data_6643 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6643 _Entry.Title ; Solution structure of human prolactin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-05-23 _Entry.Accession_date 2005-05-23 _Entry.Last_release_date 2005-08-16 _Entry.Original_release_date 2005-08-16 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Kaare Teilum . . . 6643 2 Jeffery Hoch . C. . 6643 3 Vincent Goffin . . . 6643 4 Sandrina Kinet . . . 6643 5 Joseph Martial . A. . 6643 6 Birthe Kragelund . B. . 6643 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . 'University of Copenhagen' . 6643 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6643 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 719 6643 '15N chemical shifts' 140 6643 '1H chemical shifts' 1082 6643 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2005-08-16 2005-05-23 original author . 6643 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6643 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16045928 _Citation.Full_citation . _Citation.Title 'Solution Structure of Human Prolactin' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 351 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 810 _Citation.Page_last 823 _Citation.Year 2005 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Kaare Teilum . . . 6643 1 2 Jeffery Hoch . C. . 6643 1 3 Vincent Goffin . . . 6643 1 4 Sandrina Kinet . . . 6643 1 5 Joseph Martial . A. . 6643 1 6 Birthe Kragelund . B. . 6643 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6643 _Assembly.ID 1 _Assembly.Name 'human prolactin' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all disulfide bound' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $hPRL . . yes native no no . . . 6643 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_hPRL _Entity.Sf_category entity _Entity.Sf_framecode hPRL _Entity.Entry_ID 6643 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'human prolactin' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; LPICPGGAARCQVTLRDLFD RAVVLSHYIHNLSSEMFSEF DKRYTHGRGFITKAINSCHT SSLATPEDKEQAQQMNQKDF LSLIVSILRSWNEPLYHLVT EVRGMQEAPEAILSKAVEIE EQTKRLLEGMELIVSQVHPE TKENEIYPVWSGLPSLQMAD EESRLSAYYNLLHCLRRDSH KIDNYLKLLKCRIIHNNNC ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 199 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15773 . hPrl . . . . . 100.00 199 100.00 100.00 1.02e-145 . . . . 6643 1 2 no BMRB 5599 . hPrl . . . . . 100.00 199 100.00 100.00 1.02e-145 . . . . 6643 1 3 no PDB 1RW5 . "Solution Structure Of Human Prolactin" . . . . . 100.00 199 100.00 100.00 1.02e-145 . . . . 6643 1 4 no PDB 2Q98 . "X-Ray Structure Of A Prolactin Antagonist" . . . . . 95.48 191 98.95 98.95 2.21e-135 . . . . 6643 1 5 no PDB 3D48 . "Crystal Structure Of A Prolactin Receptor Antagonist Bound To The Extracellular Domain Of The Prolactin Receptor" . . . . . 93.97 188 99.47 99.47 9.03e-134 . . . . 6643 1 6 no PDB 3MZG . "Crystal Structure Of A Human Prolactin Receptor Antagonist In Complex With The Extracellular Domain Of The Human Prolactin Rece" . . . . . 92.96 186 99.46 99.46 4.31e-132 . . . . 6643 1 7 no PDB 3N06 . "A Mutant Human Prolactin Receptor Antagonist H27a In Complex With The Extracellular Domain Of The Human Prolactin Receptor" . . . . . 92.96 186 98.92 98.92 5.45e-131 . . . . 6643 1 8 no PDB 3N0P . "A Mutant Human Prolactin Receptor Antagonist H30a In Complex With The Extracellular Domain Of The Human Prolactin Receptor" . . . . . 92.96 186 98.92 98.92 5.45e-131 . . . . 6643 1 9 no PDB 3NCB . "A Mutant Human Prolactin Receptor Antagonist H180a In Complex With The Extracellular Domain Of The Human Prolactin Receptor" . . . . . 92.96 186 98.92 98.92 5.45e-131 . . . . 6643 1 10 no PDB 3NCC . "A Human Prolactin Receptor Antagonist In Complex With The Mutant Extracellular Domain H188a Of The Human Prolactin Receptor" . . . . . 92.96 186 99.46 99.46 4.31e-132 . . . . 6643 1 11 no PDB 3NCE . "A Mutant Human Prolactin Receptor Antagonist H27a In Complex With The Mutant Extracellular Domain H188a Of The Human Prolactin " . . . . . 92.96 186 98.92 98.92 5.45e-131 . . . . 6643 1 12 no PDB 3NCF . "A Mutant Human Prolactin Receptor Antagonist H30a In Complex With The Mutant Extracellular Domain H188a Of The Human Prolactin " . . . . . 92.96 186 98.92 98.92 5.45e-131 . . . . 6643 1 13 no PDB 3NPZ . "Prolactin Receptor (Prlr) Complexed With The Natural Hormone (Prl)" . . . . . 100.00 199 100.00 100.00 1.02e-145 . . . . 6643 1 14 no DBJ BAA00312 . "prolactin PRL precursor [Homo sapiens]" . . . . . 100.00 217 98.99 99.50 5.01e-144 . . . . 6643 1 15 no DBJ BAI46568 . "prolactin [synthetic construct]" . . . . . 100.00 227 100.00 100.00 3.23e-145 . . . . 6643 1 16 no EMBL CAA23829 . "prolactin [Homo sapiens]" . . . . . 100.00 227 100.00 100.00 3.23e-145 . . . . 6643 1 17 no EMBL CAA25214 . "prolactin [Homo sapiens]" . . . . . 100.00 217 100.00 100.00 1.01e-145 . . . . 6643 1 18 no EMBL CAA38264 . "prolactin [Homo sapiens]" . . . . . 100.00 220 100.00 100.00 1.11e-145 . . . . 6643 1 19 no GB AAA18471 . "prolactin [Macaca mulatta]" . . . . . 100.00 227 97.99 99.50 1.12e-142 . . . . 6643 1 20 no GB AAA60173 . "prolactin, partial [Homo sapiens]" . . . . . 100.00 217 99.50 99.50 1.66e-144 . . . . 6643 1 21 no GB AAB70858 . "preprolactin, partial [Homo sapiens]" . . . . . 86.93 191 98.84 98.84 2.01e-122 . . . . 6643 1 22 no GB AAH15850 . "Prolactin [Homo sapiens]" . . . . . 100.00 227 100.00 100.00 3.23e-145 . . . . 6643 1 23 no GB AAH88370 . "Prolactin [Homo sapiens]" . . . . . 100.00 228 100.00 100.00 2.44e-145 . . . . 6643 1 24 no PRF 1005222A . prolactin . . . . . 100.00 217 100.00 100.00 1.01e-145 . . . . 6643 1 25 no REF NP_000939 . "prolactin precursor [Homo sapiens]" . . . . . 100.00 227 100.00 100.00 3.23e-145 . . . . 6643 1 26 no REF NP_001040593 . "prolactin precursor [Macaca mulatta]" . . . . . 100.00 227 97.99 99.50 1.12e-142 . . . . 6643 1 27 no REF NP_001157030 . "prolactin precursor [Homo sapiens]" . . . . . 100.00 227 100.00 100.00 3.23e-145 . . . . 6643 1 28 no REF XP_002816520 . "PREDICTED: prolactin [Pongo abelii]" . . . . . 100.00 227 98.99 99.50 2.35e-143 . . . . 6643 1 29 no REF XP_003263607 . "PREDICTED: prolactin [Nomascus leucogenys]" . . . . . 100.00 227 99.50 100.00 2.12e-144 . . . . 6643 1 30 no SP P01236 . "RecName: Full=Prolactin; Short=PRL; Flags: Precursor [Homo sapiens]" . . . . . 100.00 227 100.00 100.00 3.23e-145 . . . . 6643 1 31 no SP P55151 . "RecName: Full=Prolactin; Short=PRL; Flags: Precursor [Macaca mulatta]" . . . . . 