data_16898 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C and 15N Chemical Shift Assignments for the alpha chain of human haemoglobin bound to alpha-haemoglobin stabilizing protein (AHSP) ; _BMRB_accession_number 16898 _BMRB_flat_file_name bmr16898.str _Entry_type original _Submission_date 2010-04-23 _Accession_date 2010-04-23 _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 Dickson Claire F. . 2 Gell David A. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 112 "13C chemical shifts" 120 "15N chemical shifts" 112 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-05-16 update BMRB 'update entry citation' 2010-05-27 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title '-Hemoglobin-stabilizing protein (AHSP) perturbs the proximal heme pocket of oxy--hemoglobin and weakens the iron-oxygen bond.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 23696640 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Dickson Claire F. . 2 Rich Anne M. . 3 Collins William M.H. . 4 Lowry Daniel A.T. . 5 Mollan Jason A. . 6 Khandros Todd L. . 7 Olson Eugene . . 8 Weiss John S. . 9 Mackay Mitchell J. . 10 Lay Joel P. . 11 Gell Peter A. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_name_full 'The Journal of biological chemistry' _Journal_volume 288 _Journal_issue 27 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 19986 _Page_last 20001 _Year 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'alpha-haemoglobin:AHSP protein complex' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'alpha globin polypeptide' $HBA1 'AHSP polypeptide' $AHSP stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function 'To inhibit the redox cyling and precipitation of the free alpha-haemoglobin chain' stop_ _Database_query_date . _Details 'alpha-haemoglobin (alpha-Hb) in the carbonmonoxy-liganded form, in complex with AHSP' save_ ######################## # Monomeric polymers # ######################## save_HBA1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common HBA1 _Molecular_mass . _Mol_thiol_state 'all free' loop_ _Biological_function 'alpha haemoglobin is bound by AHSP to inhibit redox cycling and precipitation' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 141 _Mol_residue_sequence ; VLSPADKTNVKAAWGKVGAH AGEYGAEALERMFLSFPTTK TYFPHFDLSHGSAQVKGHGK KVADALTNAVAHVDDMPNAL SALSDLHAHKLRVDPVNFKL LSHCLLVTLAAHLPAEFTPA VHASLDKFLASVSTVLTSKY R ; loop_ _Residue_seq_code _Residue_label 1 VAL 2 LEU 3 SER 4 PRO 5 ALA 6 ASP 7 LYS 8 THR 9 ASN 10 VAL 11 LYS 12 ALA 13 ALA 14 TRP 15 GLY 16 LYS 17 VAL 18 GLY 19 ALA 20 HIS 21 ALA 22 GLY 23 GLU 24 TYR 25 GLY 26 ALA 27 GLU 28 ALA 29 LEU 30 GLU 31 ARG 32 MET 33 PHE 34 LEU 35 SER 36 PHE 37 PRO 38 THR 39 THR 40 LYS 41 THR 42 TYR 43 PHE 44 PRO 45 HIS 46 PHE 47 ASP 48 LEU 49 SER 50 HIS 51 GLY 52 SER 53 ALA 54 GLN 55 VAL 56 LYS 57 GLY 58 HIS 59 GLY 60 LYS 61 LYS 62 VAL 63 ALA 64 ASP 65 ALA 66 LEU 67 THR 68 ASN 69 ALA 70 VAL 71 ALA 72 HIS 73 VAL 74 ASP 75 ASP 76 MET 77 PRO 78 ASN 79 ALA 80 LEU 81 SER 82 ALA 83 LEU 84 SER 85 ASP 86 LEU 87 HIS 88 ALA 89 HIS 90 LYS 91 LEU 92 ARG 93 VAL 94 ASP 95 PRO 96 VAL 97 ASN 98 PHE 99 LYS 100 LEU 101 LEU 102 SER 103 HIS 104 CYS 105 LEU 106 LEU 107 VAL 108 THR 109 LEU 110 ALA 111 ALA 112 HIS 113 LEU 114 PRO 115 ALA 116 GLU 117 PHE 118 THR 119 PRO 120 ALA 121 VAL 122 HIS 123 ALA 124 SER 125 LEU 126 ASP 127 LYS 128 PHE 129 LEU 130 ALA 131 SER 132 VAL 133 SER 134 THR 135 VAL 136 LEU 137 THR 138 SER 139 LYS 140 TYR 141 ARG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-18 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 1101 "hemoglobin A alpha chain" 100.00 141 100.00 100.00 4.35e-95 BMRB 16891 HBA1 100.00 141 100.00 100.00 4.35e-95 BMRB 25 "hemoglobin A alpha chain" 100.00 141 100.00 100.00 4.35e-95 BMRB 2707 "hemoglobin A alpha chain" 100.00 141 100.00 100.00 4.35e-95 BMRB 2709 "hemoglobin A alpha chain" 100.00 141 100.00 100.00 4.35e-95 BMRB 2868 "hemoglobin A alpha chain" 100.00 141 100.00 100.00 4.35e-95 BMRB 3442 "hemoglobin A alpha chain" 100.00 141 100.00 100.00 4.35e-95 PDB 1A00 "Hemoglobin (Val Beta1 Met, Trp Beta37 Tyr) Mutant" 100.00 141 100.00 100.00 4.35e-95 PDB 1A01 "Hemoglobin (Val Beta1 Met, Trp Beta37 Ala) Mutant" 100.00 141 100.00 100.00 4.35e-95 PDB 1A0U "Hemoglobin (Val Beta1 Met) Mutant" 100.00 141 100.00 100.00 4.35e-95 PDB 1A0Z "Hemoglobin (Val Beta1 Met) Mutant" 100.00 141 100.00 100.00 4.35e-95 PDB 1A3N "Deoxy Human Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1A3O "Artificial Mutant (Alpha Y42h) Of Deoxy Hemoglobin" 100.00 141 99.29 100.00 4.26e-94 PDB 1A9W "Human Embryonic Gower Ii Carbonmonoxy Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1ABW "Deoxy Rhb1.1 (Recombinant Hemoglobin)" 100.00 283 99.29 100.00 1.68e-92 PDB 1ABY "Cyanomet Rhb1.1 (Recombinant Hemoglobin)" 100.00 283 99.29 100.00 1.68e-92 PDB 1AJ9 "R-State Human Carbonmonoxyhemoglobin Alpha-A53s" 100.00 141 99.29 100.00 1.09e-94 PDB 1B86 "Human Deoxyhaemoglobin-2,3-Diphosphoglycerate Complex" 100.00 141 100.00 100.00 4.35e-95 PDB 1BAB "Hemoglobin Thionville: An Alpha-Chain Variant With A Substitution Of A Glutamate For Valine At Na-1 And Having An Acetylated Me" 99.29 143 100.00 100.00 1.78e-94 PDB 1BBB "A Third Quaternary Structure Of Human Hemoglobin A At 1.7-angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1BIJ "Crosslinked, Deoxy Human Hemoglobin A" 100.00 141 100.00 100.00 4.35e-95 PDB 1BUW "Crystal Structure Of S-Nitroso-Nitrosyl Human Hemoglobin A" 100.00 141 100.00 100.00 4.35e-95 PDB 1BZ0 "Hemoglobin A (Human, Deoxy, High Salt)" 100.00 141 100.00 100.00 4.35e-95 PDB 1BZ1 "Hemoglobin (Alpha + Met) Variant" 100.00 142 100.00 100.00 4.44e-95 PDB 1BZZ "Hemoglobin (Alpha V1m) Mutant" 100.00 141 99.29 100.00 1.21e-94 PDB 1C7B "Deoxy Rhb1.0 (Recombinant Hemoglobin)" 100.00 141 99.29 100.00 1.21e-94 PDB 1C7C "Deoxy Rhb1.1 (Recombinant Hemoglobin)" 100.00 283 99.29 100.00 1.68e-92 PDB 1C7D "Deoxy Rhb1.2 (Recombinant Hemoglobin)" 100.00 284 99.29 100.00 1.96e-92 PDB 1CLS "Cross-Linked Human Hemoglobin Deoxy" 100.00 141 100.00 100.00 4.35e-95 PDB 1CMY "The Mutation Beta99 Asp-Tyr Stabilizes Y-A New, Composite Quaternary State Of Human Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1COH "Structure Of Haemoglobin In The Deoxy Quaternary State With Ligand Bound At The Alpha Haems" 100.00 141 100.00 100.00 4.35e-95 PDB 1DKE "Ni Beta Heme