1 C 21.50 . 2 583 . 106 LEU CD2 C 24.06 . 2 584 . 107 GLU N N 125.15 . 1 585 . 107 GLU H H 9.34 . 1 586 . 107 GLU CA C 52.97 . 1 587 . 107 GLU CB C 29.21 . 1 588 . 107 GLU CG C 33.92 . 1 589 . 108 PRO C C 178.76 . 1 590 . 108 PRO CA C 62.67 . 1 591 . 108 PRO CB C 30.98 . 1 592 . 108 PRO CG C 26.63 . 1 593 . 108 PRO CD C 50.94 . 1 594 . 109 GLY N N 116.16 . 1 595 . 109 GLY H H 9.98 . 1 596 . 109 GLY C C 174.29 . 1 597 . 109 GLY CA C 44.77 . 1 598 . 110 SER N N 115.03 . 1 599 . 110 SER H H 7.73 . 1 600 . 110 SER C C 174.55 . 1 601 . 110 SER CA C 57.38 . 1 602 . 110 SER CB C 65.63 . 1 603 . 111 ASP N N 121.97 . 1 604 . 111 ASP H H 9.36 . 1 605 . 111 ASP C C 180.06 . 1 606 . 111 ASP CA C 57.72 . 1 607 . 111 ASP CB C 39.57 . 1 608 . 112 LEU N N 118.49 . 1 609 . 112 LEU H H 8.75 . 1 610 . 112 LEU C C 177.22 . 1 611 . 112 LEU CA C 56.96 . 1 612 . 112 LEU CB C 40.73 . 1 613 . 112 LEU CG C 26.86 . 1 614 . 112 LEU CD1 C 22.21 . 1 615 . 112 LEU CD2 C 22.21 . 1 616 . 113 ASP N N 120.38 . 1 617 . 113 ASP H H 7.00 . 1 618 . 113 ASP C C 177.11 . 1 619 . 113 ASP CA C 58.05 . 1 620 . 113 ASP CB C 43.04 . 1 621 . 114 ASN N N 116.02 . 1 622 . 114 ASN H H 8.76 . 1 623 . 114 ASN C C 178.40 . 1 624 . 114 ASN CA C 55.10 . 1 625 . 114 ASN CB C 37.2 . 1 626 . 115 PHE N N 123.08 . 1 627 . 115 PHE H H 7.75 . 1 628 . 115 PHE C C 177.34 . 1 629 . 115 PHE CA C 60.85 . 1 630 . 115 PHE CB C 38.59 . 1 631 . 116 LEU N N 121.27 . 1 632 . 116 LEU H H 8.33 . 1 633 . 116 LEU C C 180.29 . 1 634 . 116 LEU CA C 57.39 . 1 635 . 116 LEU CB C 40.04 . 1 636 . 116 LEU CG C 24.53 . 1 637 . 116 LEU CD1 C 20.72 . 1 638 . 116 LEU CD2 C 20.72 . 1 639 . 117 LYS N N 120.28 . 1 640 . 117 LYS H H 8.19 . 1 641 . 117 LYS C C 178.75 . 1 642 . 117 LYS CA C 58.15 . 1 643 . 117 LYS CB C 31.83 . 1 644 . 117 LYS CG C 24.78 . 1 645 . 117 LYS CD C 27.49 . 1 646 . 117 LYS CE C 41.65 . 1 647 . 118 SER N N 116.39 . 1 648 . 118 SER H H 7.71 . 1 649 . 118 SER C C 175.77 . 1 650 . 118 SER CA C 59.99 . 1 651 . 118 SER CB C 62.84 . 1 652 . 119 GLN N N 121.81 . 1 653 . 119 GLN H H 7.54 . 1 654 . 119 GLN C C 176.76 . 1 655 . 119 GLN CA C 55.42 . 1 656 . 119 GLN CB C 28.59 . 1 657 . 119 GLN CG C 32.06 . 1 658 . 120 SER N N 116.98 . 1 659 . 120 SER H H 7.81 . 1 660 . 120 SER C C 174.71 . 1 661 . 120 SER CA C 59.05 . 1 662 . 120 SER CB C 63.46 . 1 663 . 121 ASP N N 122.70 . 1 664 . 121 ASP H H 8.07 . 1 665 . 121 ASP C C 176.85 . 1 666 . 121 ASP CA C 54.39 . 1 667 . 121 ASP CB C 41.02 . 1 668 . 122 THR N N 113.03 . 1 669 . 122 THR H H 7.85 . 1 670 . 122 THR C C 175.15 . 1 671 . 122 THR CA C 62.05 . 1 672 . 122 THR CB C 69.29 . 1 673 . 122 THR CG2 C 20.45 . 1 674 . 123 SER N N 118.84 . 1 675 . 123 SER H H 8.16 . 1 676 . 123 SER C C 174.93 . 1 677 . 123 SER CA C 58.35 . 1 678 . 123 SER CB C 69.39 . 1 679 . 124 SER N N 119.92 . 1 680 . 124 SER H H 8.37 . 1 681 . 124 SER C C 174.40 . 1 682 . 124 SER CA C 58.69 . 1 683 . 124 SER CB C 63.25 . 1 684 . 125 SER N N 118.26 . 1 685 . 125 SER H H 8.18 . 1 686 . 125 SER C C 174.20 . 1 687 . 125 SER CA C 57.40 . 1 688 . 125 SER CB C 63.46 . 1 689 . 126 LYS N N 125.23 . 1 690 . 126 LYS H H 8.10 . 1 691 . 126 LYS C C 175.50 . 1 692 . 126 LYS CA C 56.51 . 1 693 . 126 LYS CB C 32.1 . 1 694 . 126 LYS CG C 23.26 . 1 695 . 126 LYS CD C 27.89 . 1 696 . 126 LYS CE C 41.35 . 1 697 . 127 ASN N N 118.44 . 1 698 . 127 ASN H H 8.28 . 1 699 . 127 ASN C C 173.54 . 1 700 . 127 ASN CA C 52.97 . 1 701 . 127 ASN CB C 38.18 . 1 702 . 128 ARG N N 122.16 . 1 703 . 128 ARG H H 7.43 . 1 704 . 128 ARG C C 174.54 . 1 705 . 128 ARG CA C 54.35 . 1 706 . 128 ARG CB C 35.55 . 1 707 . 128 ARG CG C 26.72 . 1 708 . 128 ARG CD C 42.68 . 1 709 . 129 PHE N N 127.74 . 1 710 . 129 PHE H H 9.21 . 1 711 . 129 PHE C C 175.26 . 1 712 . 129 PHE CA C 56.10 . 1 713 . 129 PHE CB C 42.01 . 1 714 . 130 ASP N N 125.09 . 1 715 . 130 ASP H H 8.19 . 1 716 . 130 ASP C C 175.61 . 1 717 . 130 ASP CA C 52.22 . 1 718 . 130 ASP CB C 41.6 . 1 719 . 131 ASP N N 120.92 . 1 720 . 131 ASP H H 8.27 . 1 721 . 131 ASP C C 177.00 . 1 722 . 131 ASP CA C 52.65 . 1 723 . 131 ASP CB C 43.32 . 1 724 . 132 VAL N N 120.31 . 1 725 . 132 VAL H H 8.31 . 1 726 . 132 VAL C C 177.94 . 1 727 . 132 VAL CA C 65.03 . 1 728 . 132 VAL CB C 30.91 . 1 729 . 132 VAL CG1 C 20.14 . 1 730 . 