100.00 227 97.99 99.50 1.12e-142 . . . . 6643 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . LEU . 6643 1 2 . PRO . 6643 1 3 . ILE . 6643 1 4 . CYS . 6643 1 5 . PRO . 6643 1 6 . GLY . 6643 1 7 . GLY . 6643 1 8 . ALA . 6643 1 9 . ALA . 6643 1 10 . ARG . 6643 1 11 . CYS . 6643 1 12 . GLN . 6643 1 13 . VAL . 6643 1 14 . THR . 6643 1 15 . LEU . 6643 1 16 . ARG . 6643 1 17 . ASP . 6643 1 18 . LEU . 6643 1 19 . PHE . 6643 1 20 . ASP . 6643 1 21 . ARG . 6643 1 22 . ALA . 6643 1 23 . VAL . 6643 1 24 . VAL . 6643 1 25 . LEU . 6643 1 26 . SER . 6643 1 27 . HIS . 6643 1 28 . TYR . 6643 1 29 . ILE . 6643 1 30 . HIS . 6643 1 31 . ASN . 6643 1 32 . LEU . 6643 1 33 . SER . 6643 1 34 . SER . 6643 1 35 . GLU . 6643 1 36 . MET . 6643 1 37 . PHE . 6643 1 38 . SER . 6643 1 39 . GLU . 6643 1 40 . PHE . 6643 1 41 . ASP . 6643 1 42 . LYS . 6643 1 43 . ARG . 6643 1 44 . TYR . 6643 1 45 . THR . 6643 1 46 . HIS . 6643 1 47 . GLY . 6643 1 48 . ARG . 6643 1 49 . GLY . 6643 1 50 . PHE . 6643 1 51 . ILE . 6643 1 52 . THR . 6643 1 53 . LYS . 6643 1 54 . ALA . 6643 1 55 . ILE . 6643 1 56 . ASN . 6643 1 57 . SER . 6643 1 58 . CYS . 6643 1 59 . HIS . 6643 1 60 . THR . 6643 1 61 . SER . 6643 1 62 . SER . 6643 1 63 . LEU . 6643 1 64 . ALA . 6643 1 65 . THR . 6643 1 66 . PRO . 6643 1 67 . GLU . 6643 1 68 . ASP . 6643 1 69 . LYS . 6643 1 70 . GLU . 6643 1 71 . GLN . 6643 1 72 . ALA . 6643 1 73 . GLN . 6643 1 74 . GLN . 6643 1 75 . MET . 6643 1 76 . ASN . 6643 1 77 . GLN . 6643 1 78 . LYS . 6643 1 79 . ASP . 6643 1 80 . PHE . 6643 1 81 . LEU . 6643 1 82 . SER . 6643 1 83 . LEU . 6643 1 84 . ILE . 6643 1 85 . VAL . 6643 1 86 . SER . 6643 1 87 . ILE . 6643 1 88 . LEU . 6643 1 89 . ARG . 6643 1 90 . SER . 6643 1 91 . TRP . 6643 1 92 . ASN . 6643 1 93 . GLU . 6643 1 94 . PRO . 6643 1 95 . LEU . 6643 1 96 . TYR . 6643 1 97 . HIS . 6643 1 98 . LEU . 6643 1 99 . VAL . 6643 1 100 . THR . 6643 1 101 . GLU . 6643 1 102 . VAL . 6643 1 103 . ARG . 6643 1 104 . GLY . 6643 1 105 . MET . 6643 1 106 . GLN . 6643 1 107 . GLU . 6643 1 108 . ALA . 6643 1 109 . PRO . 6643 1 110 . GLU . 6643 1 111 . ALA . 6643 1 112 . ILE . 6643 1 113 . LEU . 6643 1 114 . SER . 6643 1 115 . LYS . 6643 1 116 . ALA . 6643 1 117 . VAL . 6643 1 118 . GLU . 6643 1 119 . ILE . 6643 1 120 . GLU . 6643 1 121 . GLU . 6643 1 122 . GLN . 6643 1 123 . THR . 6643 1 124 . LYS . 6643 1 125 . ARG . 6643 1 126 . LEU . 6643 1 127 . LEU . 6643 1 128 . GLU . 6643 1 129 . GLY . 6643 1 130 . MET . 6643 1 131 . GLU . 6643 1 132 . LEU . 6643 1 133 . ILE . 6643 1 134 . VAL . 6643 1 135 . SER . 6643 1 136 . GLN . 6643 1 137 . VAL . 6643 1 138 . HIS . 6643 1 139 . PRO . 6643 1 140 . GLU . 6643 1 141 . THR . 6643 1 142 . LYS . 6643 1 143 . GLU . 6643 1 144 . ASN . 6643 1 145 . GLU . 6643 1 146 . ILE . 6643 1 147 . TYR . 6643 1 148 . PRO . 6643 1 149 . VAL . 6643 1 150 . TRP . 6643 1 151 . SER . 6643 1 152 . GLY . 6643 1 153 . LEU . 6643 1 154 . PRO . 6643 1 155 . SER . 6643 1 156 . LEU . 6643 1 157 . GLN . 6643 1 158 . MET . 6643 1 159 . ALA . 6643 1 160 . ASP . 6643 1 161 . GLU . 6643 1 162 . GLU . 6643 1 163 . SER . 6643 1 164 . ARG . 6643 1 165 . LEU . 6643 1 166 . SER . 6643 1 167 . ALA . 6643 1 168 . TYR . 6643 1 169 . TYR . 6643 1 170 . ASN . 6643 1 171 . LEU . 6643 1 172 . LEU . 6643 1 173 . HIS . 6643 1 174 . CYS . 6643 1 175 . LEU . 6643 1 176 . ARG . 6643 1 177 . ARG . 6643 1 178 . ASP . 6643 1 179 . SER . 6643 1 180 . HIS . 6643 1 181 . LYS . 6643 1 182 . ILE . 6643 1 183 . ASP . 6643 1 184 . ASN . 6643 1 185 . TYR . 6643 1 186 . LEU . 6643 1 187 . LYS . 6643 1 188 . LEU . 6643 1 189 . LEU . 6643 1 190 . LYS . 6643 1 191 . CYS . 6643 1 192 . ARG . 6643 1 193 . ILE . 6643 1 194 . ILE . 6643 1 195 . HIS . 6643 1 196 . ASN . 6643 1 197 . ASN . 6643 1 198 . ASN . 6643 1 199 . CYS . 6643 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . LEU 1 1 6643 1 . PRO 2 2 6643 1 . ILE 3 3 6643 1 . CYS 4 4 6643 1 . PRO 5 5 6643 1 . GLY 6 6 6643 1 . GLY 7 7 6643 1 . ALA 8 8 6643 1 . ALA 9 9 6643 1 . ARG 10 10 6643 1 . CYS 11 11 6643 1 . GLN 12 12 6643 1 . VAL 13 13 6643 1 . THR 14 14 6643 1 . LEU 15 15 6643 1 . ARG 16 16 6643 1 . ASP 17 17 6643 1 . LEU 18 18 6643 1 . PHE 19 19 6643 1 . ASP 20 20 6643 1 . ARG 21 21 6643 1 . ALA 22 22 6643 1 . VAL 23 23 6643 1 . VAL 24 24 6643 1 . LEU 25 25 6643 1 . SER 26 26 6643 1 . HIS 27 27 6643 1 . TYR 28 28 6643 1 . ILE 29 29 6643 1 . HIS 30 30 6643 1 . ASN 31 31 6643 1 . LEU 32 32 6643 1 . SER 33 33 6643 1 . SER 34 34 6643 1 . GLU 35 35 6643 1 . MET 36 36 6643 1 . PHE 37 37 6643 1 . SER 38 38 6643 1 . GLU 39 39 6643 1 . PHE 40 40 6643 1 . ASP 41 41 6643 1 . LYS 42 42 6643 1 . ARG 43 43 6643 1 . TYR 44 44 6643 1 . THR 45 45 6643 1 . HIS 46 46 6643 1 . GLY 47 47 6643 1 . ARG 48 48 6643 1 . GLY 49 49 6643 1 . PHE 50 50 6643 1 . ILE 51 51 6643 1 . THR 52 52 6643 1 . LYS 53 53 6643 1 . ALA 54 54 6643 1 . ILE 55 55 6643 1 . ASN 56 56 6643 1 . SER 57 57 6643 1 . CYS 58 58 6643 1 . HIS 59 59 6643 1 . THR 60 60 6643 1 . SER 61 61 6643 1 . SER 62 62 6643 1 . LEU 63 63 6643 1 . ALA 64 64 6643 1 . THR 65 65 6643 1 . PRO 66 66 6643 1 . GLU 67 67 6643 1 . ASP 68 68 6643 1 . LYS 69 69 6643 1 . GLU 70 70 6643 1 . GLN 71 71 6643 1 . ALA 72 72 6643 1 . GLN 73 73 6643 1 . GLN 74 74 6643 1 . MET 75 75 6643 1 . ASN 76 76 6643 1 . GLN 77 77 6643 1 . LYS 78 78 6643 1 . ASP 79 79 6643 1 . PHE 80 80 6643 1 . LEU 81 81 6643 1 . SER 82 82 6643 1 . LEU 83 83 6643 1 . ILE 84 84 6643 1 . VAL 85 85 6643 1 . SER 86 86 6643 1 . ILE 87 87 6643 1 . LEU 88 88 6643 1 . ARG 89 89 6643 1 . SER 90 90 6643 1 . TRP 91 91 6643 1 . ASN 92 92 6643 1 . GLU 93 93 6643 1 . PRO 94 94 6643 1 . LEU 95 95 6643 1 . TYR 96 96 6643 1 . HIS 97 97 6643 1 . LEU 98 98 6643 1 . VAL 99 99 6643 1 . THR 100 100 6643 1 . GLU 101 101 6643 1 . VAL 102 102 6643 1 . ARG 103 103 6643 1 . GLY 104 104 6643 1 . MET 105 105 6643 1 . GLN 106 106 6643 1 . GLU 107 107 6643 1 . ALA 108 108 6643 1 . PRO 109 109 6643 1 . GLU 110 110 6643 1 . ALA 111 111 6643 1 . ILE 112 112 6643 1 . LEU 113 113 6643 1 . SER 114 114 6643 1 . LYS 115 115 6643 1 . ALA 116 116 6643 1 . VAL 117 117 6643 1 . GLU 118 118 6643 1 . ILE 119 119 6643 1 . GLU 120 120 6643 1 . GLU 121 121 6643 1 . GLN 122 122 6643 1 . THR 123 123 6643 1 . LYS 124 124 6643 1 . ARG 125 125 6643 1 . LEU 126 126 6643 1 . LEU 127 127 6643 1 . GLU 128 128 6643 1 . GLY 129 129 6643 1 . MET 130 130 6643 1 . GLU 131 131 6643 1 . LEU 132 132 6643 1 . ILE 133 133 6643 1 . VAL 134 134 6643 1 . SER 135 135 6643 1 . GLN 136 136 6643 1 . VAL 137 