Human Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1DXT "High-Resolution X-Ray Study Of Deoxy Recombinant Human Hemoglobins Synthesized From Beta-Globins Having Mutated Amino Termini" 100.00 141 100.00 100.00 4.35e-95 PDB 1DXU "High-Resolution X-Ray Study Of Deoxy Recombinant Human Hemoglobins Synthesized From Beta-Globins Having Mutated Amino Termini" 100.00 141 100.00 100.00 4.35e-95 PDB 1DXV "High-resolution X-ray Study Of Deoxy Recombinant Human Hemoglobins Synthesized From Beta-globins Having Mutated Amino Termini" 100.00 141 100.00 100.00 4.35e-95 PDB 1FDH "Structure Of Human Foetal Deoxyhaemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1FN3 "Crystal Structure Of Nickel Reconstituted Hemoglobin-A Case For Permanent, T-State Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1G9V "High Resolution Crystal Structure Of Deoxy Hemoglobin Complexed With A Potent Allosteric Effector" 100.00 141 100.00 100.00 4.35e-95 PDB 1GBU "Deoxy (Beta-(C93a,C112g)) Human Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1GBV "(Alpha-Oxy, Beta-(C112g)deoxy) T-State Human Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1GLI "Deoxyhemoglobin T38w (alpha Chains), V1g (alpha And Beta Chains)" 100.00 141 98.58 99.29 1.56e-93 PDB 1GZX "Oxy T State Haemoglobin: Oxygen Bound At All Four Haems" 100.00 141 100.00 100.00 4.35e-95 PDB 1HAB "Crosslinked Haemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1HAC "Crosslinked Haemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1HBA "High-Resolution X-Ray Study Of Deoxyhemoglobin Rothschild 37beta Trp-> Arg: A Mutation That Creates An Intersubunit Chloride-Bi" 100.00 141 100.00 100.00 4.35e-95 PDB 1HBB "High-Resolution X-Ray Study Of Deoxyhemoglobin Rothschild 37beta Trp-> Arg: A Mutation That Creates An Intersubunit Chloride-Bi" 100.00 141 100.00 100.00 4.35e-95 PDB 1HBS "Refined Crystal Structure Of Deoxyhemoglobin S. I. Restrained Least-Squares Refinement At 3.0-Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1HCO "The Structure Of Human Carbonmonoxy Haemoglobin At 2.7 Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1HDB "Analysis Of The Crystal Structure, Molecular Modeling And Infrared Spectroscopy Of The Distal Beta-Heme Pocket Valine67(E11)-Th" 100.00 141 100.00 100.00 4.35e-95 PDB 1HGA "High Resolution Crystal Structures And Comparisons Of T State Deoxyhaemoglobin And Two Liganded T-state Haemoglobins: T(alpha-o" 100.00 141 100.00 100.00 4.35e-95 PDB 1HGB "High Resolution Crystal Structures And Comparisons Of T State Deoxyhaemoglobin And Two Liganded T-State Haemoglobins: T(Alpha-O" 100.00 141 100.00 100.00 4.35e-95 PDB 1HGC "High Resolution Crystal Structures And Comparisons Of T State Deoxyhaemoglobin And Two Liganded T-state Haemoglobins: T(alpha-o" 100.00 141 100.00 100.00 4.35e-95 PDB 1HHO "Structure Of Human Oxyhaemoglobin At 2.1 Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1IRD "Crystal Structure Of Human Carbonmonoxy-Haemoglobin At 1.25 A Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1J3Y "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Hemoglobin; Crystal Structure Of Alpha(Fe)-Beta(N" 100.00 141 100.00 100.00 4.35e-95 PDB 1J3Z "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Haemoglobin; Crystal Structure Of Alpha(Fe-Co)-Be" 100.00 141 100.00 100.00 4.35e-95 PDB 1J40 "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Haemoglobin; Crystal Structure Of Alpha(Ni)-Beta(" 100.00 141 100.00 100.00 4.35e-95 PDB 1J41 "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Haemoglobin; Crystal Structure Of Alpha(Ni)-Beta(" 100.00 141 100.00 100.00 4.35e-95 PDB 1J7S "Crystal Structure Of Deoxy Hbalphayq, A Mutant Of Hba" 100.00 141 97.87 98.58 3.18e-93 PDB 1J7W "Crystal Structure Of Deoxy Hbbetayq, A Site Directed Mutant Of Hba" 100.00 141 99.29 100.00 1.21e-94 PDB 1J7Y "Crystal Structure Of Partially Ligated Mutant Of Hba" 100.00 141 97.87 98.58 3.18e-93 PDB 1JY7 "The Structure Of Human Methemoglobin. The Variation Of A Theme" 100.00 141 100.00 100.00 4.35e-95 PDB 1K0Y "X-ray Crystallographic Analyses Of Symmetrical Allosteric Effectors Of Hemoglobin. Compounds Designed To Link Primary And Secon" 100.00 141 100.00 100.00 4.35e-95 PDB 1K1K "Structure Of Mutant Human Carbonmonoxyhemoglobin C (beta E6k) At 2.0 Angstrom Resolution In Phosphate Buffer." 100.00 141 100.00 100.00 4.35e-95 PDB 1KD2 "Crystal Structure Of Human Deoxyhemoglobin In Absence Of Any Anions" 100.00 141 100.00 100.00 4.35e-95 PDB 1LFL "Deoxy Hemoglobin (90% Relative Humidity)" 100.00 141 100.00 100.00 4.35e-95 PDB 1LFQ "Oxy Hemoglobin (93% Relative Humidity)" 100.00 141 100.00 100.00 4.35e-95 PDB 1LFT "Oxy Hemoglobin (90% Relative Humidity)" 100.00 141 100.00 100.00 4.35e-95 PDB 1LFV "Oxy Hemoglobin (88% Relative Humidity)" 100.00 141 100.00 100.00 4.35e-95 PDB 1LFY "Oxy Hemoglobin (84% Relative Humidity)" 100.00 141 100.00 100.00 4.35e-95 PDB 1LFZ "Oxy Hemoglobin (25% Methanol)" 100.00 141 100.00 100.00 4.35e-95 PDB 1LJW "Crystal Structure Of Human Carbonmonoxy Hemoglobin At 2.16 A: A Snapshot Of The Allosteric Transition" 100.00 141 100.00 100.00 4.35e-95 PDB 1M9P "Crystalline Human Carbonmonoxy Hemoglobin C Exhibits The R2 Quaternary State At Neutral Ph In The Presence Of Polyethylene Glyc" 100.00 141 100.00 100.00 4.35e-95 PDB 1MKO "A Fourth Quaternary Structure Of Human Hemoglobin A At 2.18 A Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1NEJ "Crystalline Human Carbonmonoxy Hemoglobin S (liganded Sickle Cell Hemoglobin) Exhibits The R2 Quaternary State At Neutral Ph In" 100.00 141 100.00 100.00 4.35e-95 PDB 1NIH "Structure Of Deoxy-Quaternary Haemoglobin With Liganded Beta Subunits" 100.00 141 100.00 100.00 4.35e-95 PDB 1NQP "Crystal Structure Of Human Hemoglobin E At 1.73 A Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1O1I "Cyanomet Hemoglobin (a-gly-c:v1m,l29f,h58q; B,d:v1m,l106w)" 100.00 141 97.87 98.58 2.79e-93 PDB 1O1J "Deoxy Hemoglobin (a-gly-c:v1m,l29f,h58q; B,d:v1m,l106w)" 100.00 283 97.87 98.58 3.08e-91 PDB 1O1K "Deoxy Hemoglobin (A,C:v1m; B,D:v1m,V67w)" 100.00 141 99.29 100.00 1.21e-94 PDB 1O1L "Deoxy Hemoglobin (A-Gly-C:v1m,L29w,H58q; B,D:v1m)" 100.00 283 97.87 98.58 6.81e-91 PDB 1O1M "Deoxy Hemoglobin (a-glyglygly-c:v1m,l29f,h58q B,d:v1m,v67w)" 100.00 285 97.87 98.58 3.70e-91 PDB 1O1N "Deoxy Hemoglobin (A-Glyglygly-C:v1m,L29w; B,D:v1m)" 100.00 285 