132 VAL CG2 C 20.14 . 1 731 . 133 THR N N 118.79 . 1 732 . 133 THR H H 7.83 . 1 733 . 133 THR C C 177.83 . 1 734 . 133 THR CA C 65.81 . 1 735 . 133 THR CB C 67.87 . 1 736 . 133 THR CG2 C 21.37 . 1 737 . 134 THR N N 123.69 . 1 738 . 134 THR H H 8.29 . 1 739 . 134 THR C C 175.84 . 1 740 . 134 THR CA C 56.10 . 1 741 . 134 THR CG2 C 21.36 . 1 742 . 135 ASP N N 123.39 . 1 743 . 135 ASP H H 7.98 . 1 744 . 135 ASP C C 177.94 . 1 745 . 135 ASP CA C 57.39 . 1 746 . 135 ASP CB C 39.49 . 1 747 . 136 GLN N N 118.41 . 1 748 . 136 GLN H H 8.36 . 1 749 . 136 GLN C C 178.30 . 1 750 . 136 GLN CA C 58.45 . 1 751 . 136 GLN CB C 27.7 . 1 752 . 136 GLN CG C 33.32 . 1 753 . 137 PHE N N 122.94 . 1 754 . 137 PHE H H 7.62 . 1 755 . 137 PHE C C 176.90 . 1 756 . 137 PHE CA C 60.42 . 1 757 . 137 PHE CB C 38.92 . 1 758 . 138 VAL N N 122.04 . 1 759 . 138 VAL H H 8.40 . 1 760 . 138 VAL C C 177.79 . 1 761 . 138 VAL CA C 66.77 . 1 762 . 138 VAL CB C 30.79 . 1 763 . 139 LEU N N 120.16 . 1 764 . 139 LEU H H 8.73 . 1 765 . 139 LEU C C 179.69 . 1 766 . 139 LEU CA C 57.49 . 1 767 . 139 LEU CB C 39.97 . 1 768 . 139 LEU CG C 26.12 . 1 769 . 139 LEU CD1 C 21.78 . 2 770 . 139 LEU CD2 C 23.52 . 2 771 . 140 ASN N N 121.19 . 1 772 . 140 ASN H H 7.73 . 1 773 . 140 ASN C C 177.02 . 1 774 . 140 ASN CA C 56.10 . 1 775 . 140 ASN CB C 37.85 . 1 776 . 141 VAL N N 122.48 . 1 777 . 141 VAL H H 7.82 . 1 778 . 141 VAL C C 179.67 . 1 779 . 141 VAL CA C 65.66 . 1 780 . 141 VAL CB C 30.43 . 1 781 . 141 VAL CG1 C 20.71 . 1 782 . 141 VAL CG2 C 20.71 . 1 783 . 142 ILE N N 122.17 . 1 784 . 142 ILE H H 8.27 . 1 785 . 142 ILE C C 176.89 . 1 786 . 142 ILE CA C 65.93 . 1 787 . 142 ILE CB C 37.05 . 1 788 . 142 ILE CG1 C 28.16 . 1 789 . 142 ILE CG2 C 15.72 . 2 790 . 143 LYS N N 119.50 . 1 791 . 143 LYS H H 7.84 . 1 792 . 143 LYS C C 179.60 . 1 793 . 143 LYS CA C 59.01 . 1 794 . 143 LYS CB C 31.85 . 1 795 . 143 LYS CG C 23.52 . 1 796 . 143 LYS CD C 28.40 . 1 797 . 143 LYS CE C 41.52 . 1 798 . 144 GLU N N 117.06 . 1 799 . 144 GLU H H 7.87 . 1 800 . 144 GLU C C 177.06 . 1 801 . 144 GLU CA C 57.16 . 1 802 . 144 GLU CB C 29.81 . 1 803 . 144 GLU CG C 35.16 . 1 804 . 145 ASN N N 117.03 . 1 805 . 145 ASN H H 7.61 . 1 806 . 145 ASN C C 175.80 . 1 807 . 145 ASN CA C 52.73 . 1 808 . 145 ASN CB C 40.51 . 1 809 . 146 VAL N N 122.58 . 1 810 . 146 VAL H H 7.15 . 1 811 . 146 VAL C C 177.68 . 1 812 . 146 VAL CA C 65.78 . 1 813 . 146 VAL CB C 31.39 . 1 814 . 146 VAL CG1 C 18.83 . 2 815 . 146 VAL CG2 C 20.69 . 2 816 . 147 GLN N N 121.25 . 1 817 . 147 GLN H H 8.73 . 1 818 . 147 GLN C C 178.25 . 1 819 . 147 GLN CA C 57.78 . 1 820 . 147 GLN CB C 27.39 . 1 821 . 147 GLN CG C 33.11 . 1 822 . 148 THR N N 117.52 . 1 823 . 148 THR H H 7.84 . 1 824 . 148 THR C C 176.37 . 1 825 . 148 THR CA C 64.60 . 1 826 . 148 THR CB C 67.52 . 1 827 . 148 THR CG2 C 20.88 . 1 828 . 149 PHE N N 119.19 . 1 829 . 149 PHE H H 7.41 . 1 830 . 149 PHE C C 176.34 . 1 831 . 149 PHE CA C 61.58 . 1 832 . 149 PHE CB C 37.7 . 1 833 . 150 SER N N 111.55 . 1 834 . 150 SER H H 7.30 . 1 835 . 150 SER C C 174.37 . 1 836 . 150 SER CA C 59.42 . 1 837 . 150 SER CB C 63.61 . 1 838 . 151 THR N N 115.82 . 1 839 . 151 THR H H 7.36 . 1 840 . 151 THR C C 173.43 . 1 841 . 151 THR CA C 62.14 . 1 842 . 151 THR CB C 70.23 . 1 843 . 151 THR CG2 C 21.16 . 1 844 . 152 GLY N N 110.35 . 1 845 . 152 GLY H H 8.13 . 1 846 . 152 GLY C C 173.24 . 1 847 . 152 GLY CA C 43.05 . 1 848 . 153 GLN N N 122.97 . 1 849 . 153 GLN H H 10.25 . 1 850 . 153 GLN C C 176.58 . 1 851 . 153 GLN CA C 56.52 . 1 852 . 153 GLN CB C 30.18 . 1 853 . 153 GLN CG C 33.21 . 1 854 . 154 SER N N 122.47 . 1 855 . 154 SER H H 10.27 . 1 856 . 154 SER C C 175.56 . 1 857 . 154 SER CA C 57.29 . 1 858 . 154 SER CB C 66.39 . 1 859 . 155 GLU N N 125.26 . 1 860 . 155 GLU H H 8.51 . 1 861 . 155 GLU C C 176.22 . 1 862 . 155 GLU CA C 56.29 . 1 863 . 155 GLU CB C 29.46 . 1 864 . 155 GLU CG C 34.90 . 1 865 . 156 ALA N N 130.44 . 1 866 . 156 ALA H H 8.62 . 1 867 . 156 ALA CA C 49.15 . 1 868 . 156 ALA CB C 17.51 . 1 869 . 157 PRO CA C 61.27 . 1 870 . 157 PRO CB C 31.69 . 1 871 . 157 PRO CG C 25.06 . 1 872 . 157 PRO CD C 49.38 . 1 873 . 158 GLU N N 118.48 . 1 874 . 158 GLU H H 8.27 . 1 875 . 158 GLU C C 177.88 . 1 876 . 158 GLU CA C 56.08 . 1 877 . 158 GLU CB C 29.69 . 1 878 . 