137 6643 1 . HIS 138 138 6643 1 . PRO 139 139 6643 1 . GLU 140 140 6643 1 . THR 141 141 6643 1 . LYS 142 142 6643 1 . GLU 143 143 6643 1 . ASN 144 144 6643 1 . GLU 145 145 6643 1 . ILE 146 146 6643 1 . TYR 147 147 6643 1 . PRO 148 148 6643 1 . VAL 149 149 6643 1 . TRP 150 150 6643 1 . SER 151 151 6643 1 . GLY 152 152 6643 1 . LEU 153 153 6643 1 . PRO 154 154 6643 1 . SER 155 155 6643 1 . LEU 156 156 6643 1 . GLN 157 157 6643 1 . MET 158 158 6643 1 . ALA 159 159 6643 1 . ASP 160 160 6643 1 . GLU 161 161 6643 1 . GLU 162 162 6643 1 . SER 163 163 6643 1 . ARG 164 164 6643 1 . LEU 165 165 6643 1 . SER 166 166 6643 1 . ALA 167 167 6643 1 . TYR 168 168 6643 1 . TYR 169 169 6643 1 . ASN 170 170 6643 1 . LEU 171 171 6643 1 . LEU 172 172 6643 1 . HIS 173 173 6643 1 . CYS 174 174 6643 1 . LEU 175 175 6643 1 . ARG 176 176 6643 1 . ARG 177 177 6643 1 . ASP 178 178 6643 1 . SER 179 179 6643 1 . HIS 180 180 6643 1 . LYS 181 181 6643 1 . ILE 182 182 6643 1 . ASP 183 183 6643 1 . ASN 184 184 6643 1 . TYR 185 185 6643 1 . LEU 186 186 6643 1 . LYS 187 187 6643 1 . LEU 188 188 6643 1 . LEU 189 189 6643 1 . LYS 190 190 6643 1 . CYS 191 191 6643 1 . ARG 192 192 6643 1 . ILE 193 193 6643 1 . ILE 194 194 6643 1 . HIS 195 195 6643 1 . ASN 196 196 6643 1 . ASN 197 197 6643 1 . ASN 198 198 6643 1 . CYS 199 199 6643 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 6643 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $hPRL . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 6643 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 6643 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $hPRL . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6643 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6643 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'human prolactin' '[U-13C; U-15N]' 1 $assembly 1 $hPRL . . 1 . . mM . . . . 6643 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6643 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 8 0.1 pH 6643 1 temperature 310 0.1 K 6643 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_800MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_spectrometer _NMR_spectrometer.Entry_ID 6643 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6643 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 HSQC no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 2 HNCO no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 3 HN(CA)CO no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 4 HN(CO)CA no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 5 HNCA no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 6 HNCACB no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 7 CBCA(CO)NH no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 8 HCCH-TOCSY no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 9 C13-NOESY-HSQC no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 10 N15-NOESY-HSQC no 1 $HSQC . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6643 1 stop_ save_ save_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HSQC _NMR_spec_expt.Entry_ID 6643 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $800MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6643 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 external indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6643 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1 . . . 1 $entry_citation . . 1 $entry_citation 6643 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6643 1 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6643 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 isotropic 6643 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 LEU HA H 1 4.62 0.03 . 1 . . . . 1 LEU HA . 6643 1 2 . 1 1 1 1 LEU HB2 H 1 1.60 0.03 . 2 . . . . 1 LEU HB2 . 6643 1 3 . 1 1 1 1 LEU HG H 1 1.71 0.03 . 1 . . . . 1 LEU HG . 6643 1 4 . 1 1 1 1 LEU HD11 H 1 0.95 0.03 . 2 . . . . 1 LEU HD1 . 6643 1 5 . 1 1 1 1 LEU HD12 H 1 0.95 0.03 . 2 . . . . 1 LEU HD1 . 6643 1 6 . 1 1 1 1 LEU HD13 H 1 0.95 0.03 . 2 . . . . 1 LEU HD1 . 6643 1 7 . 1 1 1 1 LEU HD21 H 1 0.93 0.03 . 2 . . . . 1 LEU HD2 . 6643 1 8 . 1 1 1 1 LEU HD22 H 1 0.93 0.03 . 2 . . . . 1 LEU HD2 . 6643 1 9 . 1 1 1 1 LEU HD23 H 1 0.93 0.03 . 2 . . . . 1 LEU HD2 . 6643 1 10 . 1 1 1 1 LEU CA C 13 52.90 0.40 . 1 . . . . 1 LEU CA . 6643 1 11 . 1 1 1 1 LEU CB C 13 41.94 0.40 . 1 . . . . 1 LEU CB . 6643 1 12 . 1 1 1 1 LEU CG C 13 27.17 0.40 . 1 . . . . 1 LEU CG . 6643 1 13 . 1 1 1 1 LEU CD1 C 13 25.34 0.40 . 2 . . . . 1 LEU CD1 . 6643 1 14 . 1 1 1 1 LEU CD2 C 13 23.69 0.40 . 2 . . . . 1 LEU CD2 . 6643 1 15 . 1 1 2 2 PRO HA H 1 4.49 0.03 . 1 . . . . 2 PRO HA . 6643 1 16 . 1 1 2 2 PRO HB2 H 1 1.92 0.03 . 2 . . . . 2 PRO HB2 . 6643 1 17 . 1 1 2 2 PRO HB3 H 1 2.25 0.03 . 2 . . . . 2 PRO HB3 . 6643 1 18 . 1 1 2 2 PRO HG2 H 1 2.03 0.03 . 2 . . . . 2 PRO HG2 . 6643 1 19 . 1 1 2 2 PRO HD2 H 1 3.64 0.03 . 2 . . . . 2 PRO HD2 . 6643 1 20 . 1 1 2 2 PRO HD3 H 1 3.83 0.03 . 2 . . . . 2 PRO HD3 . 6643 1 21 . 1 1 2 2 PRO C C 13 176.33 0.40 . 1 . . . . 2 PRO C . 6643 1 22 . 1 1 2 2 PRO CA C 13 62.81 0.40 . 1 . . . . 2 PRO CA . 6643 1 23 . 1 1 2 2 PRO CB C 13 31.88 0.40 . 1 . . . . 2 PRO CB . 6643 1 24 . 1 1 2 2 PRO CG C 13 27.52 0.40 . 1 . . . . 2 PRO CG . 6643 1 25 . 1 1 2 2 PRO CD C 13 50.53 0.40 . 1 . . . . 2 PRO CD . 6643 1 26 . 1 1 3 3 ILE H H 1 8.12 0.03 . 1 . . . . 3 ILE H . 6643 1 27 . 1 1 3 3 ILE HA H 1 4.09 0.03 . 1 . . . . 3 ILE HA . 6643 1 28 . 1 1 3 3 ILE HB H 1 1.83 0.03 . 1 . . . . 3 ILE HB . 6643 1 29 . 1 1 3 3 ILE HG12 H 1 1.53 0.03 . 2 . . . . 3 ILE HG12 . 6643 1 30 . 1 1 3 3 ILE HG13 H 1 1.17 0.03 . 2 . . . . 3 ILE HG13 . 6643 1 31 . 1 1 3 3 ILE HG21 H 1 0.90 0.03 . 1 . . . . 3 ILE HG2 . 6643 1 32 . 1 1 3 3 ILE HG22 H 1 0.90 0.03 . 1 . . . . 3 ILE HG2 . 6643 1 33 . 1 1 3 3 ILE HG23 H 1 0.90 0.03 . 1 . . . . 3 ILE HG2 . 6643 1 34 . 1 1 3 3 ILE HD11 H 1 0.86 0.03 . 1 . . . . 3 ILE HD1 . 6643 1 35 . 1 1 3 3 ILE HD12 H 1 0.86 0.03 . 1 . . . . 3 ILE HD1 . 6643 1 36 . 1 1 3 3 ILE HD13 H 1 0.86 0.03 . 1 . . . . 3 ILE HD1 . 6643 1 37 . 1 1 3 3 ILE C C 13 175.91 0.40 . 1 . . . . 3 ILE C . 6643 1 38 . 1 1 3 3 ILE CA C 13 61.64 0.40 . 1 . . . . 3 ILE CA . 6643 1 39 . 1 1 3 3 ILE CB C 13 38.76 0.40 . 1 . . . . 3 ILE CB . 6643 1 40 . 1 1 3 3 ILE CG1 C 13 27.41 0.40 . 1 . . . . 3 ILE CG1 . 6643 1 41 . 1 1 3 3 ILE CG2 C 13 17.66 0.40 . 1 . . . . 3 ILE CG2 . 6643 1 42 . 1 1 3 3 ILE CD1 C 13 13.04 0.40 . 1 . . . . 3 ILE CD1 . 6643 1 43 . 1 1 3 3 ILE N N 15 119.95 0.10 . 1 . . . . 3 ILE N . 6643 1 44 . 