98.58 99.29 1.43e-91 PDB 1O1O "Deoxy Hemoglobin (A,C:v1m,V62l; B,D:v1m,V67l)" 100.00 141 98.58 100.00 3.90e-94 PDB 1O1P "Deoxy Hemoglobin (A-Gly-C:v1m; B,D:v1m,C93a,N108k)" 100.00 283 99.29 100.00 1.68e-92 PDB 1QI8 "Deoxygenated Structure Of A Distal Pocket Hemoglobin Mutant" 100.00 141 97.87 98.58 3.18e-93 PDB 1QSH "Magnesium(Ii)-And Zinc(Ii)-Protoporphyrin Ix's Stabilize The Lowest Oxygen Affinity State Of Human Hemoglobin Even More Strongl" 100.00 141 100.00 100.00 4.35e-95 PDB 1QSI "Magnesium(Ii)-And Zinc(Ii)-Protoporphyrin Ix's Stabilize The Lowest Oxygen Affinity State Of Human Hemoglobin Even More Strongl" 100.00 141 100.00 100.00 4.35e-95 PDB 1QXD "Structural Basis For The Potent Antisickling Effect Of A Novel Class Of 5-Membered Heterocyclic Aldehydic Compounds" 100.00 141 100.00 100.00 4.35e-95 PDB 1QXE "Structural Basis For The Potent Antisickling Effect Of A Novel Class Of 5-Membered Heterocyclic Aldehydic Compounds" 100.00 141 100.00 100.00 4.35e-95 PDB 1R1X "Crystal Structure Of Oxy-Human Hemoglobin Bassett At 2.15 Angstrom" 100.00 141 99.29 99.29 6.89e-94 PDB 1R1Y "Crystal Structure Of Deoxy-Human Hemoglobin Bassett At 1.8 Angstrom" 100.00 141 99.29 99.29 6.89e-94 PDB 1RPS "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Hemoglobin. Hemoglobin Exposed To No Under" 100.00 141 100.00 100.00 4.35e-95 PDB 1RQ3 "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Deoxyhemoglobin, Deoxyhemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1RQ4 "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Hemoglobin, Hemoglobin Exposed To No Under" 100.00 141 100.00 100.00 4.35e-95 PDB 1RQA "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Hemoglobin. Beta W73e Hemoglobin Exposed T" 100.00 141 100.00 100.00 4.35e-95 PDB 1RVW "R State Human Hemoglobin [alpha V96w], Carbonmonoxy" 100.00 141 99.29 99.29 6.11e-94 PDB 1SDK "Cross-linked, Carbonmonoxy Hemoglobin A" 100.00 141 100.00 100.00 4.35e-95 PDB 1SDL "Cross-Linked, Carbonmonoxy Hemoglobin A" 100.00 141 100.00 100.00 4.35e-95 PDB 1SHR "Crystal Structure Of Ferrocyanide Bound Human Hemoglobin A2 At 1.88a Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1SI4 "Crystal Structure Of Human Hemoglobin A2 (In R2 State) At 2.2 A Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1THB "Refinement Of A Partially Oxygenated T State Haemoglobin At 1.5 Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 1UIW "Crystal Structures Of Unliganded And Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82beta1 And Lys 82beta" 100.00 141 100.00 100.00 4.35e-95 PDB 1VWT "T State Human Hemoglobin [alpha V96w], Alpha Aquomet, Beta Deoxy" 100.00 141 99.29 99.29 6.11e-94 PDB 1XXT "The T-To-T High Transitions In Human Hemoglobin: Wild-Type Deoxy Hb A (Low Salt, One Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1XY0 "T-To-Thigh Transitions In Human Hemoglobin: Alphak40g Deoxy Low-Salt" 100.00 141 98.58 99.29 1.02e-93 PDB 1XYE "T-to-thigh Transitions In Human Hemoglobin: Alpha Y42a Deoxy Low Salt" 100.00 141 98.58 99.29 2.94e-93 PDB 1XZ2 "Wild-Type Hemoglobin Deoxy No-Salt" 100.00 141 100.00 100.00 4.35e-95 PDB 1XZ4 "Intersubunit Interactions Associated With Tyr42alpha Stabilize The Quaternary-T Tetramer But Are Not Major Quaternary Constrain" 100.00 141 98.58 99.29 2.94e-93 PDB 1XZ5 "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphal91a Deoxy Low-Salt" 100.00 141 98.58 99.29 7.20e-94 PDB 1XZ7 "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphar92a Deoxy Low-Salt" 100.00 141 98.58 99.29 1.84e-93 PDB 1XZU "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphad94g Deoxy Low-Salt" 100.00 141 98.58 99.29 1.40e-93 PDB 1XZV "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphap95a Deoxy Low-Salt" 100.00 141 98.58 99.29 1.74e-93 PDB 1Y01 "Crystal Structure Of Ahsp Bound To Fe(Ii) Alpha-Hemoglobin" 100.00 142 100.00 100.00 4.44e-95 PDB 1Y09 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Alphan97a Deoxy Low-Salt" 100.00 141 98.58 99.29 2.22e-93 PDB 1Y0A "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphay140a Deoxy Low-Salt" 100.00 141 98.58 99.29 2.94e-93 PDB 1Y0C "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphay140f Deoxy Low-Salt" 100.00 141 98.58 100.00 4.96e-94 PDB 1Y0D "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Desarg141alpha Deoxy Low-Salt" 99.29 140 100.00 100.00 4.40e-94 PDB 1Y0T "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav1m Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y0W "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Betav1m Deoxy Low-Salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y22 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav33a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y2Z "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav34g Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y31 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y35 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35f Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y45 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap36a Deoxy Low-Salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y46 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37y Deoxy Low-Salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y4B "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37h Deoxy Low-Salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y4F "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37a Deoxy Low-Salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y4G "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37g Deoxy Low-Salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y4P "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37e Deoxy Low-Salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y4Q "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaf42a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y4R "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaf45a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y4V "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betac93a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y5F "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betal96a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y5J "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betah97a Deoxy Low-salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y5K "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betad99a Deoxy Low-salt (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y7C "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap100a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y7D "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betap100g Deoxy Low-salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y7G "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betan102a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y7Z "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betan108a Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y83 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay145g Deoxy Low-Salt (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y85 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Deshis146beta Deoxy Low-Salt" 100.00 141 100.00 100.00 4.35e-95 PDB 1Y8W "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Alphar92a Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" 100.00 141 98.58 99.29 1.84e-93 PDB 1YDZ "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Alphay140f Oxy (2mm Ihp, 20% Peg) (1 Test Set)" 100.00 141 98.58 100.00 4.96e-94 PDB 1YE0 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav33a Oxy (2mm Ihp, 20% Peg) (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YE1 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35a Oxy (2mm Ihp, 20% Peg) (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YE2 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35f Oxy (2mm Ihp, 20% Peg) (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YEN "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap36a Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YEO "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37a Oxy (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YEQ "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37y Oxy (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YEU "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37g Oxy (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YEV "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37e Oxy (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YFF "Structure Of Human Carbonmonoxyhemoglobin C (beta E6k): Two Quaternary States (r2 And R3) In One Crystal" 100.00 141 100.00 100.00 4.35e-95 PDB 1YG5 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37h Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YGD "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betaw37e Alpha Zinc Beta Oxy (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YGF "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betah97a Oxy (2mm Ihp, 20% Peg) (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YH9 "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Hba Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YHE "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Hba Oxy (5.0mm Ihp, 20% Peg) (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YHR "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Hba Oxy (10.0mm Ihp, 20% Peg) (10 Test Sets)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YIE "T-to-thigh Quaternary Transitions In Human Hemoglobin: Betaw37a Oxy (2.2mm Ihp, 13% Peg) (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YIH "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap100a Oxy (2.2mm Ihp, 20% Peg) (1 Test Set)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YVQ "The Low Salt (Peg) Crystal Structure Of Co Hemoglobin E (Betae26k) Approaching Physiological Ph (Ph 7.5)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YVT "The High Salt (Phosphate) Crystal Structure Of Co Hemoglobin E (Glu26lys) At Physiological Ph (Ph 7.35)" 100.00 141 100.00 100.00 4.35e-95 PDB 1YZI "A Novel Quaternary Structure Of Human Carbonmonoxy Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 1Z8U "Crystal Structure Of Oxidized Alpha Hemoglobin Bound To Ahsp" 100.00 142 100.00 100.00 4.44e-95 PDB 2D5Z "Crystal Structure Of T-State Human Hemoglobin Complexed With Three L35 Molecules" 100.00 141 100.00 100.00 4.35e-95 PDB 2D60 "Crystal Structure Of Deoxy Human Hemoglobin Complexed With Two L35 Molecules" 100.00 141 100.00 100.00 4.35e-95 PDB 2DN1 "1.25a Resolution Crystal Structure Of Human Hemoglobin In The Oxy Form" 100.00 141 100.00 100.00 4.35e-95 PDB 2DN2 "1.25a Resolution Crystal Structure Of Human Hemoglobin In The Deoxy Form" 100.00 141 100.00 100.00 4.35e-95 PDB 2DN3 "1.25a Resolution Crystal Structure Of Human Hemoglobin In The Carbonmonoxy Form" 100.00 141 100.00 100.00 4.35e-95 PDB 2DXM "Neutron Structure Analysis Of Deoxy Human Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 2H35 "Solution Structure Of Human Normal Adult Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 2HBC "High Resolution X-ray Structures Of Myoglobin-and Hemoglobin-alkyl Isocyanide Complexes" 100.00 141 100.00 100.00 4.35e-95 PDB 2HBD "High Resolution X-Ray Structures Of Myoglobin-And Hemoglobin-Alkyl Isocyanide Complexes" 100.00 141 100.00 100.00 4.35e-95 PDB 2HBE "High Resolution X-Ray Structures Of Myoglobin-And Hemoglobin-Alkyl Isocyanide Complexes" 100.00 141 100.00 100.00 4.35e-95 PDB 2HBF "High Resolution X-Ray Structures Of Myoglobin-And Hemoglobin-Alkyl Isocyanide Complexes" 100.00 141 100.00 100.00 4.35e-95 PDB 2HBS "The High Resolution Crystal Structure Of Deoxyhemoglobin S" 100.00 141 100.00 100.00 4.35e-95 PDB 2HCO "The Structure Of Human Carbonmonoxy Haemoglobin At 2.7 Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 2HHB "The Crystal Structure Of Human Deoxyhaemoglobin At 1.74 Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 2HHD "Oxygen Affinity Modulation By The N-Termini Of The Beta- Chains In Human And Bovine Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 2HHE "Oxygen Affinity Modulation By The N-Termini Of The Beta Chains In Human And Bovine Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 2M6Z "Refined Solution Structure Of Human Adult Hemoglobin In The Carbonmonoxy Form" 100.00 141 100.00 100.00 4.35e-95 PDB 2W6V "Structure Of Human Deoxy Hemoglobin A In Complex With Xenon" 100.00 141 100.00 100.00 4.35e-95 PDB 2W72 "Deoxygenated Structure Of A Distal Site Hemoglobin Mutant Plus Xe" 100.00 141 98.58 98.58 1.26e-93 PDB 2YRS "Human Hemoglobin D Los Angeles: Crystal Structure" 100.00 141 100.00 100.00 4.35e-95 PDB 3B75 "Crystal Structure Of Glycated Human Haemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 3D17 "A Triply Ligated Crystal Structure Of Relaxed State Human Hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 3D7O "Human Hemoglobin, Nitrogen Dioxide Anion Modified" 100.00 141 100.00 100.00 4.35e-95 PDB 3DUT "The High Salt (Phosphate) Crystal Structure Of Deoxy Hemoglobin E (Glu26lys) At Physiological Ph (Ph 7.35)" 100.00 141 100.00 100.00 4.35e-95 PDB 3HHB "The Crystal Structure Of Human Deoxyhaemoglobin At 1.74 Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 3HXN "The Structure Of Human Carbonmonoxyhemoglobin Complex To Ihp At 2.0 Angstrons Resolution." 