158 GLU CG C 35.62 . 1 879 . 159 ALA N N 125.21 . 1 880 . 159 ALA H H 8.63 . 1 881 . 159 ALA C C 176.33 . 1 882 . 159 ALA CA C 53.74 . 1 883 . 159 ALA CB C 17.46 . 1 884 . 160 THR N N 101.39 . 1 885 . 160 THR H H 7.00 . 1 886 . 160 THR C C 175.00 . 1 887 . 160 THR CA C 60.56 . 1 888 . 160 THR CB C 68.52 . 1 889 . 160 THR CG2 C 20.89 . 1 890 . 161 ALA N N 127.07 . 1 891 . 161 ALA H H 7.35 . 1 892 . 161 ALA C C 176.74 . 1 893 . 161 ALA CA C 51.94 . 1 894 . 161 ALA CB C 18.76 . 1 895 . 162 ASP N N 122.03 . 1 896 . 162 ASP H H 8.34 . 1 897 . 162 ASP C C 175.91 . 1 898 . 162 ASP CA C 53.36 . 1 899 . 162 ASP CB C 42.02 . 1 900 . 163 THR N N 117.08 . 1 901 . 163 THR H H 8.51 . 1 902 . 163 THR C C 172.64 . 1 903 . 163 THR CA C 59.34 . 1 904 . 163 THR CB C 69.12 . 1 905 . 163 THR CG2 C 18.62 . 1 906 . 164 ASN N N 125.13 . 1 907 . 164 ASN H H 8.44 . 1 908 . 164 ASN C C 173.66 . 1 909 . 164 ASN CA C 52.45 . 1 910 . 164 ASN CB C 37.62 . 1 911 . 165 LEU N N 122.54 . 1 912 . 165 LEU H H 8.03 . 1 913 . 165 LEU C C 177.04 . 1 914 . 165 LEU CA C 53.62 . 1 915 . 165 LEU CB C 40.22 . 1 916 . 165 LEU CG C 24.57 . 1 917 . 165 LEU CD1 C 21.42 . 2 918 . 165 LEU CD2 C 25.03 . 2 919 . 166 HIS N N 129.00 . 1 920 . 166 HIS H H 9.01 . 1 921 . 166 HIS C C 171.77 . 1 922 . 166 HIS CA C 54.26 . 1 923 . 166 HIS CB C 35.19 . 1 924 . 167 TYR N N 121.32 . 1 925 . 167 TYR H H 5.98 . 1 926 . 167 TYR C C 176.25 . 1 927 . 167 TYR CA C 56.13 . 1 928 . 167 TYR CB C 41.8 . 1 929 . 168 ILE N N 118.51 . 1 930 . 168 ILE H H 9.44 . 1 931 . 168 ILE C C 173.43 . 1 932 . 168 ILE CA C 60.54 . 1 933 . 168 ILE CB C 42.78 . 1 934 . 168 ILE CG2 C 18.31 . 2 935 . 169 THR N N 116.75 . 1 936 . 169 THR H H 7.56 . 1 937 . 169 THR C C 172.08 . 1 938 . 169 THR CA C 61.60 . 1 939 . 169 THR CB C 71.83 . 1 940 . 169 THR CG2 C 21.18 . 1 941 . 170 TYR N N 125.84 . 1 942 . 170 TYR H H 9.60 . 1 943 . 170 TYR C C 175.70 . 1 944 . 170 TYR CA C 56.98 . 1 945 . 170 TYR CB C 41.64 . 1 946 . 171 VAL N N 112.76 . 1 947 . 171 VAL H H 8.29 . 1 948 . 171 VAL C C 172.39 . 1 949 . 171 VAL CA C 59.23 . 1 950 . 171 VAL CB C 35.89 . 1 951 . 171 VAL CG1 C 17.75 . 2 952 . 171 VAL CG2 C 20.83 . 2 953 . 172 GLU N N 125.31 . 1 954 . 172 GLU H H 8.97 . 1 955 . 172 GLU C C 175.31 . 1 956 . 172 GLU CA C 53.70 . 1 957 . 172 GLU CB C 31.39 . 1 958 . 172 GLU CG C 32.87 . 1 959 . 173 GLU N N 126.16 . 1 960 . 173 GLU H H 9.22 . 1 961 . 173 GLU C C 175.83 . 1 962 . 173 GLU CA C 55.56 . 1 963 . 173 GLU CB C 31.4 . 1 964 . 173 GLU CG C 32.88 . 1 965 . 174 ASN N N 127.33 . 1 966 . 174 ASN H H 9.51 . 1 967 . 174 ASN C C 175.30 . 1 968 . 174 ASN CA C 53.61 . 1 969 . 174 ASN CB C 37.6 . 1 970 . 175 GLY N N 106.10 . 1 971 . 175 GLY H H 9.02 . 1 972 . 175 GLY CA C 45.53 . 1 973 . 176 GLY N N 112.12 . 1 974 . 176 GLY H H 8.37 . 1 975 . 176 GLY C C 170.59 . 1 976 . 176 GLY CA C 43.37 . 1 977 . 177 ILE N N 121.55 . 1 978 . 177 ILE H H 7.90 . 1 979 . 177 ILE C C 174.16 . 1 980 . 177 ILE CA C 57.59 . 1 981 . 177 ILE CB C 35.53 . 1 982 . 177 ILE CG1 C 17.00 . 2 983 . 177 ILE CG2 C 17.00 . 2 984 . 178 PHE N N 124.83 . 1 985 . 178 PHE H H 8.89 . 1 986 . 178 PHE C C 173.52 . 1 987 . 178 PHE CA C 56.14 . 1 988 . 178 PHE CB C 43.01 . 1 989 . 179 GLU N N 123.08 . 1 990 . 179 GLU H H 9.12 . 1 991 . 179 GLU C C 175.81 . 1 992 . 179 GLU CA C 54.37 . 1 993 . 179 GLU CB C 33.88 . 1 994 . 179 GLU CG C 37.48 . 1 995 . 180 LEU N N 129.05 . 1 996 . 180 LEU H H 9.66 . 1 997 . 180 LEU C C 175.30 . 1 998 . 180 LEU CA C 53.30 . 1 999 . 180 LEU CB C 41.62 . 1 1000 . 180 LEU CG C 25.58 . 1 1001 . 181 ASP N N 129.80 . 1 1002 . 181 ASP H H 9.59 . 1 1003 . 181 ASP CA C 53.19 . 1 1004 . 181 ASP CB C 43.68 . 1 1005 . 182 GLY N N 119.76 . 1 1006 . 182 GLY H H 9.28 . 1 1007 . 182 GLY C C 175.81 . 1 1008 . 182 GLY CA C 47.04 . 1 1009 . 183 ARG N N 120.95 . 1 1010 . 183 ARG H H 8.82 . 1 1011 . 183 ARG C C 176.24 . 1 1012 . 183 ARG CA C 55.55 . 1 1013 . 183 ARG CB C 30.05 . 1 1014 . 183 ARG CG C 25.98 . 1 1015 . 183 ARG CD C 42.25 . 1 1016 . 184 ASN N N 119.47 . 1 1017 . 184 ASN H H 7.67 . 1 1018 . 184 ASN C C 175.44 . 1 1019 . 184 ASN CA C 52.11 . 1 1020 . 184 ASN CB C 38.02 . 1 1021 . 185 LEU N N 125.01 . 1 1022 . 185 LEU H H 8.45 . 1 1023 . 185 LEU C C 178.16 . 1 1024 . 185 LEU CA C 56.31 . 1 1025 . 