1 1 4 4 CYS HA H 1 5.03 0.03 . 1 . . . . 4 CYS HA . 6643 1 45 . 1 1 4 4 CYS HB2 H 1 3.01 0.03 . 2 . . . . 4 CYS HB2 . 6643 1 46 . 1 1 4 4 CYS HB3 H 1 3.13 0.03 . 2 . . . . 4 CYS HB3 . 6643 1 47 . 1 1 4 4 CYS CA C 13 52.88 0.40 . 1 . . . . 4 CYS CA . 6643 1 48 . 1 1 4 4 CYS CB C 13 41.20 0.40 . 1 . . . . 4 CYS CB . 6643 1 49 . 1 1 5 5 PRO HA H 1 4.42 0.03 . 1 . . . . 5 PRO HA . 6643 1 50 . 1 1 5 5 PRO HB2 H 1 1.98 0.03 . 2 . . . . 5 PRO HB2 . 6643 1 51 . 1 1 5 5 PRO HB3 H 1 2.30 0.03 . 2 . . . . 5 PRO HB3 . 6643 1 52 . 1 1 5 5 PRO HG2 H 1 2.02 0.03 . 2 . . . . 5 PRO HG2 . 6643 1 53 . 1 1 5 5 PRO HG3 H 1 2.10 0.03 . 2 . . . . 5 PRO HG3 . 6643 1 54 . 1 1 5 5 PRO HD2 H 1 3.72 0.03 . 2 . . . . 5 PRO HD2 . 6643 1 55 . 1 1 5 5 PRO HD3 H 1 3.83 0.03 . 2 . . . . 5 PRO HD3 . 6643 1 56 . 1 1 5 5 PRO CA C 13 63.65 0.40 . 1 . . . . 5 PRO CA . 6643 1 57 . 1 1 5 5 PRO CB C 13 31.93 0.40 . 1 . . . . 5 PRO CB . 6643 1 58 . 1 1 5 5 PRO CG C 13 27.50 0.40 . 1 . . . . 5 PRO CG . 6643 1 59 . 1 1 5 5 PRO CD C 13 50.72 0.40 . 1 . . . . 5 PRO CD . 6643 1 60 . 1 1 6 6 GLY HA2 H 1 4.00 0.03 . 2 . . . . 6 GLY HA2 . 6643 1 61 . 1 1 6 6 GLY HA3 H 1 3.90 0.03 . 2 . . . . 6 GLY HA3 . 6643 1 62 . 1 1 6 6 GLY CA C 13 45.59 0.40 . 1 . . . . 6 GLY CA . 6643 1 63 . 1 1 7 7 GLY HA2 H 1 4.15 0.03 . 2 . . . . 7 GLY HA2 . 6643 1 64 . 1 1 7 7 GLY HA3 H 1 3.81 0.03 . 2 . . . . 7 GLY HA3 . 6643 1 65 . 1 1 7 7 GLY CA C 13 45.16 0.40 . 1 . . . . 7 GLY CA . 6643 1 66 . 1 1 8 8 ALA HA H 1 4.23 0.03 . 1 . . . . 8 ALA HA . 6643 1 67 . 1 1 8 8 ALA HB1 H 1 1.45 0.03 . 1 . . . . 8 ALA HB . 6643 1 68 . 1 1 8 8 ALA HB2 H 1 1.45 0.03 . 1 . . . . 8 ALA HB . 6643 1 69 . 1 1 8 8 ALA HB3 H 1 1.45 0.03 . 1 . . . . 8 ALA HB . 6643 1 70 . 1 1 8 8 ALA CA C 13 53.04 0.40 . 1 . . . . 8 ALA CA . 6643 1 71 . 1 1 8 8 ALA CB C 13 19.06 0.40 . 1 . . . . 8 ALA CB . 6643 1 72 . 1 1 9 9 ALA HA H 1 4.38 0.03 . 1 . . . . 9 ALA HA . 6643 1 73 . 1 1 9 9 ALA HB1 H 1 1.42 0.03 . 1 . . . . 9 ALA HB . 6643 1 74 . 1 1 9 9 ALA HB2 H 1 1.42 0.03 . 1 . . . . 9 ALA HB . 6643 1 75 . 1 1 9 9 ALA HB3 H 1 1.42 0.03 . 1 . . . . 9 ALA HB . 6643 1 76 . 1 1 9 9 ALA CA C 13 52.52 0.40 . 1 . . . . 9 ALA CA . 6643 1 77 . 1 1 9 9 ALA CB C 13 19.18 0.40 . 1 . . . . 9 ALA CB . 6643 1 78 . 1 1 10 10 ARG HA H 1 4.42 0.03 . 1 . . . . 10 ARG HA . 6643 1 79 . 1 1 10 10 ARG HB2 H 1 1.90 0.03 . 2 . . . . 10 ARG HB2 . 6643 1 80 . 1 1 10 10 ARG HB3 H 1 1.77 0.03 . 2 . . . . 10 ARG HB3 . 6643 1 81 . 1 1 10 10 ARG HG2 H 1 1.61 0.03 . 2 . . . . 10 ARG HG2 . 6643 1 82 . 1 1 10 10 ARG HG3 H 1 1.59 0.03 . 2 . . . . 10 ARG HG3 . 6643 1 83 . 1 1 10 10 ARG HD2 H 1 3.21 0.03 . 2 . . . . 10 ARG HD2 . 6643 1 84 . 1 1 10 10 ARG CA C 13 55.72 0.40 . 1 . . . . 10 ARG CA . 6643 1 85 . 1 1 10 10 ARG CB C 13 30.77 0.40 . 1 . . . . 10 ARG CB . 6643 1 86 . 1 1 10 10 ARG CG C 13 27.11 0.40 . 1 . . . . 10 ARG CG . 6643 1 87 . 1 1 10 10 ARG CD C 13 43.29 0.40 . 1 . . . . 10 ARG CD . 6643 1 88 . 1 1 11 11 CYS HA H 1 4.75 0.03 . 1 . . . . 11 CYS HA . 6643 1 89 . 1 1 11 11 CYS HB2 H 1 3.19 0.03 . 2 . . . . 11 CYS HB2 . 6643 1 90 . 1 1 11 11 CYS HB3 H 1 3.28 0.03 . 2 . . . . 11 CYS HB3 . 6643 1 91 . 1 1 11 11 CYS CA C 13 55.76 0.40 . 1 . . . . 11 CYS CA . 6643 1 92 . 1 1 11 11 CYS CB C 13 40.83 0.40 . 1 . . . . 11 CYS CB . 6643 1 93 . 1 1 12 12 GLN HA H 1 4.40 0.03 . 1 . . . . 12 GLN HA . 6643 1 94 . 1 1 12 12 GLN HB2 H 1 2.02 0.03 . 2 . . . . 12 GLN HB2 . 6643 1 95 . 1 1 12 12 GLN HB3 H 1 2.12 0.03 . 2 . . . . 12 GLN HB3 . 6643 1 96 . 1 1 12 12 GLN HG2 H 1 2.36 0.03 . 2 . . . . 12 GLN HG2 . 6643 1 97 . 1 1 12 12 GLN CA C 13 56.22 0.40 . 1 . . . . 12 GLN CA . 6643 1 98 . 1 1 12 12 GLN CB C 13 29.31 0.40 . 1 . . . . 12 GLN CB . 6643 1 99 . 1 1 12 12 GLN CG C 13 33.89 0.40 . 1 . . . . 12 GLN CG . 6643 1 100 . 1 1 13 13 VAL HA H 1 4.35 0.03 . 1 . . . . 13 VAL HA . 6643 1 101 . 1 1 13 13 VAL HB H 1 2.09 0.03 . 1 . . . . 13 VAL HB . 6643 1 102 . 1 1 13 13 VAL HG11 H 1 0.97 0.03 . 2 . . . . 13 VAL HG1 . 6643 1 103 . 1 1 13 13 VAL HG12 H 1 0.97 0.03 . 2 . . . . 13 VAL HG1 . 6643 1 104 . 1 1 13 13 VAL HG13 H 1 0.97 0.03 . 2 . . . . 13 VAL HG1 . 6643 1 105 . 1 1 13 13 VAL CA C 13 61.76 0.40 . 1 . . . . 13 VAL CA . 6643 1 106 . 1 1 13 13 VAL CB C 13 33.33 0.40 . 1 . . . . 13 VAL CB . 6643 1 107 . 1 1 13 13 VAL CG1 C 13 21.28 0.40 . 2 . . . . 13 VAL CG1 . 6643 1 108 . 1 1 14 14 THR HB H 1 4.21 0.03 . 1 . . . . 14 THR HB . 6643 1 109 . 1 1 14 14 THR HG21 H 1 1.17 0.03 . 1 . . . . 14 THR HG2 . 6643 1 110 . 1 1 14 14 THR HG22 H 1 1.17 0.03 . 1 . . . . 14 THR HG2 . 6643 1 111 . 1 1 14 14 THR HG23 H 1 1.17 0.03 . 1 . . . . 14 THR HG2 . 6643 1 112 . 1 1 14 14 THR CB C 13 69.13 0.40 . 1 . . . . 14 THR CB . 6643 1 113 . 1 1 14 14 THR CG2 C 13 21.90 0.40 . 1 . . . . 14 THR CG2 . 6643 1 114 . 1 1 16 16 ARG H H 1 8.31 0.03 . 1 . . . . 16 ARG H . 6643 1 115 . 1 1 16 16 ARG HA H 1 3.92 0.03 . 1 . . . . 16 ARG HA . 6643 1 116 . 1 1 16 16 ARG HB2 H 1 1.84 0.03 . 2 . . . . 16 ARG HB2 . 6643 1 117 . 1 1 16 16 ARG HG2 H 1 1.66 0.03 . 2 . . . . 16 ARG HG2 . 6643 1 118 . 1 1 16 16 ARG HD2 H 1 3.20 0.03 . 2 . . . . 16 ARG HD2 . 6643 1 119 . 1 1 16 16 ARG C C 13 177.70 0.40 . 1 . . . . 16 ARG C . 6643 1 120 . 1 1 16 16 ARG CA C 13 60.15 0.40 . 1 . . . . 16 ARG CA . 6643 1 121 . 1 1 16 16 ARG CB C 13 29.81 0.40 . 1 . . . . 16 ARG CB . 6643 1 122 . 1 1 16 16 ARG CG C 13 27.26 0.40 . 1 . . . . 16 ARG CG . 6643 1 123 . 1 1 16 16 ARG CD C 13 43.44 0.40 . 1 . . . . 16 ARG CD . 6643 1 124 . 1 1 16 16 ARG N N 15 118.04 0.10 . 1 . . . . 16 ARG N . 6643 1 125 . 1 1 17 17 ASP H H 1 7.61 0.03 . 1 . . . . 17 ASP H . 6643 1 126 . 1 1 17 17 ASP HA H 1 4.44 0.03 . 1 . . . . 17 ASP HA . 6643 1 127 . 1 1 17 17 ASP HB2 H 1 2.69 0.03 . 2 . . . . 17 ASP HB2 . 6643 1 128 . 1 1 17 17 ASP HB3 H 1 2.94 0.03 . 2 . . . . 17 ASP HB3 . 6643 1 129 . 1 1 17 17 ASP C C 13 179.19 0.40 . 1 . . . . 17 ASP C . 6643 1 130 . 1 1 17 17 ASP CA C 13 57.64 0.40 . 1 . . . . 17 ASP CA . 6643 1 131 . 1 1 17 17 ASP CB C 13 40.56 0.40 . 1 . . . . 17 ASP CB . 6643 1 132 . 1 1 17 17 ASP N N 15 118.97 0.10 . 1 . . . . 17 ASP N . 6643 1 133 . 1 1 18 18 LEU H H 1 8.15 0.03 . 1 . . . . 18 LEU H . 6643 1 134 . 1 1 18 18 LEU HA H 1 3.97 0.03 . 1 . . . . 18 LEU HA . 6643 1 135 . 1 1 18 18 LEU HB2 H 1 1.98 0.03 . 2 . . . . 18 LEU HB2 . 6643 1 136 . 1 1 18 18 LEU HG H 1 1.22 0.03 . 1 . . . . 18 LEU HG . 6643 1 137 . 1 1 18 18 LEU C C 13 180.03 0.40 . 1 . . . . 18 LEU C . 6643 1 138 . 1 1 18 18 LEU CA C 13 58.18 0.40 . 1 . . . . 18 LEU CA . 6643 1 139 . 1 1 18 18 LEU CB C 13 42.17 0.40 . 1 . . . . 