100.00 141 100.00 100.00 4.35e-95 PDB 3IA3 "A Cis-Proline In Alpha-Hemoglobin Stabilizing Protein Directs The Structural Reorganization Of Alpha-Hemoglobin" 100.00 145 100.00 100.00 5.91e-95 PDB 3IC0 "Crystal Structure Of Liganded Hemoglobin In Complex With A Potent Antisickling Agent, Inn-298" 100.00 141 100.00 100.00 4.35e-95 PDB 3IC2 "Crystal Structure Of Liganded Hemoglobin In Complex With A Potent Antisickling Agent, Inn-266" 100.00 141 100.00 100.00 4.35e-95 PDB 3KMF "Room Temperature Time-Of-Flight Neutron Diffraction Study Of Deoxy Human Normal Adult Hemoglobin" 98.58 141 100.00 100.00 2.08e-93 PDB 3NL7 "Human Hemoglobin A Mutant Beta H63w Carbonmonoxy-Form" 100.00 141 100.00 100.00 4.35e-95 PDB 3NMM "Human Hemoglobin A Mutant Alpha H58w Deoxy-Form" 100.00 141 99.29 99.29 8.67e-94 PDB 3ODQ "Structure Of A Crystal Form Of Human Methemoglobin Indicative Of Fiber Formation" 100.00 141 100.00 100.00 4.35e-95 PDB 3ONZ "Human Tetrameric Hemoglobin: Proximal Nitrite Ligand At Beta" 100.00 141 100.00 100.00 4.35e-95 PDB 3OO4 "R-State Human Hemoglobin: Nitriheme Modified At Alpha" 100.00 141 100.00 100.00 4.35e-95 PDB 3OO5 "R-State Human Hemoglobin: Nitriheme Modified" 100.00 141 100.00 100.00 4.35e-95 PDB 3OVU "Crystal Structure Of Human Alpha-Haemoglobin Complexed With Ahsp And The First Neat Domain Of Isdh From Staphylococcus Aureus" 100.00 141 100.00 100.00 4.35e-95 PDB 3P5Q "Ferric R-State Human Aquomethemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 3QJB "Human Hemoglobin A Mutant Alpha H58l Carbonmonoxy-Form" 100.00 141 99.29 99.29 1.15e-93 PDB 3QJC "Human Hemoglobin A Mutant Beta H63l Carbonmonoxy-Form" 100.00 141 100.00 100.00 4.35e-95 PDB 3QJD "Human Hemoglobin A Mutant Alpha H58l Deoxy-Form" 100.00 141 99.29 99.29 1.15e-93 PDB 3QJE "Human Hemoglobin A Mutant Beta H63l Deoxy-Form" 100.00 141 100.00 100.00 4.35e-95 PDB 3R5I "Crystal Structure Of Liganded Hemoglobin Complexed With A Potent Antisickling Agent, Inn-312" 100.00 141 100.00 100.00 4.35e-95 PDB 3S48 "Human Alpha-haemoglobin Complexed With The First Neat Domain Of Isdh From Staphylococcus Aureus" 100.00 141 100.00 100.00 4.35e-95 PDB 3S65 "Structures And Oxygen Affinities Of Crystalline Human Hemoglobin C (Beta6 Lys) In The R2 Quaternary Structures" 100.00 141 100.00 100.00 4.35e-95 PDB 3S66 "Structures And Oxygen Affinities Of Crystalline Human Hemoglobin C (Beta6 Lys) In The R Quaternary Structures" 100.00 141 100.00 100.00 4.35e-95 PDB 3SZK "Crystal Structure Of Human Methaemoglobin Complexed With The First Neat Domain Of Isdh From Staphylococcus Aureus" 100.00 141 100.00 100.00 4.35e-95 PDB 3WCP "Deoxyhemoglobin Sh-drug Complex" 100.00 141 100.00 100.00 4.35e-95 PDB 3WHM "Structure Of Hemoglobin Complex With 18-crown-6" 100.00 141 100.00 100.00 4.35e-95 PDB 4FC3 "Crystal Structure Of Human Methaemoglobin Complexed With The Second Neat Domain Of Isdh From Staphylococcus Aureus" 100.00 141 100.00 100.00 4.35e-95 PDB 4HHB "The Crystal Structure Of Human Deoxyhaemoglobin At 1.74 Angstroms Resolution" 100.00 141 100.00 100.00 4.35e-95 PDB 4IJ2 "Human Methemoglobin In Complex With The Second And Third Neat Domains Of Isdh From Staphylococcus Aureus" 100.00 141 100.00 100.00 4.35e-95 PDB 4L7Y "Deoxygenated Hb In Complex With The Allosteric Effectors, Irl2500 And 2,3-dpg" 100.00 141 100.00 100.00 4.35e-95 PDB 4M4A "Human Hemoglobin Nitromethane Modified" 100.00 141 100.00 100.00 4.35e-95 PDB 4M4B "Human Hemoglobin Nitroethane Modified" 100.00 141 100.00 100.00 4.35e-95 PDB 4MQC "Carbonmonoxy Structure Of Hemoglobin Evans Alphav62mbetawt" 100.00 141 99.29 100.00 1.21e-94 PDB 4MQG "Structure Of Carbonmonoxy Adult Hemoglobin Bristol-alesha Alphawtbetav67m" 100.00 141 100.00 100.00 4.35e-95 PDB 4MQH "Structure Of Aquomet Hemoglobin Evans Alphav62mbetawt" 98.58 139 99.28 100.00 1.53e-92 PDB 4MQI "Structure Of Aquomet Hemoglobin Bristol-alesha Alphawtbetav67m" 99.29 140 100.00 100.00 4.40e-94 PDB 4MQJ "Structure Of Wild-type Fetal Human Hemoglobin Hbf" 100.00 141 100.00 100.00 4.35e-95 PDB 4MQK "Carbonmonoxy Structure Of The Human Fetal Hemoglobin Mutant Hbf Toms River Alphawtgammav67m" 100.00 141 100.00 100.00 4.35e-95 PDB 4N7N "Capturing The Haemoglobin Allosteric Transition In A Single Crystal Form; Crystal Structure Of Full-liganded Human Haemoglobin " 100.00 141 100.00 100.00 4.35e-95 PDB 4N7O "Capturing The Haemoglobin Allosteric Transition In A Single Crystal Form; Crystal Structure Of Half-liganded Human Haemoglobin " 100.00 141 100.00 100.00 4.35e-95 PDB 4N7P "Capturing The Haemoglobin Allosteric Transition In A Single Crystal Form; Crystal Structure Of Half-liganded Human Haemoglobin " 100.00 141 100.00 100.00 4.35e-95 PDB 4N8T "Human Hemoglobin Nitric Oxide Adduct" 100.00 141 100.00 100.00 4.35e-95 PDB 4NI0 "Quaternary R3 Co-liganded Hemoglobin Structure In Complex With A Thiol Containing Compound" 100.00 141 100.00 100.00 4.35e-95 PDB 4NI1 "Qauternary R Co-liganded Hemoglobin Structure In Complex With A Thiol Containing Compound" 100.00 141 100.00 100.00 4.35e-95 PDB 4ROL "Deoxyhemoglobin In Complex With Imidazolylacryloyl Derivatives" 100.00 141 100.00 100.00 4.35e-95 PDB 4ROM "Deoxyhemoglobin In Complex With Imidazolylacryloyl Derivatives" 100.00 141 100.00 100.00 4.35e-95 PDB 4WJG "Structure Of T. Brucei Haptoglobin-hemoglobin Receptor Binding To Human Haptoglobin-hemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 4X0I "Trypanosoma Brucei Haptoglobin-haemoglobin Receptor In Complex With Human Haptoglobin-haemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 4X0L "Human Haptoglobin-haemoglobin Complex" 100.00 141 100.00 100.00 