185 LEU CB C 39.88 . 1 1026 . 185 LEU CG C 25.94 . 1 1027 . 186 SER N N 114.69 . 1 1028 . 186 SER H H 8.09 . 1 1029 . 186 SER C C 173.75 . 1 1030 . 186 SER CA C 58.81 . 1 1031 . 186 SER CB C 62.87 . 1 1032 . 187 GLY N N 111.01 . 1 1033 . 187 GLY H H 7.45 . 1 1034 . 187 GLY CA C 41.22 . 1 1035 . 188 PRO C C 174.43 . 1 1036 . 188 PRO CA C 62.68 . 1 1037 . 188 PRO CB C 32.62 . 1 1038 . 188 PRO CG C 26.83 . 1 1039 . 189 LEU N N 126.19 . 1 1040 . 189 LEU H H 8.23 . 1 1041 . 189 LEU C C 174.99 . 1 1042 . 189 LEU CA C 53.43 . 1 1043 . 189 LEU CB C 42.57 . 1 1044 . 189 LEU CG C 26.33 . 1 1045 . 189 LEU CD1 C 22.77 . 2 1046 . 189 LEU CD2 C 24.48 . 2 1047 . 190 TYR N N 130.37 . 1 1048 . 190 TYR H H 8.78 . 1 1049 . 190 TYR C C 174.85 . 1 1050 . 190 TYR CA C 56.30 . 1 1051 . 190 TYR CB C 37.76 . 1 1052 . 191 LEU N N 128.51 . 1 1053 . 191 LEU H H 8.66 . 1 1054 . 191 LEU C C 176.01 . 1 1055 . 191 LEU CA C 54.30 . 1 1056 . 191 LEU CB C 41.04 . 1 1057 . 191 LEU CD1 C 24.32 . 1 1058 . 191 LEU CD2 C 24.32 . 1 1059 . 192 GLY N N 104.39 . 1 1060 . 192 GLY H H 5.46 . 1 1061 . 192 GLY C C 170.20 . 1 1062 . 192 GLY CA C 43.27 . 1 1063 . 193 LYS N N 119.95 . 1 1064 . 193 LYS H H 8.01 . 1 1065 . 193 LYS C C 176.19 . 1 1066 . 193 LYS CA C 55.25 . 1 1067 . 193 LYS CB C 32.7 . 1 1068 . 193 LYS CG C 23.50 . 1 1069 . 193 LYS CD C 27.91 . 1 1070 . 193 LYS CE C 41.12 . 1 1071 . 194 SER N N 118.29 . 1 1072 . 194 SER H H 8.20 . 1 1073 . 194 SER C C 174.06 . 1 1074 . 194 SER CA C 57.19 . 1 1075 . 194 SER CB C 63.52 . 1 1076 . 195 ASP N N 128.40 . 1 1077 . 195 ASP H H 9.17 . 1 1078 . 195 ASP CA C 50.49 . 1 1079 . 195 ASP CB C 41.02 . 1 1080 . 196 PRO C C 177.48 . 1 1081 . 196 PRO CA C 63.65 . 1 1082 . 196 PRO CB C 31.72 . 1 1083 . 196 PRO CG C 25.79 . 1 1084 . 196 PRO CD C 50.34 . 1 1085 . 197 THR N N 111.67 . 1 1086 . 197 THR H H 8.51 . 1 1087 . 197 THR C C 174.75 . 1 1088 . 197 THR CA C 61.68 . 1 1089 . 197 THR CB C 69.12 . 1 1090 . 197 THR CG2 C 20.83 . 1 1091 . 198 ALA N N 127.42 . 1 1092 . 198 ALA H H 7.21 . 1 1093 . 198 ALA CA C 51.01 . 1 1094 . 198 ALA CB C 19.08 . 1 1095 . 199 THR N N 118.84 . 1 1096 . 199 THR H H 8.92 . 1 1097 . 199 THR C C 173.92 . 1 1098 . 199 THR CA C 64.41 . 1 1099 . 199 THR CB C 69.07 . 1 1100 . 199 THR CG2 C 20.61 . 1 1101 . 200 ASP N N 118.24 . 1 1102 . 200 ASP H H 7.26 . 1 1103 . 200 ASP C C 177.64 . 1 1104 . 200 ASP CA C 52.75 . 1 1105 . 200 ASP CB C 40.59 . 1 1106 . 201 LEU N N 115.74 . 1 1107 . 201 LEU H H 7.19 . 1 1108 . 201 LEU C C 178.03 . 1 1109 . 201 LEU CA C 57.16 . 1 1110 . 201 LEU CB C 43.61 . 1 1111 . 201 LEU CD1 C 23.90 . 2 1112 . 201 LEU CD2 C 24.77 . 2 1113 . 202 ILE N N 114.14 . 1 1114 . 202 ILE H H 7.20 . 1 1115 . 202 ILE C C 175.31 . 1 1116 . 202 ILE CA C 61.18 . 1 1117 . 202 ILE CB C 37.27 . 1 1118 . 202 ILE CG1 C 27.60 . 1 1119 . 202 ILE CG2 C 16.80 . 2 1120 . 203 GLU N N 116.72 . 1 1121 . 203 GLU H H 7.01 . 1 1122 . 203 GLU C C 175.85 . 1 1123 . 203 GLU CA C 54.59 . 1 1124 . 203 GLU CB C 30.74 . 1 1125 . 203 GLU CG C 35.93 . 1 1126 . 204 GLN N N 119.22 . 1 1127 . 204 GLN H H 7.06 . 1 1128 . 204 GLN C C 176.06 . 1 1129 . 204 GLN CA C 54.36 . 1 1130 . 204 GLN CB C 25.14 . 1 1131 . 204 GLN CG C 31.24 . 1 1132 . 205 GLU N N 134.08 . 1 1133 . 205 GLU H H 9.24 . 1 1134 . 205 GLU C C 177.36 . 1 1135 . 205 GLU CA C 58.90 . 1 1136 . 205 GLU CB C 28.77 . 1 1137 . 205 GLU CG C 34.38 . 1 1138 . 206 LEU N N 116.57 . 1 1139 . 206 LEU H H 9.00 . 1 1140 . 206 LEU C C 180.41 . 1 1141 . 206 LEU CA C 57.31 . 1 1142 . 206 LEU CB C 42.12 . 1 1143 . 206 LEU CG C 25.56 . 1 1144 . 206 LEU CD1 C 24.15 . 1 1145 . 206 LEU CD2 C 24.15 . 1 1146 . 207 VAL N N 116.62 . 1 1147 . 207 VAL H H 6.70 . 1 1148 . 207 VAL C C 176.18 . 1 1149 . 207 VAL CA C 65.06 . 1 1150 . 207 VAL CB C 30.81 . 1 1151 . 207 VAL CG1 C 18.58 . 1 1152 . 207 VAL CG2 C 18.58 . 1 1153 . 208 ARG N N 119.76 . 1 1154 . 208 ARG H H 7.18 . 1 1155 . 208 ARG C C 179.17 . 1 1156 . 208 ARG CA C 59.76 . 1 1157 . 208 ARG CB C 29.17 . 1 1158 . 208 ARG CG C 26.74 . 1 1159 . 208 ARG CD C 42.64 . 1 1160 . 209 VAL N N 118.97 . 1 1161 . 209 VAL H H 8.59 . 1 1162 . 209 VAL C C 178.37 . 1 1163 . 209 VAL CA C 64.95 . 1 1164 . 209 VAL CB C 31.36 . 1 1165 . 209 VAL CG1 C 19.77 . 1 1166 . 209 VAL CG2 C 19.77 . 1 1167 . 210 ARG N N 124.03 . 