18 LEU CB . 6643 1 140 . 1 1 18 18 LEU N N 15 119.42 0.10 . 1 . . . . 18 LEU N . 6643 1 141 . 1 1 19 19 PHE H H 1 8.57 0.03 . 1 . . . . 19 PHE H . 6643 1 142 . 1 1 19 19 PHE HA H 1 4.08 0.03 . 1 . . . . 19 PHE HA . 6643 1 143 . 1 1 19 19 PHE HB2 H 1 3.13 0.03 . 2 . . . . 19 PHE HB2 . 6643 1 144 . 1 1 19 19 PHE HB3 H 1 2.91 0.03 . 2 . . . . 19 PHE HB3 . 6643 1 145 . 1 1 19 19 PHE HD1 H 1 7.13 0.03 . 3 . . . . 19 PHE HD1 . 6643 1 146 . 1 1 19 19 PHE HE1 H 1 7.25 0.03 . 3 . . . . 19 PHE HE1 . 6643 1 147 . 1 1 19 19 PHE C C 13 177.92 0.40 . 1 . . . . 19 PHE C . 6643 1 148 . 1 1 19 19 PHE CA C 13 63.18 0.40 . 1 . . . . 19 PHE CA . 6643 1 149 . 1 1 19 19 PHE CB C 13 39.26 0.40 . 1 . . . . 19 PHE CB . 6643 1 150 . 1 1 19 19 PHE CD1 C 13 130.76 0.40 . 3 . . . . 19 PHE CD1 . 6643 1 151 . 1 1 19 19 PHE CE1 C 13 130.93 0.40 . 3 . . . . 19 PHE CE1 . 6643 1 152 . 1 1 19 19 PHE N N 15 118.87 0.10 . 1 . . . . 19 PHE N . 6643 1 153 . 1 1 20 20 ASP H H 1 8.44 0.03 . 1 . . . . 20 ASP H . 6643 1 154 . 1 1 20 20 ASP HA H 1 4.50 0.03 . 1 . . . . 20 ASP HA . 6643 1 155 . 1 1 20 20 ASP HB2 H 1 2.70 0.03 . 2 . . . . 20 ASP HB2 . 6643 1 156 . 1 1 20 20 ASP HB3 H 1 2.93 0.03 . 2 . . . . 20 ASP HB3 . 6643 1 157 . 1 1 20 20 ASP C C 13 179.07 0.40 . 1 . . . . 20 ASP C . 6643 1 158 . 1 1 20 20 ASP CA C 13 57.66 0.40 . 1 . . . . 20 ASP CA . 6643 1 159 . 1 1 20 20 ASP CB C 13 40.37 0.40 . 1 . . . . 20 ASP CB . 6643 1 160 . 1 1 20 20 ASP N N 15 119.68 0.10 . 1 . . . . 20 ASP N . 6643 1 161 . 1 1 21 21 ARG H H 1 7.83 0.03 . 1 . . . . 21 ARG H . 6643 1 162 . 1 1 21 21 ARG HA H 1 4.44 0.03 . 1 . . . . 21 ARG HA . 6643 1 163 . 1 1 21 21 ARG HB2 H 1 2.30 0.03 . 2 . . . . 21 ARG HB2 . 6643 1 164 . 1 1 21 21 ARG HB3 H 1 1.92 0.03 . 2 . . . . 21 ARG HB3 . 6643 1 165 . 1 1 21 21 ARG C C 13 178.49 0.40 . 1 . . . . 21 ARG C . 6643 1 166 . 1 1 21 21 ARG CA C 13 58.64 0.40 . 1 . . . . 21 ARG CA . 6643 1 167 . 1 1 21 21 ARG CB C 13 30.32 0.40 . 1 . . . . 21 ARG CB . 6643 1 168 . 1 1 21 21 ARG N N 15 117.89 0.10 . 1 . . . . 21 ARG N . 6643 1 169 . 1 1 22 22 ALA H H 1 8.17 0.03 . 1 . . . . 22 ALA H . 6643 1 170 . 1 1 22 22 ALA HA H 1 4.02 0.03 . 1 . . . . 22 ALA HA . 6643 1 171 . 1 1 22 22 ALA HB1 H 1 1.40 0.03 . 1 . . . . 22 ALA HB . 6643 1 172 . 1 1 22 22 ALA HB2 H 1 1.40 0.03 . 1 . . . . 22 ALA HB . 6643 1 173 . 1 1 22 22 ALA HB3 H 1 1.40 0.03 . 1 . . . . 22 ALA HB . 6643 1 174 . 1 1 22 22 ALA C C 13 178.71 0.40 . 1 . . . . 22 ALA C . 6643 1 175 . 1 1 22 22 ALA CA C 13 55.58 0.40 . 1 . . . . 22 ALA CA . 6643 1 176 . 1 1 22 22 ALA CB C 13 18.28 0.40 . 1 . . . . 22 ALA CB . 6643 1 177 . 1 1 22 22 ALA N N 15 122.06 0.10 . 1 . . . . 22 ALA N . 6643 1 178 . 1 1 23 23 VAL H H 1 8.04 0.03 . 1 . . . . 23 VAL H . 6643 1 179 . 1 1 23 23 VAL HA H 1 4.57 0.03 . 1 . . . . 23 VAL HA . 6643 1 180 . 1 1 23 23 VAL HB H 1 2.36 0.03 . 1 . . . . 23 VAL HB . 6643 1 181 . 1 1 23 23 VAL HG11 H 1 1.08 0.03 . 2 . . . . 23 VAL HG1 . 6643 1 182 . 1 1 23 23 VAL HG12 H 1 1.08 0.03 . 2 . . . . 23 VAL HG1 . 6643 1 183 . 1 1 23 23 VAL HG13 H 1 1.08 0.03 . 2 . . . . 23 VAL HG1 . 6643 1 184 . 1 1 23 23 VAL HG21 H 1 1.18 0.03 . 2 . . . . 23 VAL HG2 . 6643 1 185 . 1 1 23 23 VAL HG22 H 1 1.18 0.03 . 2 . . . . 23 VAL HG2 . 6643 1 186 . 1 1 23 23 VAL HG23 H 1 1.18 0.03 . 2 . . . . 23 VAL HG2 . 6643 1 187 . 1 1 23 23 VAL C C 13 179.22 0.40 . 1 . . . . 23 VAL C . 6643 1 188 . 1 1 23 23 VAL CA C 13 64.34 0.40 . 1 . . . . 23 VAL CA . 6643 1 189 . 1 1 23 23 VAL CB C 13 31.59 0.40 . 1 . . . . 23 VAL CB . 6643 1 190 . 1 1 23 23 VAL CG1 C 13 22.05 0.40 . 2 . . . . 23 VAL CG1 . 6643 1 191 . 1 1 23 23 VAL CG2 C 13 22.03 0.40 . 2 . . . . 23 VAL CG2 . 6643 1 192 . 1 1 23 23 VAL N N 15 113.23 0.10 . 1 . . . . 23 VAL N . 6643 1 193 . 1 1 24 24 VAL H H 1 7.45 0.03 . 1 . . . . 24 VAL H . 6643 1 194 . 1 1 24 24 VAL HA H 1 3.82 0.03 . 1 . . . . 24 VAL HA . 6643 1 195 . 1 1 24 24 VAL HB H 1 2.21 0.03 . 1 . . . . 24 VAL HB . 6643 1 196 . 1 1 24 24 VAL HG11 H 1 0.94 0.03 . 2 . . . . 24 VAL HG1 . 6643 1 197 . 1 1 24 24 VAL HG12 H 1 0.94 0.03 . 2 . . . . 24 VAL HG1 . 6643 1 198 . 1 1 24 24 VAL HG13 H 1 0.94 0.03 . 2 . . . . 24 VAL HG1 . 6643 1 199 . 1 1 24 24 VAL HG21 H 1 1.08 0.03 . 2 . . . . 24 VAL HG2 . 6643 1 200 . 1 1 24 24 VAL HG22 H 1 1.08 0.03 . 2 . . . . 24 VAL HG2 . 6643 1 201 . 1 1 24 24 VAL HG23 H 1 1.08 0.03 . 2 . . . . 24 VAL HG2 . 6643 1 202 . 1 1 24 24 VAL C C 13 179.19 0.40 . 1 . . . . 24 VAL C . 6643 1 203 . 1 1 24 24 VAL CA C 13 66.53 0.40 . 1 . . . . 24 VAL CA . 6643 1 204 . 1 1 24 24 VAL CB C 13 31.50 0.40 . 1 . . . . 24 VAL CB . 6643 1 205 . 1 1 24 24 VAL CG1 C 13 21.44 0.40 . 2 . . . . 24 VAL CG1 . 6643 1 206 . 1 1 24 24 VAL CG2 C 13 23.05 0.40 . 2 . . . . 24 VAL CG2 . 6643 1 207 . 1 1 24 24 VAL N N 15 122.26 0.10 . 1 . . . . 24 VAL N . 6643 1 208 . 1 1 25 25 LEU H H 1 7.87 0.03 . 1 . . . . 25 LEU H . 6643 1 209 . 1 1 25 25 LEU HA H 1 4.29 0.03 . 1 . . . . 25 LEU HA . 6643 1 210 . 1 1 25 25 LEU HB2 H 1 1.53 0.03 . 2 . . . . 25 LEU HB2 . 6643 1 211 . 1 1 25 25 LEU HB3 H 1 2.07 0.03 . 2 . . . . 25 LEU HB3 . 6643 1 212 . 1 1 25 25 LEU HG H 1 1.83 0.03 . 1 . . . . 25 LEU HG . 6643 1 213 . 1 1 25 25 LEU HD11 H 1 1.01 0.03 . 2 . . . . 25 LEU HD1 . 6643 1 214 . 1 1 25 25 LEU HD12 H 1 1.01 0.03 . 2 . . . . 25 LEU HD1 . 6643 1 215 . 1 1 25 25 LEU HD13 H 1 1.01 0.03 . 2 . . . . 25 LEU HD1 . 6643 1 216 . 1 1 25 25 LEU HD21 H 1 0.93 0.03 . 2 . . . . 25 LEU HD2 . 6643 1 217 . 1 1 25 25 LEU HD22 H 1 0.93 0.03 . 2 . . . . 25 LEU HD2 . 6643 1 218 . 1 1 25 25 LEU HD23 H 1 0.93 0.03 . 2 . . . . 25 LEU HD2 . 6643 1 219 . 1 1 25 25 LEU C C 13 178.99 0.40 . 1 . . . . 25 LEU C . 6643 1 220 . 1 1 25 25 LEU CA C 13 58.06 0.40 . 1 . . . . 25 LEU CA . 6643 1 221 . 1 1 25 25 LEU CB C 13 43.20 0.40 . 1 . . . . 25 LEU CB . 6643 1 222 . 1 1 25 25 LEU CG C 13 27.31 0.40 . 1 . . . . 25 LEU CG . 6643 1 223 . 1 1 25 25 LEU CD1 C 13 24.15 0.40 . 2 . . . . 25 LEU CD1 . 6643 1 224 . 1 1 25 25 LEU CD2 C 13 24.97 0.40 . 2 . . . . 25 LEU CD2 . 6643 1 225 . 1 1 25 25 LEU N N 15 120.27 0.10 . 1 . . . . 25 LEU N . 6643 1 226 . 1 1 26 26 SER H H 1 9.37 0.03 . 1 . . . . 26 SER H . 6643 1 227 . 1 1 26 26 SER HB2 H 1 3.90 0.03 . 2 . . . . 26 SER HB2 . 6643 1 228 . 1 1 26 26 SER C C 13 177.97 0.40 . 1 . . . . 26 SER C . 6643 1 229 . 1 1 26 26 SER CA C 13 62.79 0.40 . 1 . . . . 26 SER CA . 6643 1 230 . 1 1 26 26 SER CB C 13 61.92 0.40 . 1 . . . . 26 SER CB . 6643 1 231 . 1 1 26 26 SER N N 15 116.18 0.10 . 1 . . . . 26 SER N . 6643 1 232 . 1 1 27 27 HIS H H 1 7.96 0.03 . 1 . . . . 27 HIS H . 6643 1 233 . 