4.35e-95 PDB 4XS0 "Human Methemoglobin In Complex With The Second And Third Neat Domains Of Isdh(f365y/a369f/y642a) From Staphylococcus Aureus" 100.00 141 100.00 100.00 4.35e-95 PDB 5E29 "Crystal Structure Of Deoxygenated Hemoglobin In Complex With An Allosteric Effector And Nitric Oxide" 100.00 141 100.00 100.00 4.35e-95 PDB 5EE4 "The Crystal Structure Of Hpua From Kingella Denitrificans In Complex With Human Haemoglobin" 100.00 141 100.00 100.00 4.35e-95 PDB 6HBW "Crystal Structure Of Deoxy-human Hemoglobin Beta6 Glu->trp" 100.00 141 100.00 100.00 4.35e-95 DBJ BAD97112 "alpha 2 globin variant [Homo sapiens]" 100.00 142 99.29 100.00 4.22e-94 DBJ BAJ20323 "hemoglobin, alpha 1 [synthetic construct]" 100.00 142 100.00 100.00 4.44e-95 EMBL CAA23748 "alpha globin [Homo sapiens]" 100.00 142 100.00 100.00 4.44e-95 EMBL CAA23750 "alpha 1 globin [Homo sapiens]" 100.00 141 100.00 100.00 4.35e-95 EMBL CAA23751 "unnamed protein product [Homo sapiens]" 60.28 85 100.00 100.00 2.96e-50 EMBL CAA23752 "hemoglobin alpha chain [Homo sapiens]" 100.00 142 100.00 100.00 4.44e-95 EMBL CAA23774 "alpha-2-globin [Homo sapiens]" 100.00 141 100.00 100.00 4.35e-95 GB AAA52632 "pseudo-a-thal, partial [Homo sapiens]" 60.28 85 100.00 100.00 2.96e-50 GB AAA66030 "alpha-2 globin [Pongo pygmaeus]" 100.00 142 97.87 98.58 9.90e-93 GB AAA66031 "alpha-2 globin [Pongo pygmaeus]" 100.00 142 97.87 98.58 9.90e-93 GB AAB59407 "hemoglobin alpha 2 [Homo sapiens]" 100.00 142 100.00 100.00 4.44e-95 GB AAB59408 "hemoglobin alpha 1 [Homo sapiens]" 100.00 142 100.00 100.00 4.44e-95 PRF 0404170A "hemoglobin alphaI" 100.00 141 97.87 98.58 1.03e-92 PRF 0907233A "hemoglobin alpha" 100.00 141 100.00 100.00 4.35e-95 PRF 1004272B "hemoglobin alpha" 100.00 141 97.16 99.29 2.37e-92 PRF 1509322A "hemoglobin alpha" 100.00 141 97.16 97.16 8.42e-92 PRF 610524A "hemoglobin alpha" 100.00 141 99.29 100.00 1.86e-94 REF NP_000508 "hemoglobin subunit alpha [Homo sapiens]" 100.00 142 100.00 100.00 4.44e-95 REF NP_000549 "hemoglobin subunit alpha [Homo sapiens]" 100.00 142 100.00 100.00 4.44e-95 REF NP_001036091 "hemoglobin subunit alpha [Pan troglodytes]" 100.00 142 100.00 100.00 4.44e-95 REF NP_001036092 "hemoglobin subunit alpha [Pan troglodytes]" 100.00 142 100.00 100.00 4.44e-95 REF NP_001125901 "hemoglobin subunit alpha [Pongo abelii]" 100.00 142 100.00 100.00 4.44e-95 SP P01923 "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain" 100.00 141 99.29 100.00 1.86e-94 SP P01924 "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain" 100.00 141 97.87 98.58 8.68e-93 SP P06635 "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain" 100.00 142 97.87 98.58 9.90e-93 SP P18972 "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain" 100.00 141 97.16 99.29 2.37e-92 SP P21766 "RecName: Full=Hemoglobin subunit alpha-1/2/3; AltName: Full=Alpha-1/2/3-globin; AltName: Full=Hemoglobin alpha-1/2/3 chain" 100.00 141 97.16 97.87 2.48e-91 stop_ save_ save_AHSP _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common AHSP _Molecular_mass . _Mol_thiol_state 'not present' _Details . _Residue_count 102 _Mol_residue_sequence ; MALLKANKDLISAGLKEFSV LLNQQVFNDPLVSEEDMVTV VEDWMNFYINYYRQQVTGEP QERDKALQELRQELNTLANP FLAKYRDFLKSHELPSHPPP SS ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 LEU 4 LEU 5 LYS 6 ALA 7 ASN 8 LYS 9 ASP 10 LEU 11 ILE 12 SER 13 ALA 14 GLY 15 LEU 16 LYS 17 GLU 18 PHE 19 SER 20 VAL 21 LEU 22 LEU 23 ASN 24 GLN 25 GLN 26 VAL 27 PHE 28 ASN 29 ASP 30 PRO 31 LEU 32 VAL 33 SER 34 GLU 35 GLU 36 ASP 37 MET 38 VAL 39 THR 40 VAL 41 VAL 42 GLU 43 ASP 44 TRP 45 MET 46 ASN 47 PHE 48 TYR 49 ILE 50 ASN 51 TYR 52 TYR 53 ARG 54 GLN 55 GLN 56 VAL 57 THR 58 GLY 59 GLU 60 PRO 61 GLN 62 GLU 63 ARG 64 ASP 65 LYS 66 ALA 67 LEU 68 GLN 69 GLU 70 LEU 71 ARG 72 GLN 73 GLU 74 LEU 75 ASN 76 THR 77 LEU 78 ALA 79 ASN 80 PRO 81 PHE 82 LEU 83 ALA 84 LYS 85 TYR 86 ARG 87 ASP 88 PHE 89 LEU 90 LYS 91 SER 92 HIS 93 GLU 94 LEU 95 PRO 96 SER 97 HIS 98 PRO 99 PRO 100 PRO 101 SER 102 SER stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-30 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 1W09 "Solution Structure Of The Cis Form Of The Human Alpha- Hemoglobin Stabilizing Protein (Ahsp)" 90.20 92 100.00 100.00 2.62e-59 PDB 1W0A "Solution Structure Of The Trans Form Of The Human Alpha- Hemoglobin Stabilizing Protein (Ahsp)" 90.20 92 100.00 100.00 2.62e-59 PDB 1W0B "Solution Structure Of The Human Alpha-Hemoglobin Stabilizing Protein (Ahsp) P30a Mutant" 99.02 102 99.01 99.01 6.20e-66 PDB 1XZY "Solution Structure Of The P30-Trans Form Of Alpha Hemoglobin Stabilizing Protein (Ahsp)" 88.24 90 100.00 100.00 9.01e-58 PDB 1Y01 "Crystal Structure Of Ahsp Bound To Fe(Ii) Alpha-Hemoglobin" 100.00 102 99.02 99.02 8.80e-67 PDB 1Z8U "Crystal Structure Of Oxidized Alpha Hemoglobin Bound To Ahsp" 100.00 102 99.02 99.02 8.80e-67 PDB 3IA3 "A Cis-Proline In Alpha-Hemoglobin Stabilizing Protein Directs The Structural Reorganization Of Alpha-Hemoglobin" 89.22 91 100.00 100.00 1.79e-58 PDB 3OVU "Crystal Structure Of Human Alpha-Haemoglobin Complexed With Ahsp And The First Neat Domain Of Isdh From Staphylococcus Aureus" 99.02 101 100.00 100.00 7.49e-67 GB AAF64279 "EDRF [Homo sapiens]" 100.00 102 100.00 100.00 8.53e-68 GB AAH35842 "Erythroid associated factor [Homo sapiens]" 100.00 102 100.00 100.00 8.53e-68 GB AAK50856 "erythroid associated factor [Homo sapiens]" 100.00 102 100.00 100.00 8.53e-68 GB AAL82894 "EDRF [Homo sapiens]" 100.00 102 98.04 99.02 1.83e-66 GB AAO49381 "erythroid associated factor [Homo sapiens]" 100.00 102 100.00 100.00 8.53e-68 REF NP_057717 "alpha-hemoglobin-stabilizing protein [Homo sapiens]" 100.00 102 100.00 100.00 8.53e-68 REF XP_002834076 "PREDICTED: alpha-hemoglobin-stabilizing protein [Pongo abelii]" 100.00 102 98.04 99.02 3.52e-66 REF XP_003807554 "PREDICTED: alpha-hemoglobin-stabilizing protein [Pan paniscus]" 100.00 102 100.00 100.00 8.53e-68 REF XP_004057613 "PREDICTED: alpha-hemoglobin-stabilizing protein isoform 1 [Gorilla gorilla gorilla]" 100.00 102 99.02 100.00 1.41e-67 REF XP_004057614 "PREDICTED: alpha-hemoglobin-stabilizing protein isoform 2 [Gorilla gorilla gorilla]" 100.00 102 99.02 100.00 1.41e-67 SP Q9NZD4 "RecName: Full=Alpha-hemoglobin-stabilizing protein; AltName: Full=Erythroid differentiation-related factor; AltName: Full=Eryth" 100.00 102 100.00 100.00 8.53e-68 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $HBA1 Human 9606 Eukaryota Metazoa Homo sapiens $AHSP Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $HBA1 'recombinant technology' . Escherichia coli . pHE7 $AHSP 'recombinant technology' . Escherichia coli . pGEX-2T stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $HBA1 . mM 0.6 1 '[U-98% 13C; U-98% 15N]' $AHSP . mM 0.6 1 'natural abundance' D2O 7 % . . 