1 1168 . 210 ARG H H 7.19 . 1 1169 . 210 ARG C C 179.09 . 1 1170 . 210 ARG CA C 57.17 . 1 1171 . 210 ARG CB C 29.07 . 1 1172 . 210 ARG CG C 24.95 . 1 1173 . 210 ARG CD C 41.97 . 1 1174 . 211 VAL N N 121.04 . 1 1175 . 211 VAL H H 8.48 . 1 1176 . 211 VAL C C 178.03 . 1 1177 . 211 VAL CA C 66.87 . 1 1178 . 211 VAL CB C 30.82 . 1 1179 . 211 VAL CG1 C 20.40 . 1 1180 . 211 VAL CG2 C 20.40 . 1 1181 . 212 ALA N N 121.78 . 1 1182 . 212 ALA H H 7.93 . 1 1183 . 212 ALA C C 180.00 . 1 1184 . 212 ALA CA C 54.52 . 1 1185 . 212 ALA CB C 17.19 . 1 1186 . 213 SER N N 115.96 . 1 1187 . 213 SER H H 7.74 . 1 1188 . 213 SER C C 177.10 . 1 1189 . 213 SER CA C 61.16 . 1 1190 . 213 SER CB C 62.32 . 1 1191 . 214 TYR N N 122.48 . 1 1192 . 214 TYR H H 7.46 . 1 1193 . 214 TYR C C 179.34 . 1 1194 . 214 TYR CA C 61.48 . 1 1195 . 214 TYR CB C 38.2 . 1 1196 . 215 MET N N 119.59 . 1 1197 . 215 MET H H 7.72 . 1 1198 . 215 MET C C 178.32 . 1 1199 . 215 MET CA C 58.87 . 1 1200 . 215 MET CB C 30.92 . 1 1201 . 215 MET CG C 32.04 . 1 1202 . 216 GLU N N 119.70 . 1 1203 . 216 GLU H H 8.33 . 1 1204 . 216 GLU C C 177.16 . 1 1205 . 216 GLU CA C 57.49 . 1 1206 . 216 GLU CB C 29.12 . 1 1207 . 216 GLU CG C 35.00 . 1 1208 . 217 ASN N N 116.57 . 1 1209 . 217 ASN H H 7.44 . 1 1210 . 217 ASN C C 174.22 . 1 1211 . 217 ASN CA C 52.75 . 1 1212 . 217 ASN CB C 39.49 . 1 1213 . 218 ALA N N 124.00 . 1 1214 . 218 ALA H H 7.14 . 1 1215 . 218 ALA C C 177.49 . 1 1216 . 218 ALA CA C 52.10 . 1 1217 . 218 ALA CB C 18.81 . 1 1218 . 219 ASN N N 121.95 . 1 1219 . 219 ASN H H 8.95 . 1 1220 . 219 ASN C C 176.69 . 1 1221 . 219 ASN CA C 52.97 . 1 1222 . 219 ASN CB C 38.35 . 1 1223 . 220 GLU N N 123.27 . 1 1224 . 220 GLU H H 8.79 . 1 1225 . 220 GLU C C 178.41 . 1 1226 . 220 GLU CA C 59.44 . 1 1227 . 220 GLU CB C 29.16 . 1 1228 . 220 GLU CG C 35.09 . 1 1229 . 221 GLU N N 118.00 . 1 1230 . 221 GLU H H 9.08 . 1 1231 . 221 GLU C C 177.15 . 1 1232 . 221 GLU CA C 57.73 . 1 1233 . 221 GLU CB C 28.27 . 1 1234 . 221 GLU CG C 35.06 . 1 1235 . 222 ASP N N 120.47 . 1 1236 . 222 ASP H H 8.02 . 1 1237 . 222 ASP C C 177.25 . 1 1238 . 222 ASP CA C 54.26 . 1 1239 . 222 ASP CB C 43.32 . 1 1240 . 223 VAL N N 117.91 . 1 1241 . 223 VAL H H 7.05 . 1 1242 . 223 VAL C C 175.55 . 1 1243 . 223 VAL CA C 65.16 . 1 1244 . 223 VAL CB C 31.78 . 1 1245 . 223 VAL CG1 C 20.17 . 1 1246 . 223 VAL CG2 C 20.17 . 1 1247 . 224 LEU N N 118.21 . 1 1248 . 224 LEU H H 8.36 . 1 1249 . 224 LEU C C 178.56 . 1 1250 . 224 LEU CA C 54.19 . 1 1251 . 224 LEU CB C 41.55 . 1 1252 . 224 LEU CG C 26.03 . 1 1253 . 224 LEU CD1 C 22.29 . 2 1254 . 224 LEU CD2 C 24.51 . 2 1255 . 225 ASN N N 121.99 . 1 1256 . 225 ASN H H 7.67 . 1 1257 . 225 ASN C C 170.51 . 1 1258 . 225 ASN CA C 52.98 . 1 1259 . 225 ASN CB C 36.47 . 1 1260 . 226 PHE N N 115.74 . 1 1261 . 226 PHE H H 8.00 . 1 1262 . 226 PHE C C 175.29 . 1 1263 . 226 PHE CA C 55.25 . 1 1264 . 226 PHE CB C 45.37 . 1 1265 . 227 ALA N N 121.92 . 1 1266 . 227 ALA H H 8.72 . 1 1267 . 227 ALA C C 175.02 . 1 1268 . 227 ALA CA C 51.69 . 1 1269 . 227 ALA CB C 22.17 . 1 1270 . 228 MET N N 120.62 . 1 1271 . 228 MET H H 8.82 . 1 1272 . 228 MET C C 174.25 . 1 1273 . 228 MET CA C 54.48 . 1 1274 . 228 MET CB C 39.45 . 1 1275 . 228 MET CG C 33.26 . 1 1276 . 229 LEU N N 124.94 . 1 1277 . 229 LEU H H 9.23 . 1 1278 . 229 LEU C C 175.83 . 1 1279 . 229 LEU CA C 52.61 . 1 1280 . 229 LEU CB C 45.51 . 1 1281 . 229 LEU CG C 26.02 . 1 1282 . 229 LEU CD1 C 23.42 . 1 1283 . 229 LEU CD2 C 23.42 . 1 1284 . 230 GLY N N 109.20 . 1 1285 . 230 GLY H H 8.91 . 1 1286 . 230 GLY C C 169.95 . 1 1287 . 230 GLY CA C 42.83 . 1 1288 . 231 LEU N N 125.02 . 1 1289 . 231 LEU H H 7.86 . 1 1290 . 231 LEU C C 174.47 . 1 1291 . 231 LEU CA C 52.87 . 1 1292 . 231 LEU CB C 43.74 . 1 1293 . 231 LEU CG C 24.75 . 1 1294 . 231 LEU CD1 C 21.59 . 2 1295 . 231 LEU CD2 C 26.11 . 2 1296 . 232 GLY N N 116.89 . 1 1297 . 232 GLY H H 9.00 . 1 1298 . 232 GLY CA C 45.31 . 1 1299 . 233 PRO C C 175.13 . 1 1300 . 233 PRO CA C 62.35 . 1 1301 . 233 PRO CB C 30.84 . 1 1302 . 234 ASN N N 120.56 . 1 1303 . 234 ASN H H 7.98 . 1 1304 . 234 ASN C C 174.83 . 1 1305 . 234 ASN CA C 51.20 . 1 1306 . 234 ASN CB C 38.63 . 1 1307 . 235 TRP N N 126.20 . 1 1308 . 235 TRP H H 8.03 . 1 1309 . 235 TRP C C 175.26 . 1 1310 . 