1 1 27 27 HIS HA H 1 4.29 0.03 . 1 . . . . 27 HIS HA . 6643 1 234 . 1 1 27 27 HIS HB2 H 1 3.60 0.03 . 2 . . . . 27 HIS HB2 . 6643 1 235 . 1 1 27 27 HIS HB3 H 1 3.37 0.03 . 2 . . . . 27 HIS HB3 . 6643 1 236 . 1 1 27 27 HIS HD2 H 1 7.10 0.03 . 1 . . . . 27 HIS HD2 . 6643 1 237 . 1 1 27 27 HIS C C 13 177.48 0.40 . 1 . . . . 27 HIS C . 6643 1 238 . 1 1 27 27 HIS CA C 13 60.13 0.40 . 1 . . . . 27 HIS CA . 6643 1 239 . 1 1 27 27 HIS CB C 13 30.37 0.40 . 1 . . . . 27 HIS CB . 6643 1 240 . 1 1 27 27 HIS N N 15 125.85 0.10 . 1 . . . . 27 HIS N . 6643 1 241 . 1 1 28 28 TYR H H 1 7.97 0.03 . 1 . . . . 28 TYR H . 6643 1 242 . 1 1 28 28 TYR HA H 1 4.40 0.03 . 1 . . . . 28 TYR HA . 6643 1 243 . 1 1 28 28 TYR HB2 H 1 3.33 0.03 . 2 . . . . 28 TYR HB2 . 6643 1 244 . 1 1 28 28 TYR HB3 H 1 3.45 0.03 . 2 . . . . 28 TYR HB3 . 6643 1 245 . 1 1 28 28 TYR HD1 H 1 7.10 0.03 . 3 . . . . 28 TYR HD1 . 6643 1 246 . 1 1 28 28 TYR HE1 H 1 6.81 0.03 . 3 . . . . 28 TYR HE1 . 6643 1 247 . 1 1 28 28 TYR C C 13 177.98 0.40 . 1 . . . . 28 TYR C . 6643 1 248 . 1 1 28 28 TYR CA C 13 60.31 0.40 . 1 . . . . 28 TYR CA . 6643 1 249 . 1 1 28 28 TYR CB C 13 38.87 0.40 . 1 . . . . 28 TYR CB . 6643 1 250 . 1 1 28 28 TYR CD1 C 13 132.43 0.40 . 3 . . . . 28 TYR CD1 . 6643 1 251 . 1 1 28 28 TYR CE1 C 13 118.26 0.40 . 3 . . . . 28 TYR CE1 . 6643 1 252 . 1 1 28 28 TYR N N 15 120.79 0.10 . 1 . . . . 28 TYR N . 6643 1 253 . 1 1 29 29 ILE H H 1 8.93 0.03 . 1 . . . . 29 ILE H . 6643 1 254 . 1 1 29 29 ILE HA H 1 3.34 0.03 . 1 . . . . 29 ILE HA . 6643 1 255 . 1 1 29 29 ILE HB H 1 1.78 0.03 . 1 . . . . 29 ILE HB . 6643 1 256 . 1 1 29 29 ILE HG21 H 1 0.76 0.03 . 1 . . . . 29 ILE HG2 . 6643 1 257 . 1 1 29 29 ILE HG22 H 1 0.76 0.03 . 1 . . . . 29 ILE HG2 . 6643 1 258 . 1 1 29 29 ILE HG23 H 1 0.76 0.03 . 1 . . . . 29 ILE HG2 . 6643 1 259 . 1 1 29 29 ILE HD11 H 1 0.77 0.03 . 1 . . . . 29 ILE HD1 . 6643 1 260 . 1 1 29 29 ILE HD12 H 1 0.77 0.03 . 1 . . . . 29 ILE HD1 . 6643 1 261 . 1 1 29 29 ILE HD13 H 1 0.77 0.03 . 1 . . . . 29 ILE HD1 . 6643 1 262 . 1 1 29 29 ILE C C 13 178.36 0.40 . 1 . . . . 29 ILE C . 6643 1 263 . 1 1 29 29 ILE CA C 13 66.26 0.40 . 1 . . . . 29 ILE CA . 6643 1 264 . 1 1 29 29 ILE CB C 13 38.44 0.40 . 1 . . . . 29 ILE CB . 6643 1 265 . 1 1 29 29 ILE CG2 C 13 17.04 0.40 . 1 . . . . 29 ILE CG2 . 6643 1 266 . 1 1 29 29 ILE CD1 C 13 14.94 0.40 . 1 . . . . 29 ILE CD1 . 6643 1 267 . 1 1 29 29 ILE N N 15 118.81 0.10 . 1 . . . . 29 ILE N . 6643 1 268 . 1 1 30 30 HIS H H 1 8.25 0.03 . 1 . . . . 30 HIS H . 6643 1 269 . 1 1 30 30 HIS HA H 1 4.47 0.03 . 1 . . . . 30 HIS HA . 6643 1 270 . 1 1 30 30 HIS HB2 H 1 3.22 0.03 . 2 . . . . 30 HIS HB2 . 6643 1 271 . 1 1 30 30 HIS HB3 H 1 2.93 0.03 . 2 . . . . 30 HIS HB3 . 6643 1 272 . 1 1 30 30 HIS HD2 H 1 6.88 0.03 . 1 . . . . 30 HIS HD2 . 6643 1 273 . 1 1 30 30 HIS C C 13 177.92 0.40 . 1 . . . . 30 HIS C . 6643 1 274 . 1 1 30 30 HIS CA C 13 59.00 0.40 . 1 . . . . 30 HIS CA . 6643 1 275 . 1 1 30 30 HIS CB C 13 28.28 0.40 . 1 . . . . 30 HIS CB . 6643 1 276 . 1 1 30 30 HIS N N 15 120.52 0.10 . 1 . . . . 30 HIS N . 6643 1 277 . 1 1 31 31 ASN H H 1 8.21 0.03 . 1 . . . . 31 ASN H . 6643 1 278 . 1 1 31 31 ASN HA H 1 4.07 0.03 . 1 . . . . 31 ASN HA . 6643 1 279 . 1 1 31 31 ASN HB2 H 1 2.71 0.03 . 2 . . . . 31 ASN HB2 . 6643 1 280 . 1 1 31 31 ASN C C 13 177.57 0.40 . 1 . . . . 31 ASN C . 6643 1 281 . 1 1 31 31 ASN CA C 13 57.00 0.40 . 1 . . . . 31 ASN CA . 6643 1 282 . 1 1 31 31 ASN CB C 13 38.00 0.40 . 1 . . . . 31 ASN CB . 6643 1 283 . 1 1 31 31 ASN N N 15 120.81 0.10 . 1 . . . . 31 ASN N . 6643 1 284 . 1 1 32 32 LEU H H 1 8.60 0.03 . 1 . . . . 32 LEU H . 6643 1 285 . 1 1 32 32 LEU HA H 1 3.92 0.03 . 1 . . . . 32 LEU HA . 6643 1 286 . 1 1 32 32 LEU HB2 H 1 1.12 0.03 . 2 . . . . 32 LEU HB2 . 6643 1 287 . 1 1 32 32 LEU HB3 H 1 1.66 0.03 . 2 . . . . 32 LEU HB3 . 6643 1 288 . 1 1 32 32 LEU HG H 1 1.34 0.03 . 1 . . . . 32 LEU HG . 6643 1 289 . 1 1 32 32 LEU HD11 H 1 0.42 0.03 . 1 . . . . 32 LEU HD1 . 6643 1 290 . 1 1 32 32 LEU HD12 H 1 0.42 0.03 . 1 . . . . 32 LEU HD1 . 6643 1 291 . 1 1 32 32 LEU HD13 H 1 0.42 0.03 . 1 . . . . 32 LEU HD1 . 6643 1 292 . 1 1 32 32 LEU HD21 H 1 0.74 0.03 . 1 . . . . 32 LEU HD2 . 6643 1 293 . 1 1 32 32 LEU HD22 H 1 0.74 0.03 . 1 . . . . 32 LEU HD2 . 6643 1 294 . 1 1 32 32 LEU HD23 H 1 0.74 0.03 . 1 . . . . 32 LEU HD2 . 6643 1 295 . 1 1 32 32 LEU C C 13 179.54 0.40 . 1 . . . . 32 LEU C . 6643 1 296 . 1 1 32 32 LEU CA C 13 58.15 0.40 . 1 . . . . 32 LEU CA . 6643 1 297 . 1 1 32 32 LEU CB C 13 43.16 0.40 . 1 . . . . 32 LEU CB . 6643 1 298 . 1 1 32 32 LEU CG C 13 26.96 0.40 . 1 . . . . 32 LEU CG . 6643 1 299 . 1 1 32 32 LEU CD1 C 13 25.36 0.40 . 1 . . . . 32 LEU CD1 . 6643 1 300 . 1 1 32 32 LEU CD2 C 13 23.46 0.40 . 1 . . . . 32 LEU CD2 . 6643 1 301 . 1 1 32 32 LEU N N 15 120.48 0.10 . 1 . . . . 32 LEU N . 6643 1 302 . 1 1 33 33 SER H H 1 8.61 0.03 . 1 . . . . 33 SER H . 6643 1 303 . 1 1 33 33 SER HA H 1 3.91 0.03 . 1 . . . . 33 SER HA . 6643 1 304 . 1 1 33 33 SER HB2 H 1 3.81 0.03 . 2 . . . . 33 SER HB2 . 6643 1 305 . 1 1 33 33 SER HB3 H 1 3.56 0.03 . 2 . . . . 33 SER HB3 . 6643 1 306 . 1 1 33 33 SER CA C 13 62.49 0.40 . 1 . . . . 33 SER CA . 6643 1 307 . 1 1 33 33 SER CB C 13 62.41 0.40 . 1 . . . . 33 SER CB . 6643 1 308 . 1 1 33 33 SER N N 15 116.03 0.10 . 1 . . . . 33 SER N . 6643 1 309 . 1 1 34 34 SER H H 1 8.11 0.03 . 1 . . . . 34 SER H . 6643 1 310 . 1 1 34 34 SER HB2 H 1 4.00 0.03 . 2 . . . . 34 SER HB2 . 6643 1 311 . 1 1 34 34 SER HB3 H 1 3.86 0.03 . 2 . . . . 34 SER HB3 . 6643 1 312 . 1 1 34 34 SER CA C 13 62.47 0.40 . 1 . . . . 34 SER CA . 6643 1 313 . 1 1 34 34 SER CB C 13 62.50 0.40 . 1 . . . . 34 SER CB . 6643 1 314 . 1 1 34 34 SER N N 15 120.68 0.10 . 1 . . . . 34 SER N . 6643 1 315 . 1 1 35 35 GLU H H 1 8.32 0.03 . 1 . . . . 35 GLU H . 6643 1 316 . 1 1 35 35 GLU HA H 1 4.13 0.03 . 1 . . . . 35 GLU HA . 6643 1 317 . 1 1 35 35 GLU HB2 H 1 2.23 0.03 . 2 . . . . 35 GLU HB2 . 6643 1 318 . 1 1 35 35 GLU HB3 H 1 2.13 0.03 . 2 . . . . 35 GLU HB3 . 6643 1 319 . 1 1 35 35 GLU HG2 H 1 2.47 0.03 . 2 . . . . 35 GLU HG2 . 6643 1 320 . 1 1 35 35 GLU C C 13 179.09 0.40 . 1 . . . . 35 GLU C . 6643 1 321 . 1 1 35 35 GLU CA C 13 59.39 0.40 . 1 . . . . 35 GLU CA . 6643 1 322 . 1 1 35 35 GLU CB C 13 29.78 0.40 . 1 . . . . 35 GLU CB . 6643 1 323 . 1 1 35 35 GLU CG C 13 36.46 0.40 . 1 . . . . 35 GLU CG . 6643 1 324 . 1 1 35 35 GLU N N 15 123.13 0.10 . 1 . . . . 35 GLU N . 6643 1 325 . 1 1 36 36 MET H H 1 8.85 0.03 . 1 . . . . 36 MET H . 6643 1 326 . 1 1 36 36 MET HA H 1 3.92 0.03 . 