'natural abundance' DSS 40 uM . . 'natural abundance' H2O 93 % . . 'natural abundance' 'sodium phosphate' 20 mM . . 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . Goddard . . stop_ loop_ _Task 'chemical shift assignment' collection stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HNCA_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 20 . mM pH 7.0 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0 external indirect . . . 0.25144953 DSS H 1 'methyl protons' ppm 0 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0 external indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D HNCA' '3D CBCA(CO)NH' '3D HNCACB' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'alpha globin polypeptide' _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 3 SER H H 9.794 0.001 1 2 3 3 SER CA C 56.897 0.039 1 3 3 3 SER N N 123.513 0.001 1 4 6 6 ASP H H 8.074 0.001 1 5 6 6 ASP CA C 57.635 0.039 1 6 6 6 ASP N N 118.112 0.008 1 7 7 7 LYS H H 8.261 0.001 1 8 7 7 LYS CA C 61.373 0.002 1 9 7 7 LYS N N 118.774 0.011 1 10 8 8 THR H H 8.189 0.002 1 11 8 8 THR CA C 66.854 0.039 1 12 8 8 THR N N 116.503 0.045 1 13 10 10 VAL H H 8.541 0.001 1 14 10 10 VAL CA C 66.846 0.012 1 15 10 10 VAL N N 120.532 0.017 1 16 11 11 LYS H H 8.022 0.002 1 17 11 11 LYS CA C 60.225 0.040 1 18 11 11 LYS N N 118.032 0.019 1 19 12 12 ALA H H 8.305 0.002 1 20 12 12 ALA CA C 54.806 0.000 1 21 12 12 ALA N N 121.859 0.027 1 22 14 14 TRP H H 8.995 0.001 1 23 14 14 TRP CA C 60.191 0.011 1 24 14 14 TRP N N 117.755 0.000 1 25 15 15 GLY H H 8.079 0.009 1 26 15 15 GLY CA C 46.741 0.003 1 27 15 15 GLY N N 105.277 0.018 1 28 16 16 LYS H H 7.416 0.007 1 29 16 16 LYS CA C 57.008 0.008 1 30 16 16 LYS N N 119.672 0.064 1 31 17 17 VAL H H 7.636 0.004 1 32 17 17 VAL CA C 65.796 0.021 1 33 17 17 VAL N N 120.131 0.006 1 34 18 18 GLY H H 7.380 0.004 1 35 18 18 GLY CA C 47.023 0.000 1 36 18 18 GLY N N 103.738 0.014 1 37 20 20 HIS H H 7.751 0.007 1 38 20 20 HIS CA C 55.836 0.024 1 39 20 20 HIS N N 115.143 0.117 1 40 21 21 ALA H H 7.199 0.203 1 41 21 21 ALA CA C 56.291 0.050 1 42 21 21 ALA CB C 17.937 0.000 1 43 21 21 ALA N N 121.580 0.470 1 44 22 22 GLY H H 8.493 0.005 1 45 22 22 GLY CA C 47.273 0.010 1 46 22 22 GLY N N 104.484 0.032 1 47 23 23 GLU H H 7.759 0.007 1 48 23 23 GLU CA C 58.843 0.001 1 49 23 23 GLU N N 123.980 0.029 1 50 24 24 TYR H H 7.935 0.008 1 51 24 24 TYR CA C 57.199 0.007 1 52 24 24 TYR N N 120.098 0.028 1 53 25 25 GLY H H 8.716 0.010 1 54 25 25 GLY CA C 46.704 0.021 1 55 25 25 GLY N N 107.988 0.019 1 56 26 26 ALA H H 7.753 0.005 1 57 26 26 ALA CA C 54.851 0.053 1 58 26 26 ALA CB C 19.064 0.000 1 59 26 26 ALA N N 121.994 0.016 1 60 27 27 GLU H H 7.817 0.004 1 61 27 27 GLU CA C 59.053 0.022 1 62 27 27 GLU N N 118.282 0.017 1 63 28 28 ALA H H 8.290 0.002 1 64 28 28 ALA CA C 55.434 0.011 1 65 28 28 ALA N N 121.904 0.033 1 66 29 29 LEU H H 7.171 0.001 1 67 29 29 LEU CA C 57.509 0.048 1 68 29 29 LEU N N 117.127 0.025 1 69 30 30 GLU H H 7.710 0.004 1 70 30 30 GLU CA C 60.492 0.054 1 71 30 30 GLU N N 115.670 0.004 1 72 31 31 ARG H H 8.433 0.006 1 73 31 31 ARG CA C 58.947 0.032 1 74 31 31 ARG N N 119.145 0.040 1 75 32 32 MET H H 8.076 0.002 1 76 32 32 MET CA C 60.471 0.065 1 77 32 32 MET N N 123.227 0.015 1 78 33 33 PHE H H 8.009 0.003 1 79 33 33 PHE CA C 58.029 0.014 1 80 33 33 PHE N N 117.371 0.006 1 81 34 34 LEU H H 7.561 0.002 1 82 34 34 LEU CA C 57.002 0.021 1 83 34 34 LEU N N 116.624 0.009 1 84 35 35 SER H H 8.726 0.003 1 85 35 35 SER CA C 62.059 0.019 1 86 35 35 SER N N 114.536 0.006 1 87 36 36 PHE H H 8.440 0.002 1 88 36 36 PHE CA C 54.608 0.000 1 89 36 36 PHE N N 118.722 0.004 1 90 38 38 THR H H 8.700 0.003 1 91 38 38 THR CA C 65.791 0.000 1 92 38 38 THR N N 115.191 0.007 1 93 39 39 THR H H 9.021 0.001 1 94 39 39 THR CA C 66.562 0.007 1 95 39 39 THR N N 114.407 0.018 1 96 40 40 LYS H H 7.849 0.005 1 97 40 40 LYS CA C 59.731 0.012 1 98 40 40 LYS N N 118.306 0.010 1 99 41 41 THR H H 7.975 0.002 1 100 41 41 THR CA C 64.868 0.002 1 101 41 41 THR N N 111.627 0.016 1 102 42 42 TYR H H 7.417 0.002 1 103 42 42 TYR CA C 60.277 0.040 1 104 42 42 TYR N N 116.560 0.014 1 105 43 43 PHE H H 7.851 0.002 1 106 43 43 PHE CA C 55.293 0.000 1 107 43 43 PHE N N 116.628 0.039 1 108 44 44 PRO CA C 65.517 0.000 1 109 45 45 HIS H H 9.893 0.002 1 110 45 45 HIS CA C 55.512 0.000 1 111 45 45 HIS N N 117.478 0.027 1 112 46 46 PHE H H 7.559 0.000 1 113 46 46 PHE CA C 55.203 0.021 1 114 46 46 PHE N N 122.931 0.009 1 115 47 47 ASP H H 7.809 0.001 1 116 47 47 ASP CA C 53.544 0.000 1 117 47 47 ASP N N 118.995 0.026 1 118 48 48 LEU H H 8.608 0.001 1 119 48 48 LEU CA C 53.511 0.006 1 120 48 48 LEU N N 127.998 0.022 1 121 49 49 SER H H 8.304 0.005 1 122 49 49 SER CA C 59.231 0.000 1 123 49 49 SER N N 117.640 0.004 1 124 51 51 GLY H H 9.453 0.003 1 125 51 51 GLY CA C 45.279 0.011 1 126 51 51 GLY N N 116.958 0.010 1 127 52 52 SER H H 7.515 0.004 1 128 52 52 SER CA C 57.156 0.070 1 129 52 52 SER CB C 64.689 0.000 1 130 52 52 SER N N 114.647 0.025 1 131 54 54 GLN H H 8.334 0.002 1 132 54 54 GLN CA C 58.829 0.006 1 133 54 54 GLN N N 119.700 0.016 1 134 55 55 VAL H H 7.493 0.002 1 135 55 55 VAL CA C 67.246 0.020 1 136 55 55 VAL N N 121.836 0.014 1 137 56 56 LYS H H 7.905 0.003 1 138 56 56 LYS CA C 59.842 0.012 1 139 56 56 LYS N N 120.153 0.009 1 140 57 57 GLY H H 8.213 0.012 1 141 57 57 GLY CA C 46.636 0.083 1 142 57 57 GLY N N 105.904 0.052 1 143 58 58 HIS H H 8.056 0.008 1 144 58 58 HIS CA C 59.962 0.011 1 145 58 58 HIS N N 124.127 0.035 1 146 59 59 GLY H H 8.571 0.001 1 147 59 59 GLY CA C 46.441 0.006 1 148 59 59 GLY N N 105.707 0.007 1 149 60 60 LYS H H 7.001 0.006 1 150 60 60 LYS CA C 59.368 0.009 1 151 60 60 LYS N N 119.553 0.028 1 152 61 61 LYS H H 6.875 0.005 1 153 61 61 LYS CA C 60.072 0.023 1 154 61 61 LYS N N 118.432 0.203 1 155 62 62 VAL H H 7.515 0.001 1 156 62 62 VAL CA C 66.896 0.028 1 157 62 62 VAL N N 119.931 0.007 1 158 63 63 ALA H H 8.134 0.004 1 159 63 63 ALA CA C 55.918 0.031 1 160 63 63 