235 TRP CA C 55.56 . 1 1311 . 235 TRP CB C 29.81 . 1 1312 . 236 GLU N N 128.11 . 1 1313 . 236 GLU H H 7.80 . 1 1314 . 236 GLU CA C 57.47 . 1 1315 . 236 GLU CB C 29.93 . 1 1316 . 236 GLU CG C 35.27 . 1 stop_ save_ save_Ubiquitin_cs _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _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 MET C C 170.42 . 1 2 . 1 MET CB C 32.09 . 1 3 . 2 GLN N N 124.75 . 1 4 . 2 GLN H H 8.92 . 1 5 . 2 GLN C C 175.77 . 1 6 . 2 GLN CA C 54.59 . 1 7 . 2 GLN CB C 29.64 . 1 8 . 2 GLN CG C 33.71 . 1 9 . 3 ILE N N 116.89 . 1 10 . 3 ILE H H 8.23 . 1 11 . 3 ILE C C 172.19 . 1 12 . 3 ILE CA C 59.05 . 1 13 . 3 ILE CB C 40.98 . 1 14 . 3 ILE CG1 C 16.57 . 2 15 . 3 ILE CG2 C 16.57 . 2 16 . 3 ILE CD1 C 13.28 . 1 17 . 4 PHE N N 120.10 . 1 18 . 4 PHE H H 8.45 . 1 19 . 4 PHE C C 174.74 . 1 20 . 4 PHE CA C 54.70 . 1 21 . 4 PHE CB C 40.26 . 1 22 . 5 VAL N N 123.65 . 1 23 . 5 VAL H H 9.38 . 1 24 . 5 VAL C C 174.61 . 1 25 . 5 VAL CA C 60.08 . 1 26 . 5 VAL CB C 32.82 . 1 27 . 5 VAL CG1 C 19.62 . 2 28 . 5 VAL CG2 C 21.55 . 2 29 . 6 LYS N N 129.17 . 1 30 . 6 LYS H H 8.74 . 1 31 . 6 LYS C C 176.30 . 1 32 . 6 LYS CA C 53.97 . 1 33 . 6 LYS CB C 34.41 . 1 34 . 6 LYS CG C 24.29 . 1 35 . 6 LYS CD C 28.17 . 1 36 . 6 LYS CE C 41.18 . 1 37 . 7 THR N N 113.32 . 1 38 . 7 THR H H 8.21 . 1 39 . 7 THR C C 177.35 . 1 40 . 7 THR CA C 59.77 . 1 41 . 7 THR CB C 70.41 . 1 42 . 7 THR CG2 C 20.64 . 1 43 . 8 LEU N N 127.19 . 1 44 . 8 LEU H H 9.99 . 1 45 . 8 LEU C C 177.74 . 1 46 . 8 LEU CA C 57.70 . 1 47 . 8 LEU CB C 41.42 . 1 48 . 8 LEU CG C 24.94 . 3 49 . 9 THR N N 105.13 . 1 50 . 9 THR H H 7.51 . 1 51 . 9 THR C C 175.22 . 1 52 . 9 THR CA C 61.43 . 1 53 . 9 THR CB C 68.64 . 1 54 . 9 THR CG2 C 21.08 . 1 55 . 10 GLY N N 110.87 . 1 56 . 10 GLY H H 7.90 . 1 57 . 10 GLY C C 174.06 . 1 58 . 10 GLY CA C 44.54 . 1 59 . 11 LYS N N 124.71 . 1 60 . 11 LYS H H 7.32 . 1 61 . 11 LYS C C 175.56 . 1 62 . 11 LYS CA C 55.84 . 1 63 . 11 LYS CB C 31.71 . 1 64 . 11 LYS CG C 24.17 . 1 65 . 11 LYS CD C 28.56 . 1 66 . 11 LYS CE C 41.24 . 1 67 . 12 THR N N 122.19 . 1 68 . 12 THR H H 8.51 . 1 69 . 12 THR C C 173.83 . 1 70 . 12 THR CA C 61.84 . 1 71 . 12 THR CB C 68.88 . 1 72 . 12 THR CG2 C 20.92 . 1 73 . 13 ILE N N 132.35 . 1 74 . 13 ILE H H 9.76 . 1 75 . 13 ILE C C 175.22 . 1 76 . 13 ILE CA C 59.77 . 1 77 . 13 ILE CB C 39.55 . 1 78 . 13 ILE CG1 C 25.64 . 2 79 . 13 ILE CG2 C 16.26 . 2 80 . 13 ILE CD1 C 13.30 . 1 81 . 14 THR N N 125.62 . 1 82 . 14 THR H H 8.78 . 1 83 . 14 THR C C 173.57 . 1 84 . 14 THR CA C 61.95 . 1 85 . 14 THR CB C 68.43 . 1 86 . 14 THR CG2 C 20.65 . 1 87 . 15 LEU N N 126.73 . 1 88 . 15 LEU H H 8.62 . 1 89 . 15 LEU C C 174.38 . 1 90 . 15 LEU CA C 52.21 . 1 91 . 15 LEU CB C 45.61 . 1 92 . 15 LEU CG C 25.86 . 1 93 . 15 LEU CD1 C 22.65 . 1 94 . 15 LEU CD2 C 22.65 . 1 95 . 16 GLU N N 123.86 . 1 96 . 16 GLU H H 8.04 . 1 97 . 16 GLU C C 175.67 . 1 98 . 16 GLU CA C 54.28 . 1 99 . 16 GLU CB C 28.80 . 1 100 . 16 GLU CG C 34.66 . 1 101 . 17 VAL N N 119.14 . 1 102 . 17 VAL H H 8.91 . 1 103 . 17 VAL C C 173.98 . 1 104 . 17 VAL CA C 58.01 . 1 105 . 17 VAL CB C 35.21 . 1 106 . 17 VAL CG1 C 18.26 . 2 107 . 17 VAL CG2 C 20.73 . 2 108 . 18 GLU N N 120.27 . 1 109 . 18 GLU H H 8.58 . 1 110 . 18 GLU C C 178.03 . 1 111 . 18 GLU CA C 53.25 . 1 112 . 18 GLU CB C 31.20 . 1 113 . 18 GLU CG C 34.61 . 1 114 . 20 SER N N 110.28 . 1 115 . 20 SER H H 7.24 . 1 116 . 20 SER C C 174.57 . 1 117 . 20 SER CA C 56.77 . 1 118 . 20 SER CB C 62.69 . 1 119 . 21 ASP N N 125.02 . 1 120 . 21 ASP H H 7.80 . 1 121 . 21 ASP C C 176.13 . 1 122 . 21 ASP CA C 55.22 . 1 123 . 21 ASP CB C 40.00 . 1 124 . 22 THR N N 110.08 . 1 125 . 22 THR H H 7.91 . 1 126 . 22 THR C C 176.71 . 1 127 . 22 THR CA C 59.15 . 1 128 . 22 THR CB C 70.85 . 1 129 . 22 THR CG2 C 21.19 . 1 130 . 23 ILE N N 123.10 . 1 131 . 23 ILE H H 8.55 . 1 132 . 23 ILE C C 178.46 . 1 133 . 23 ILE CA C 61.84 . 1 134 . 23 ILE CB C 33.90 . 1 135 . 23 ILE CG2 C 16.93 . 2 136 . 23 ILE CD1 C 8.32 . 1 137 . 24 ASP N N 120.18 . 1 138 . 24 ASP H H 9.31 . 1 139 . 24 ASP C C 178.58 . 1 140 . 24 ASP CA C 56.56 . 1 141 . 24 ASP CB C 39.07 . 1 142 . 25 ASN N N 121.16 . 1 143 . 25 ASN H H 8.00 . 1 144 . 25 ASN C C 178.38 . 1 145 . 25 ASN CA C 55.53 . 1 146 . 25 ASN CB C 37.67 . 1 147 . 26 VAL N N 123.82 . 