1 . . . . 36 MET HA . 6643 1 327 . 1 1 36 36 MET HB2 H 1 2.03 0.03 . 2 . . . . 36 MET HB2 . 6643 1 328 . 1 1 36 36 MET HB3 H 1 2.26 0.03 . 2 . . . . 36 MET HB3 . 6643 1 329 . 1 1 36 36 MET HG2 H 1 2.50 0.03 . 2 . . . . 36 MET HG2 . 6643 1 330 . 1 1 36 36 MET HE1 H 1 1.92 0.03 . 1 . . . . 36 MET HE . 6643 1 331 . 1 1 36 36 MET HE2 H 1 1.92 0.03 . 1 . . . . 36 MET HE . 6643 1 332 . 1 1 36 36 MET HE3 H 1 1.92 0.03 . 1 . . . . 36 MET HE . 6643 1 333 . 1 1 36 36 MET C C 13 177.30 0.40 . 1 . . . . 36 MET C . 6643 1 334 . 1 1 36 36 MET CA C 13 60.24 0.40 . 1 . . . . 36 MET CA . 6643 1 335 . 1 1 36 36 MET CB C 13 33.66 0.40 . 1 . . . . 36 MET CB . 6643 1 336 . 1 1 36 36 MET CG C 13 32.10 0.40 . 1 . . . . 36 MET CG . 6643 1 337 . 1 1 36 36 MET CE C 13 17.53 0.40 . 1 . . . . 36 MET CE . 6643 1 338 . 1 1 36 36 MET N N 15 119.27 0.10 . 1 . . . . 36 MET N . 6643 1 339 . 1 1 37 37 PHE H H 1 8.04 0.03 . 1 . . . . 37 PHE H . 6643 1 340 . 1 1 37 37 PHE HA H 1 4.11 0.03 . 1 . . . . 37 PHE HA . 6643 1 341 . 1 1 37 37 PHE HB2 H 1 3.21 0.03 . 2 . . . . 37 PHE HB2 . 6643 1 342 . 1 1 37 37 PHE HB3 H 1 3.13 0.03 . 2 . . . . 37 PHE HB3 . 6643 1 343 . 1 1 37 37 PHE HD1 H 1 7.06 0.03 . 3 . . . . 37 PHE HD1 . 6643 1 344 . 1 1 37 37 PHE HE1 H 1 6.97 0.03 . 3 . . . . 37 PHE HE1 . 6643 1 345 . 1 1 37 37 PHE C C 13 176.43 0.40 . 1 . . . . 37 PHE C . 6643 1 346 . 1 1 37 37 PHE CA C 13 62.21 0.40 . 1 . . . . 37 PHE CA . 6643 1 347 . 1 1 37 37 PHE CB C 13 39.10 0.40 . 1 . . . . 37 PHE CB . 6643 1 348 . 1 1 37 37 PHE CD1 C 13 131.16 0.40 . 3 . . . . 37 PHE CD1 . 6643 1 349 . 1 1 37 37 PHE CE1 C 13 131.19 0.40 . 3 . . . . 37 PHE CE1 . 6643 1 350 . 1 1 37 37 PHE N N 15 117.65 0.10 . 1 . . . . 37 PHE N . 6643 1 351 . 1 1 38 38 SER H H 1 8.24 0.03 . 1 . . . . 38 SER H . 6643 1 352 . 1 1 38 38 SER HA H 1 4.15 0.03 . 1 . . . . 38 SER HA . 6643 1 353 . 1 1 38 38 SER HB2 H 1 4.08 0.03 . 2 . . . . 38 SER HB2 . 6643 1 354 . 1 1 38 38 SER C C 13 177.06 0.40 . 1 . . . . 38 SER C . 6643 1 355 . 1 1 38 38 SER CA C 13 61.96 0.40 . 1 . . . . 38 SER CA . 6643 1 356 . 1 1 38 38 SER CB C 13 62.92 0.40 . 1 . . . . 38 SER CB . 6643 1 357 . 1 1 38 38 SER N N 15 114.09 0.10 . 1 . . . . 38 SER N . 6643 1 358 . 1 1 39 39 GLU H H 1 8.39 0.03 . 1 . . . . 39 GLU H . 6643 1 359 . 1 1 39 39 GLU HA H 1 4.03 0.03 . 1 . . . . 39 GLU HA . 6643 1 360 . 1 1 39 39 GLU HB2 H 1 2.15 0.03 . 2 . . . . 39 GLU HB2 . 6643 1 361 . 1 1 39 39 GLU HB3 H 1 2.11 0.03 . 2 . . . . 39 GLU HB3 . 6643 1 362 . 1 1 39 39 GLU HG2 H 1 2.37 0.03 . 2 . . . . 39 GLU HG2 . 6643 1 363 . 1 1 39 39 GLU C C 13 178.70 0.40 . 1 . . . . 39 GLU C . 6643 1 364 . 1 1 39 39 GLU CA C 13 59.08 0.40 . 1 . . . . 39 GLU CA . 6643 1 365 . 1 1 39 39 GLU CB C 13 29.68 0.40 . 1 . . . . 39 GLU CB . 6643 1 366 . 1 1 39 39 GLU N N 15 120.68 0.10 . 1 . . . . 39 GLU N . 6643 1 367 . 1 1 40 40 PHE H H 1 8.37 0.03 . 1 . . . . 40 PHE H . 6643 1 368 . 1 1 40 40 PHE HA H 1 4.03 0.03 . 1 . . . . 40 PHE HA . 6643 1 369 . 1 1 40 40 PHE HB2 H 1 3.25 0.03 . 2 . . . . 40 PHE HB2 . 6643 1 370 . 1 1 40 40 PHE HB3 H 1 3.01 0.03 . 2 . . . . 40 PHE HB3 . 6643 1 371 . 1 1 40 40 PHE C C 13 176.87 0.40 . 1 . . . . 40 PHE C . 6643 1 372 . 1 1 40 40 PHE CA C 13 62.44 0.40 . 1 . . . . 40 PHE CA . 6643 1 373 . 1 1 40 40 PHE CB C 13 40.47 0.40 . 1 . . . . 40 PHE CB . 6643 1 374 . 1 1 40 40 PHE N N 15 120.85 0.10 . 1 . . . . 40 PHE N . 6643 1 375 . 1 1 41 41 ASP H H 1 8.70 0.03 . 1 . . . . 41 ASP H . 6643 1 376 . 1 1 41 41 ASP HA H 1 4.89 0.03 . 1 . . . . 41 ASP HA . 6643 1 377 . 1 1 41 41 ASP HB2 H 1 2.32 0.03 . 2 . . . . 41 ASP HB2 . 6643 1 378 . 1 1 41 41 ASP HB3 H 1 2.60 0.03 . 2 . . . . 41 ASP HB3 . 6643 1 379 . 1 1 41 41 ASP C C 13 178.71 0.40 . 1 . . . . 41 ASP C . 6643 1 380 . 1 1 41 41 ASP CA C 13 56.06 0.40 . 1 . . . . 41 ASP CA . 6643 1 381 . 1 1 41 41 ASP CB C 13 42.33 0.40 . 1 . . . . 41 ASP CB . 6643 1 382 . 1 1 41 41 ASP N N 15 119.65 0.10 . 1 . . . . 41 ASP N . 6643 1 383 . 1 1 42 42 LYS H H 1 8.05 0.03 . 1 . . . . 42 LYS H . 6643 1 384 . 1 1 42 42 LYS HA H 1 3.85 0.03 . 1 . . . . 42 LYS HA . 6643 1 385 . 1 1 42 42 LYS HB2 H 1 1.79 0.03 . 2 . . . . 42 LYS HB2 . 6643 1 386 . 1 1 42 42 LYS HB3 H 1 1.88 0.03 . 2 . . . . 42 LYS HB3 . 6643 1 387 . 1 1 42 42 LYS HG2 H 1 1.40 0.03 . 2 . . . . 42 LYS HG2 . 6643 1 388 . 1 1 42 42 LYS HG3 H 1 1.49 0.03 . 2 . . . . 42 LYS HG3 . 6643 1 389 . 1 1 42 42 LYS HD2 H 1 1.61 0.03 . 2 . . . . 42 LYS HD2 . 6643 1 390 . 1 1 42 42 LYS HE2 H 1 2.88 0.03 . 2 . . . . 42 LYS HE2 . 6643 1 391 . 1 1 42 42 LYS C C 13 178.02 0.40 . 1 . . . . 42 LYS C . 6643 1 392 . 1 1 42 42 LYS CA C 13 59.20 0.40 . 1 . . . . 42 LYS CA . 6643 1 393 . 1 1 42 42 LYS CB C 13 32.55 0.40 . 1 . . . . 42 LYS CB . 6643 1 394 . 1 1 42 42 LYS CG C 13 24.86 0.40 . 1 . . . . 42 LYS CG . 6643 1 395 . 1 1 42 42 LYS CD C 13 29.22 0.40 . 1 . . . . 42 LYS CD . 6643 1 396 . 1 1 42 42 LYS CE C 13 41.73 0.40 . 1 . . . . 42 LYS CE . 6643 1 397 . 1 1 42 42 LYS N N 15 116.57 0.10 . 1 . . . . 42 LYS N . 6643 1 398 . 1 1 43 43 ARG H H 1 7.36 0.03 . 1 . . . . 43 ARG H . 6643 1 399 . 1 1 43 43 ARG HA H 1 4.05 0.03 . 1 . . . . 43 ARG HA . 6643 1 400 . 1 1 43 43 ARG HB2 H 1 1.42 0.03 . 2 . . . . 43 ARG HB2 . 6643 1 401 . 1 1 43 43 ARG HB3 H 1 1.16 0.03 . 2 . . . . 43 ARG HB3 . 6643 1 402 . 1 1 43 43 ARG HG2 H 1 0.95 0.03 . 2 . . . . 43 ARG HG2 . 6643 1 403 . 1 1 43 43 ARG HG3 H 1 0.91 0.03 . 2 . . . . 43 ARG HG3 . 6643 1 404 . 1 1 43 43 ARG HD2 H 1 2.93 0.03 . 2 . . . . 43 ARG HD2 . 6643 1 405 . 1 1 43 43 ARG C C 13 177.40 0.40 . 1 . . . . 43 ARG C . 6643 1 406 . 1 1 43 43 ARG CA C 13 57.42 0.40 . 1 . . . . 43 ARG CA . 6643 1 407 . 1 1 43 43 ARG CB C 13 30.89 0.40 . 1 . . . . 43 ARG CB . 6643 1 408 . 1 1 43 43 ARG CG C 13 27.40 0.40 . 1 . . . . 43 ARG CG . 6643 1 409 . 1 1 43 43 ARG CD C 13 42.44 0.40 . 1 . . . . 43 ARG CD . 6643 1 410 . 1 1 43 43 ARG N N 15 115.86 0.10 . 1 . . . . 43 ARG N . 6643 1 411 . 1 1 44 44 TYR H H 1 8.11 0.03 . 1 . . . . 44 TYR H . 6643 1 412 . 1 1 44 44 TYR HA H 1 4.70 0.03 . 1 . . . . 44 TYR HA . 6643 1 413 . 1 1 44 44 TYR HB2 H 1 2.12 0.03 . 2 . . . . 44 TYR HB2 . 6643 1 414 . 1 1 44 44 TYR HB3 H 1 2.88 0.03 . 2 . . . . 44 TYR HB3 . 6643 1 415 . 1 1 44 44 TYR HD1 H 1 6.62 0.03 . 3 . . . . 44 TYR HD1 . 6643 1 416 . 1 1 44 44 TYR HE1 H 1 6.51 0.03 . 3 . . . . 44 TYR HE1 . 6643 1 417 . 1 1 44 44 TYR C C 13 176.47 0.40 . 1 . . . . 44 TYR C . 6643 1 418 . 1 1 44 44 TYR CA C 13 59.73 0.40 . 1 . . . . 44 TYR CA . 6643 1 419 . 1 1 44 44 TYR CB C 13 40.89 0.40 . 1 . . . . 44 TYR CB . 6643 1 420 . 