ALA N N 120.816 0.007 1 161 64 64 ASP H H 8.870 0.001 1 162 64 64 ASP CA C 57.676 0.036 1 163 64 64 ASP N N 119.898 0.008 1 164 65 65 ALA H H 8.208 0.000 1 165 65 65 ALA CA C 55.376 0.020 1 166 65 65 ALA N N 124.165 0.022 1 167 66 66 LEU H H 8.454 0.003 1 168 66 66 LEU CA C 57.837 0.064 1 169 66 66 LEU N N 119.746 0.027 1 170 67 67 THR H H 9.180 0.001 1 171 67 67 THR CA C 67.062 0.002 1 172 67 67 THR N N 118.671 0.031 1 173 68 68 ASN H H 7.961 0.002 1 174 68 68 ASN CA C 56.453 0.000 1 175 68 68 ASN N N 120.694 0.009 1 176 69 69 ALA H H 8.268 0.001 1 177 69 69 ALA CA C 56.042 0.062 1 178 69 69 ALA N N 123.191 0.002 1 179 70 70 VAL H H 8.203 0.004 1 180 70 70 VAL CA C 66.887 0.005 1 181 70 70 VAL N N 117.113 0.070 1 182 71 71 ALA H H 7.743 0.008 1 183 71 71 ALA CA C 54.231 0.038 1 184 71 71 ALA CB C 17.644 0.000 1 185 71 71 ALA N N 120.592 0.034 1 186 72 72 HIS H H 7.652 0.003 1 187 72 72 HIS CA C 55.013 0.180 1 188 72 72 HIS CB C 28.156 0.000 1 189 72 72 HIS N N 116.177 0.032 1 190 73 73 VAL H H 6.774 0.005 1 191 73 73 VAL CA C 65.271 0.108 1 192 73 73 VAL N N 119.790 0.018 1 193 74 74 ASP H H 8.247 0.014 1 194 74 74 ASP CA C 55.284 0.000 1 195 74 74 ASP N N 119.025 0.045 1 196 75 75 ASP H H 8.400 0.006 1 197 75 75 ASP CA C 52.995 0.013 1 198 75 75 ASP N N 122.551 0.021 1 199 76 76 MET H H 8.662 0.103 1 200 76 76 MET CA C 61.605 0.000 1 201 76 76 MET N N 122.418 0.179 1 202 77 77 PRO CA C 66.720 0.000 1 203 78 78 ASN H H 7.531 0.001 1 204 78 78 ASN CA C 55.574 0.011 1 205 78 78 ASN N N 113.218 0.018 1 206 79 79 ALA H H 7.766 0.001 1 207 79 79 ALA CA C 54.169 0.000 1 208 79 79 ALA N N 120.760 0.012 1 209 80 80 LEU H H 7.788 0.002 1 210 80 80 LEU CA C 54.333 0.000 1 211 80 80 LEU N N 114.040 0.007 1 212 81 81 SER H H 7.587 0.006 1 213 81 81 SER CA C 62.744 0.000 1 214 81 81 SER N N 117.386 0.002 1 215 83 83 LEU H H 7.659 0.002 1 216 83 83 LEU CA C 56.292 0.000 1 217 83 83 LEU N N 119.133 0.003 1 218 85 85 ASP H H 7.542 0.002 1 219 85 85 ASP CA C 57.594 0.000 1 220 85 85 ASP N N 119.709 0.004 1 221 86 86 LEU H H 7.399 0.000 1 222 86 86 LEU CA C 57.840 0.000 1 223 86 86 LEU N N 117.893 0.010 1 224 89 89 HIS H H 7.623 0.002 1 225 89 89 HIS CA C 57.267 0.068 1 226 89 89 HIS N N 112.724 0.001 1 227 90 90 LYS H H 7.235 0.004 1 228 90 90 LYS CA C 58.144 0.033 1 229 90 90 LYS N N 118.421 0.053 1 230 91 91 LEU H H 7.428 0.004 1 231 91 91 LEU CA C 54.875 0.029 1 232 91 91 LEU N N 114.921 0.048 1 233 92 92 ARG H H 6.412 0.001 1 234 92 92 ARG CA C 56.533 0.032 1 235 92 92 ARG N N 113.035 0.017 1 236 93 93 VAL H H 7.706 0.002 1 237 93 93 VAL CA C 62.599 0.001 1 238 93 93 VAL N N 119.163 0.020 1 239 94 94 ASP H H 7.328 0.001 1 240 94 94 ASP CA C 52.801 0.000 1 241 94 94 ASP N N 128.553 0.011 1 242 96 96 VAL H H 8.596 0.001 1 243 96 96 VAL CA C 65.521 0.015 1 244 96 96 VAL N N 122.934 0.009 1 245 97 97 ASN H H 7.885 0.005 1 246 97 97 ASN CA C 56.355 0.062 1 247 97 97 ASN N N 115.077 0.004 1 248 98 98 PHE H H 7.755 0.001 1 249 98 98 PHE CA C 61.975 0.058 1 250 98 98 PHE N N 118.848 0.026 1 251 99 99 LYS H H 7.510 0.005 1 252 99 99 LYS CA C 59.629 0.014 1 253 99 99 LYS N N 119.249 0.076 1 254 100 100 LEU H H 7.168 0.004 1 255 100 100 LEU CA C 57.473 0.000 1 256 100 100 LEU N N 118.621 0.021 1 257 102 102 SER H H 8.454 0.002 1 258 102 102 SER CA C 64.460 0.040 1 259 102 102 SER N N 115.727 0.022 1 260 103 103 HIS H H 7.854 0.003 1 261 103 103 HIS CA C 60.680 0.032 1 262 103 103 HIS N N 120.124 0.007 1 263 104 104 CYS H H 7.995 0.006 1 264 104 104 CYS CA C 64.672 0.035 1 265 104 104 CYS N N 115.704 0.015 1 266 105 105 LEU H H 9.075 0.002 1 267 105 105 LEU CA C 58.532 0.000 1 268 105 105 LEU N N 124.491 0.013 1 269 106 106 LEU H H 8.564 0.001 1 270 106 106 LEU CA C 58.623 0.037 1 271 106 106 LEU N N 121.479 0.002 1 272 107 107 VAL H H 8.265 0.003 1 273 107 107 VAL CA C 66.021 0.000 1 274 107 107 VAL N N 116.973 0.030 1 275 108 108 THR H H 7.377 0.004 1 276 108 108 THR CA C 67.356 0.015 1 277 108 108 THR N N 116.394 0.052 1 278 109 109 LEU H H 8.169 0.002 1 279 109 109 LEU CA C 58.517 0.000 1 280 109 109 LEU N N 120.861 0.043 1 281 112 112 HIS H H 7.098 0.000 1 282 112 112 HIS CA C 57.147 0.049 1 283 112 112 HIS N N 112.963 0.000 1 284 113 113 LEU H H 7.608 0.005 1 285 113 113 LEU CA C 53.342 0.000 1 286 113 113 LEU N N 121.022 0.035 1 287 114 114 PRO CA C 64.611 0.000 1 288 115 115 ALA H H 8.353 0.003 1 289 115 115 ALA CA C 53.876 0.053 1 290 115 115 ALA N N 119.649 0.051 1 291 116 116 GLU H H 8.004 0.005 1 292 116 116 GLU CA C 57.361 0.025 1 293 116 116 GLU N N 114.960 0.047 1 294 117 117 PHE H H 8.166 0.004 1 295 117 117 PHE CA C 58.711 0.066 1 296 117 117 PHE N N 122.106 0.056 1 297 118 118 THR H H 7.642 0.003 1 298 118 118 THR CA C 61.105 0.000 1 299 118 118 THR N N 118.760 0.020 1 300 120 120 ALA H H 7.833 0.000 1 301 120 120 ALA CA C 55.190 0.069 1 302 120 120 ALA N N 119.133 0.000 1 303 121 121 VAL H H 7.365 0.002 1 304 121 121 VAL CA C 67.127 0.053 1 305 121 121 VAL N N 121.550 0.022 1 306 122 122 HIS H H 8.588 0.004 1 307 122 122 HIS CA C 61.421 0.016 1 308 122 122 HIS N N 120.226 0.040 1 309 123 123 ALA H H 7.988 0.003 1 310 123 123 ALA CA C 55.224 0.006 1 311 123 123 ALA N N 119.715 0.003 1 312 124 124 SER H H 8.145 0.003 1 313 124 124 SER CA C 63.182 0.000 1 314 124 124 SER N N 117.208 0.018 1 315 125 125 LEU H H 8.556 0.003 1 316 125 125 LEU CA C 56.856 0.000 1 317 125 125 LEU N N 123.927 0.021 1 318 127 127 LYS H H 7.650 0.000 1 319 127 127 LYS CA C 59.886 0.031 1 320 127 127 LYS N N 118.779 0.006 1 321 128 128 PHE H H 8.651 0.002 1 322 128 128 PHE CA C 61.379 0.015 1 323 128 128 PHE N N 121.621 0.016 1 324 129 129 LEU H H 9.330 0.004 1 325 129 129 LEU CA C 57.974 0.056 1 326 129 129 LEU N N 121.369 0.025 1 327 130 130 ALA H H 8.444 0.004 1 328 130 130 ALA CA C 55.278 0.024 1 329 130 130 ALA N N 125.313 0.009 1 330 131 131 SER H H 7.891 0.001 1 331 131 131 SER CA C 62.717 0.165 1 332 131 131 SER N N 117.780 0.022 1 333 132 132 VAL H H 8.167 0.002 1 334 132 132 VAL CA C 66.949 0.029 1 335 132 132 VAL N N 123.292 0.048 1 336 133 133 SER H H 8.407 0.003 1 337 133 133 SER CA C 63.690 0.020 1 338 133 133 SER N N 115.179 0.034 1 339 134 134 THR H H 8.253 0.005 1 340 134 134 THR CA C 67.095 0.000 1 341 134 134 THR N N 120.418 0.008 1 342 141 141 ARG H H 7.584 0.000 1 343 141 141 ARG CA C 57.190 0.000 1 344 141 141 ARG N N 126.136 0.005 1 stop_ save_