1 148 . 26 VAL H H 8.08 . 1 149 . 26 VAL C C 177.65 . 1 150 . 26 VAL CA C 67.12 . 1 151 . 26 VAL CB C 29.53 . 1 152 . 26 VAL CG1 C 22.32 . 2 153 . 26 VAL CG2 C 20.33 . 2 154 . 27 LYS N N 120.18 . 1 155 . 27 LYS H H 8.45 . 1 156 . 27 LYS C C 181.03 . 1 157 . 27 LYS CA C 58.63 . 1 158 . 27 LYS CB C 32.40 . 1 159 . 27 LYS CG C 24.18 . 1 160 . 27 LYS CD C 29.48 . 1 161 . 27 LYS CE C 41.31 . 1 162 . 28 SER N N 118.51 . 1 163 . 28 SER H H 8.08 . 1 164 . 28 SER C C 176.28 . 1 165 . 28 SER CA C 61.72 . 1 166 . 28 SER CB C 71.05 . 1 167 . 29 LYS N N 124.97 . 1 168 . 29 LYS H H 7.93 . 1 169 . 29 LYS C C 180.12 . 1 170 . 29 LYS CA C 59.15 . 1 171 . 29 LYS CB C 32.06 . 1 172 . 29 LYS CG C 25.20 . 1 173 . 29 LYS CE C 41.80 . 1 174 . 30 ILE N N 123.50 . 1 175 . 30 ILE H H 8.22 . 1 176 . 30 ILE C C 178.06 . 1 177 . 30 ILE CA C 65.78 . 1 178 . 30 ILE CB C 35.57 . 1 179 . 30 ILE CG1 C 29.75 . 1 180 . 30 ILE CG2 C 15.52 . 1 181 . 30 ILE CD1 C 13.34 . 1 182 . 31 GLN N N 125.28 . 1 183 . 31 GLN H H 8.46 . 1 184 . 31 GLN C C 179.04 . 1 185 . 31 GLN CA C 59.36 . 1 186 . 31 GLN CB C 26.68 . 1 187 . 31 GLN CG C 32.75 . 1 188 . 32 ASP N N 121.97 . 1 189 . 32 ASP H H 8.24 . 1 190 . 32 ASP C C 177.38 . 1 191 . 32 ASP CA C 56.87 . 1 192 . 32 ASP CB C 39.99 . 1 193 . 33 LYS N N 117.41 . 1 194 . 33 LYS H H 7.48 . 1 195 . 33 LYS C C 177.93 . 1 196 . 33 LYS CA C 57.80 . 1 197 . 33 LYS CB C 33.06 . 1 198 . 33 LYS CG C 24.07 . 1 199 . 33 LYS CD C 27.60 . 1 200 . 33 LYS CE C 41.55 . 1 201 . 34 GLU N N 114.42 . 1 202 . 34 GLU H H 8.58 . 1 203 . 34 GLU C C 177.91 . 1 204 . 34 GLU CA C 54.39 . 1 205 . 34 GLU CB C 31.12 . 1 206 . 34 GLU CG C 33.60 . 1 207 . 35 GLY N N 110.60 . 1 208 . 35 GLY H H 8.48 . 1 209 . 35 GLY C C 173.74 . 1 210 . 35 GLY CA C 45.48 . 1 211 . 36 ILE N N 122.29 . 1 212 . 36 ILE H H 6.11 . 1 213 . 36 ILE C C 173.14 . 1 214 . 36 ILE CA C 57.39 . 1 215 . 36 ILE CB C 38.91 . 1 216 . 36 ILE CG1 C 25.66 . 1 217 . 36 ILE CG2 C 16.57 . 1 218 . 36 ILE CD1 C 12.03 . 1 219 . 38 PRO C C 178.19 . 1 220 . 38 PRO CA C 65.36 . 1 221 . 38 PRO CB C 31.69 . 1 222 . 38 PRO CG C 26.75 . 1 223 . 39 ASP N N 115.99 . 1 224 . 39 ASP H H 8.47 . 1 225 . 39 ASP C C 176.73 . 1 226 . 39 ASP CA C 55.32 . 1 227 . 39 ASP CB C 38.54 . 1 228 . 40 GLN N N 118.67 . 1 229 . 40 GLN H H 7.62 . 1 230 . 40 GLN C C 175.45 . 1 231 . 40 GLN CA C 54.91 . 1 232 . 40 GLN CB C 28.42 . 1 233 . 40 GLN CG C 33.22 . 1 234 . 41 GLN N N 118.75 . 1 235 . 41 GLN H H 7.44 . 1 236 . 41 GLN C C 176.41 . 1 237 . 41 GLN CA C 55.73 . 1 238 . 41 GLN CB C 31.63 . 1 239 . 41 GLN CG C 32.25 . 1 240 . 42 ARG N N 125.01 . 1 241 . 42 ARG H H 8.66 . 1 242 . 42 ARG C C 173.23 . 1 243 . 42 ARG CA C 54.28 . 1 244 . 42 ARG CB C 30.62 . 1 245 . 42 ARG CG C 25.10 . 1 246 . 42 ARG CD C 42.05 . 1 247 . 43 LEU N N 127.90 . 1 248 . 43 LEU H H 8.85 . 1 249 . 43 LEU C C 175.24 . 1 250 . 43 LEU CA C 52.94 . 1 251 . 43 LEU CB C 44.19 . 1 252 . 43 LEU CG C 26.52 . 1 253 . 43 LEU CD1 C 23.20 . 1 254 . 43 LEU CD2 C 23.20 . 1 255 . 44 ILE N N 121.94 . 1 256 . 44 ILE H H 8.86 . 1 257 . 44 ILE C C 175.57 . 1 258 . 44 ILE CA C 58.32 . 1 259 . 44 ILE CB C 40.47 . 1 260 . 44 ILE CG1 C 26.57 . 1 261 . 44 ILE CG2 C 15.52 . 1 262 . 44 ILE CD1 C 12.14 . 1 263 . 45 PHE N N 125.78 . 1 264 . 45 PHE H H 8.63 . 1 265 . 45 PHE C C 174.43 . 1 266 . 45 PHE CA C 56.15 . 1 267 . 45 PHE CB C 42.59 . 1 268 . 46 ALA N N 134.61 . 1 269 . 46 ALA H H 8.80 . 1 270 . 46 ALA C C 176.40 . 1 271 . 46 ALA CA C 51.93 . 1 272 . 46 ALA CB C 15.53 . 1 273 . 47 GLY N N 103.43 . 1 274 . 47 GLY H H 7.62 . 1 275 . 47 GLY C C 173.14 . 1 276 . 47 GLY CA C 44.31 . 1 277 . 48 LYS N N 123.03 . 1 278 . 48 LYS H H 7.72 . 1 279 . 48 LYS C C 174.97 . 1 280 . 48 LYS CA C 53.77 . 1 281 . 48 LYS CB C 33.13 . 1 282 . 48 LYS CG C 22.96 . 1 283 . 48 LYS CD C 27.82 . 1 284 . 48 LYS CE C 41.32 . 1 285 . 49 GLN N N 123.09 . 1 286 . 49 GLN H H 8.57 . 1 287 . 49 GLN C C 175.41 . 1 288 . 49 GLN CA C 55.42 . 1 289 . 49 GLN CB C 27.68 . 1 290 . 49 GLN CG C 33.08 . 1 291 . 50 LEU N N 125.28 . 1 292 . 50 LEU H H 8.36 . 1 293 . 50 LEU C C 176.47 . 1 294 . 50 LEU CA C 53.35 . 1 295 . 50 LEU CB C 40.13 . 1 296 . 50 LEU CD1 C 24.45 . 2 297 . 51 GLU N N 124.57 . 1 298 . 51 GLU H H 8.34 . 1 299 . 51 GLU C C 175.80 . 1 300 . 51 GLU CA C 55.42 . 1 301 . 51 GLU CB C 30.58 . 1 302 . 51 GLU CG C 35.36 . 1 303 . 52 ASP N N 121.59 . 1 304 . 52 ASP H H 8.09 . 1 305 . 52 ASP C C 177.04 . 1 306 . 52 ASP CA C 56.25 . 1 307 . 52 ASP CB C 39.99 . 1 308 . 53 GLY N N 108.01 . 1 309 . 53 GLY H H 9.26 . 1 310 . 53 GLY C C 174.68 . 1 311 . 53 GLY CA C 44.66 . 1 312 . 54 ARG N N 120.95 . 1 313 . 54 ARG H H 7.38 . 1 314 . 54 ARG C C 175.30 . 1 315 . 54 ARG CA C 53.97 . 1 316 . 54 ARG CB C 31.11 . 1 317 . 54 ARG CG C 26.28 . 1 318 . 54 ARG CD C 41.98 . 1 319 . 55 THR N N 110.50 . 1 320 . 55 THR H H 8.75 . 1 321 . 55 THR C C 176.27 . 1 322 . 55 THR CA C 59.46 . 1 323 . 55 THR CB C 71.69 . 1 324 . 55 THR CG2 C 21.29 . 1 325 . 56 LEU N N 119.66 . 1 326 . 56 LEU H H 8.15 . 1 327 . 56 LEU C C 180.67 . 1 328 . 56 LEU CA C 58.22 . 1 329 . 56 LEU CB C 38.75 . 1 330 . 56 LEU CG C 25.13 . 2 331 . 57 SER N N 114.70 . 1 332 . 57 SER H H 8.21 . 1 333 . 57 SER C C 178.19 . 1 334 . 57 SER CA C 60.50 . 1 335 . 57 SER CB C 61.66 . 1 336 . 58 ASP N N 125.84 . 1 337 . 58 ASP H H 7.88 . 1 338 . 58 ASP C C 177.24 . 1 339 . 58 ASP CA C 56.87 . 1 340 . 58 ASP CB C 39.44 . 1 341 . 59 TYR N N 117.29 . 1 342 . 59 TYR H H 7.16 . 1 343 . 59 TYR C C 174.45 . 1 344 . 59 TYR CA C 57.60 . 1 345 . 59 TYR CB C 38.90 . 1 346 . 60 ASN N N 117.79 . 1 347 . 60 ASN H H 8.08 . 1 348 . 60 ASN C C 174.08 . 1 349 . 60 ASN CA C 53.66 . 1 350 . 60 ASN CB C 36.63 . 1 351 . 61 ILE N N 120.64 . 1 352 . 61 ILE H H 7.27 . 1 353 . 61 ILE C C 174.53 . 1 354 . 61 ILE CA C 61.84 . 1 355 . 61 ILE CB C 35.60 . 1 356 . 61 ILE CG2 C 16.07 . 2 357 . 61 ILE CD1 C 12.87 . 1 358 . 62 GLN N N 126.61 . 1 359 . 62 GLN H H 7.61 . 1 360 . 62 GLN C C 175.53 . 1 361 . 62 GLN CA C 53.15 . 1 362 . 62 GLN CB C 30.62 . 1 363 . 62 GLN CG C 32.50 . 1 364 . 63 LYS N N 122.05 . 1 365 . 63 LYS H H 8.36 . 1 366 . 63 LYS C C 175.62 . 1 367 . 63 LYS CA C 57.39 . 1 368 . 63 LYS CB C 31.35 . 1 369 . 63 LYS CG C 22.57 . 1 370 . 63 LYS CD C 28.40 . 1 371 . 63 LYS CE C 41.26 . 1 372 . 64 GLU N N 116.66 . 1 373 . 64 GLU H H 9.19 . 1 374 . 64 GLU C C 175.12 . 1 375 . 64 GLU CA C 57.70 . 1 376 . 64 GLU CB C 25.10 . 1 377 . 64 GLU CG C 36.25 . 1 378 . 65 SER N N 116.56 . 1 379 . 65 SER H H 7.66 . 1 380 . 65 SER C C 171.85 . 1 381 . 65 SER CA C 60.39 . 1 382 . 65 SER CB C 63.97 . 1 383 . 66 THR N N 118.98 . 1 384 . 66 THR H H 8.68 . 1 385 . 66 THR C C 173.64 . 1 386 . 66 THR CA C 61.84 . 1 387 . 66 THR CB C 69.18 . 1 388 . 66 THR CG2 C 20.69 . 1 389 . 67 LEU N N 129.50 . 1 390 . 67 LEU H H 9.44 . 1 391 . 67 LEU C C 175.20 . 1 392 . 67 LEU CA C 53.35 . 1 393 . 67 LEU CB C 43.22 . 1 394 . 67 LEU CG C 28.29 . 1 395 . 67 LEU CD1 C 23.68 . 1 396 . 67 LEU CD2 C 23.68 . 1 397 . 68 HIS N N 119.93 . 1 398 . 68 HIS H H 9.03 . 1 399 . 68 HIS C C 172.87 . 1 400 . 68 HIS CA C 55.73 . 1 401 . 68 HIS CB C 30.86 . 1 402 . 69 LEU N N 126.16 . 1 403 . 69 LEU H H 8.51 . 1 404 . 69 LEU C C 175.51 . 1 405 . 69 LEU CA C 53.15 . 1 406 . 69 LEU CB C 43.54 . 1 407 . 69 LEU CD1 C 24.80 . 1 408 . 69 LEU CD2 C 24.80 . 1 409 . 70 VAL N N 127.93 . 1 410 . 70 VAL H H 9.31 . 1 411 . 70 VAL C C 173.50 . 1 412 . 70 VAL CA C 59.88 . 1 413 . 70 VAL CB C 33.26 . 1 414 . 70 VAL CG1 C 19.66 . 2 415 . 70 VAL CG2 C 21.80 . 2 416 . 71 LEU N N 124.16 . 1 417 . 71 LEU H H 8.25 . 1 418 . 71 LEU C C 176.81 . 1 419 . 71 LEU CA C 52.66 . 1 420 . 71 LEU CB C 42.17 . 1 421 . 71 LEU CG C 25.54 . 1 422 . 71 LEU CD1 C 23.52 . 1 423 . 71 LEU CD2 C 23.52 . 1 424 . 72 ARG N N 126.48 . 1 425 . 72 ARG H H 8.70 . 1 426 . 72 ARG C C 173.57 . 1 427 . 72 ARG CA C 52.11 . 1 428 . 72 ARG CB C 27.12 . 1 429 . 72 ARG CG C 25.10 . 1 430 . 72 ARG CD C 41.85 . 1 431 . 73 LEU N N 121.86 . 1 432 . 73 LEU H H 7.65 . 1 433 . 73 LEU C C 175.81 . 1 434 . 73 LEU CA C 51.80 . 1 435 . 73 LEU CB C 44.24 . 1 436 . 73 LEU CG C 24.48 . 1 437 . 73 LEU CD1 C 21.52 . 1 438 . 73 LEU CD2 C 21.52 . 1 439 . 74 ARG N N 120.65 . 1 440 . 74 ARG H H 8.32 . 1 441 . 74 ARG C C 174.76 . 1 442 . 74 ARG CA C 54.08 . 1 443 . 74 ARG CB C 28.94 . 1 444 . 74 ARG CG C 27.87 . 1 445 . 74 ARG CD C 42.91 . 1 446 . 75 GLY N N 108.24 . 1 447 . 75 GLY H H 7.26 . 1 448 . 75 GLY C C 172.01 . 1 449 . 75 GLY CA C 43.02 . 1 450 . 76 GLZ N N 114.56 . 1 451 . 76 GLZ H H 8.06 . 1 452 . 76 GLZ CA C 46.93 . 1 stop_ save_