1 1 44 44 TYR CD1 C 13 133.81 0.40 . 3 . . . . 44 TYR CD1 . 6643 1 421 . 1 1 44 44 TYR CE1 C 13 116.99 0.40 . 3 . . . . 44 TYR CE1 . 6643 1 422 . 1 1 44 44 TYR N N 15 114.47 0.10 . 1 . . . . 44 TYR N . 6643 1 423 . 1 1 45 45 THR H H 1 7.74 0.03 . 1 . . . . 45 THR H . 6643 1 424 . 1 1 45 45 THR HA H 1 4.34 0.03 . 1 . . . . 45 THR HA . 6643 1 425 . 1 1 45 45 THR HB H 1 4.29 0.03 . 1 . . . . 45 THR HB . 6643 1 426 . 1 1 45 45 THR HG21 H 1 1.18 0.03 . 1 . . . . 45 THR HG2 . 6643 1 427 . 1 1 45 45 THR HG22 H 1 1.18 0.03 . 1 . . . . 45 THR HG2 . 6643 1 428 . 1 1 45 45 THR HG23 H 1 1.18 0.03 . 1 . . . . 45 THR HG2 . 6643 1 429 . 1 1 45 45 THR CA C 13 62.93 0.40 . 1 . . . . 45 THR CA . 6643 1 430 . 1 1 45 45 THR CB C 13 69.23 0.40 . 1 . . . . 45 THR CB . 6643 1 431 . 1 1 45 45 THR CG2 C 13 23.38 0.40 . 1 . . . . 45 THR CG2 . 6643 1 432 . 1 1 45 45 THR N N 15 108.28 0.10 . 1 . . . . 45 THR N . 6643 1 433 . 1 1 46 46 HIS HA H 1 4.32 0.03 . 1 . . . . 46 HIS HA . 6643 1 434 . 1 1 46 46 HIS HB2 H 1 3.02 0.03 . 2 . . . . 46 HIS HB2 . 6643 1 435 . 1 1 46 46 HIS HB3 H 1 3.08 0.03 . 2 . . . . 46 HIS HB3 . 6643 1 436 . 1 1 46 46 HIS HD2 H 1 6.93 0.03 . 1 . . . . 46 HIS HD2 . 6643 1 437 . 1 1 46 46 HIS CA C 13 58.39 0.40 . 1 . . . . 46 HIS CA . 6643 1 438 . 1 1 46 46 HIS CB C 13 29.80 0.40 . 1 . . . . 46 HIS CB . 6643 1 439 . 1 1 48 48 ARG HA H 1 4.31 0.03 . 1 . . . . 48 ARG HA . 6643 1 440 . 1 1 48 48 ARG HB2 H 1 1.62 0.03 . 2 . . . . 48 ARG HB2 . 6643 1 441 . 1 1 48 48 ARG HB3 H 1 1.48 0.03 . 2 . . . . 48 ARG HB3 . 6643 1 442 . 1 1 48 48 ARG HG2 H 1 1.59 0.03 . 2 . . . . 48 ARG HG2 . 6643 1 443 . 1 1 48 48 ARG HG3 H 1 1.51 0.03 . 2 . . . . 48 ARG HG3 . 6643 1 444 . 1 1 48 48 ARG HD2 H 1 3.14 0.03 . 2 . . . . 48 ARG HD2 . 6643 1 445 . 1 1 48 48 ARG CA C 13 55.76 0.40 . 1 . . . . 48 ARG CA . 6643 1 446 . 1 1 48 48 ARG CB C 13 30.46 0.40 . 1 . . . . 48 ARG CB . 6643 1 447 . 1 1 48 48 ARG CG C 13 27.40 0.40 . 1 . . . . 48 ARG CG . 6643 1 448 . 1 1 48 48 ARG CD C 13 43.24 0.40 . 1 . . . . 48 ARG CD . 6643 1 449 . 1 1 50 50 PHE HA H 1 4.56 0.03 . 1 . . . . 50 PHE HA . 6643 1 450 . 1 1 50 50 PHE HB2 H 1 2.96 0.03 . 2 . . . . 50 PHE HB2 . 6643 1 451 . 1 1 50 50 PHE HD1 H 1 7.12 0.03 . 3 . . . . 50 PHE HD1 . 6643 1 452 . 1 1 50 50 PHE HE1 H 1 7.29 0.03 . 3 . . . . 50 PHE HE1 . 6643 1 453 . 1 1 50 50 PHE HZ H 1 7.25 0.03 . 1 . . . . 50 PHE HZ . 6643 1 454 . 1 1 50 50 PHE CA C 13 57.48 0.40 . 1 . . . . 50 PHE CA . 6643 1 455 . 1 1 50 50 PHE CB C 13 38.41 0.40 . 1 . . . . 50 PHE CB . 6643 1 456 . 1 1 50 50 PHE CD1 C 13 131.68 0.40 . 3 . . . . 50 PHE CD1 . 6643 1 457 . 1 1 50 50 PHE CE1 C 13 131.55 0.40 . 3 . . . . 50 PHE CE1 . 6643 1 458 . 1 1 50 50 PHE CZ C 13 129.55 0.40 . 1 . . . . 50 PHE CZ . 6643 1 459 . 1 1 51 51 ILE HA H 1 4.07 0.03 . 1 . . . . 51 ILE HA . 6643 1 460 . 1 1 51 51 ILE HB H 1 1.77 0.03 . 1 . . . . 51 ILE HB . 6643 1 461 . 1 1 51 51 ILE HG12 H 1 1.26 0.03 . 2 . . . . 51 ILE HG12 . 6643 1 462 . 1 1 51 51 ILE HG13 H 1 1.03 0.03 . 2 . . . . 51 ILE HG13 . 6643 1 463 . 1 1 51 51 ILE HG21 H 1 0.72 0.03 . 1 . . . . 51 ILE HG2 . 6643 1 464 . 1 1 51 51 ILE HG22 H 1 0.72 0.03 . 1 . . . . 51 ILE HG2 . 6643 1 465 . 1 1 51 51 ILE HG23 H 1 0.72 0.03 . 1 . . . . 51 ILE HG2 . 6643 1 466 . 1 1 51 51 ILE HD11 H 1 0.76 0.03 . 1 . . . . 51 ILE HD1 . 6643 1 467 . 1 1 51 51 ILE HD12 H 1 0.76 0.03 . 1 . . . . 51 ILE HD1 . 6643 1 468 . 1 1 51 51 ILE HD13 H 1 0.76 0.03 . 1 . . . . 51 ILE HD1 . 6643 1 469 . 1 1 51 51 ILE CA C 13 61.50 0.40 . 1 . . . . 51 ILE CA . 6643 1 470 . 1 1 51 51 ILE CB C 13 38.19 0.40 . 1 . . . . 51 ILE CB . 6643 1 471 . 1 1 51 51 ILE CG1 C 13 27.49 0.40 . 1 . . . . 51 ILE CG1 . 6643 1 472 . 1 1 51 51 ILE CG2 C 13 17.56 0.40 . 1 . . . . 51 ILE CG2 . 6643 1 473 . 1 1 51 51 ILE CD1 C 13 13.03 0.40 . 1 . . . . 51 ILE CD1 . 6643 1 474 . 1 1 53 53 LYS HA H 1 4.35 0.03 . 1 . . . . 53 LYS HA . 6643 1 475 . 1 1 53 53 LYS HB2 H 1 1.90 0.03 . 2 . . . . 53 LYS HB2 . 6643 1 476 . 1 1 53 53 LYS HB3 H 1 1.78 0.03 . 2 . . . . 53 LYS HB3 . 6643 1 477 . 1 1 53 53 LYS HG2 H 1 1.38 0.03 . 2 . . . . 53 LYS HG2 . 6643 1 478 . 1 1 53 53 LYS HG3 H 1 1.45 0.03 . 2 . . . . 53 LYS HG3 . 6643 1 479 . 1 1 53 53 LYS HD2 H 1 1.66 0.03 . 2 . . . . 53 LYS HD2 . 6643 1 480 . 1 1 53 53 LYS HE2 H 1 2.95 0.03 . 2 . . . . 53 LYS HE2 . 6643 1 481 . 1 1 53 53 LYS CA C 13 56.40 0.40 . 1 . . . . 53 LYS CA . 6643 1 482 . 1 1 53 53 LYS CB C 13 32.98 0.40 . 1 . . . . 53 LYS CB . 6643 1 483 . 1 1 53 53 LYS CG C 13 24.88 0.40 . 1 . . . . 53 LYS CG . 6643 1 484 . 1 1 53 53 LYS CD C 13 29.12 0.40 . 1 . . . . 53 LYS CD . 6643 1 485 . 1 1 53 53 LYS CE C 13 41.95 0.40 . 1 . . . . 53 LYS CE . 6643 1 486 . 1 1 54 54 ALA HA H 1 4.21 0.03 . 1 . . . . 54 ALA HA . 6643 1 487 . 1 1 54 54 ALA HB1 H 1 1.44 0.03 . 1 . . . . 54 ALA HB . 6643 1 488 . 1 1 54 54 ALA HB2 H 1 1.44 0.03 . 1 . . . . 54 ALA HB . 6643 1 489 . 1 1 54 54 ALA HB3 H 1 1.44 0.03 . 1 . . . . 54 ALA HB . 6643 1 490 . 1 1 54 54 ALA CA C 13 53.59 0.40 . 1 . . . . 54 ALA CA . 6643 1 491 . 1 1 54 54 ALA CB C 13 18.99 0.40 . 1 . . . . 54 ALA CB . 6643 1 492 . 1 1 55 55 ILE HA H 1 4.19 0.03 . 1 . . . . 55 ILE HA . 6643 1 493 . 1 1 55 55 ILE HB H 1 1.83 0.03 . 1 . . . . 55 ILE HB . 6643 1 494 . 1 1 55 55 ILE HG12 H 1 1.20 0.03 . 2 . . . . 55 ILE HG12 . 6643 1 495 . 1 1 55 55 ILE HG13 H 1 1.44 0.03 . 2 . . . . 55 ILE HG13 . 6643 1 496 . 1 1 55 55 ILE HG21 H 1 0.90 0.03 . 1 . . . . 55 ILE HG2 . 6643 1 497 . 1 1 55 55 ILE HG22 H 1 0.90 0.03 . 1 . . . . 55 ILE HG2 . 6643 1 498 . 1 1 55 55 ILE HG23 H 1 0.90 0.03 . 1 . . . . 55 ILE HG2 . 6643 1 499 . 1 1 55 55 ILE HD11 H 1 0.83 0.03 . 1 . . . . 55 ILE HD1 . 6643 1 500 . 1 1 55 55 ILE HD12 H 1 0.83 0.03 . 1 . . . . 55 ILE HD1 . 6643 1 501 . 1 1 55 55 ILE HD13 H 1 0.83 0.03 . 1 . . . . 55 ILE HD1 . 6643 1 502 . 1 1 55 55 ILE CA C 13 61.33 0.40 . 1 . . . . 55 ILE CA . 6643 1 503 . 1 1 55 55 ILE CB C 13 38.60 0.40 . 1 . . . . 55 ILE CB . 6643 1 504 . 1 1 55 55 ILE CG1 C 13 27.25 0.40 . 1 . . . . 55 ILE CG1 . 6643 1 505 . 1 1 55 55 ILE CG2 C 13 17.67 0.40 . 1 . . . . 55 ILE CG2 . 6643 1 506 . 1 1 55 55 ILE CD1 C 13 13.07 0.40 . 1 . . . . 55 ILE CD1 . 6643 1 507 . 1 1 56 56 ASN HA H 1 4.85 0.03 . 1 . . . . 56 ASN HA . 6643 1 508 . 1 1 56 56 ASN HB2 H 1 2.76 0.03 . 2 . . . . 56 ASN HB2 . 6643 1 509 . 1 1 56 56 ASN HB3 H 1 2.91 0.03 . 2 . . . . 56 ASN HB3 . 6643 1 510 . 1 1 56 56 ASN CA C 13 53.35 0.40 . 1 . . . . 56 ASN CA . 6643 1 511 . 1 1 56 56 ASN CB C 13 39.15 0.40 . 1 . . . . 56 ASN CB . 6643 1 512 . 1 1 57 57 SER HA H 1 4.62 0.03 . 1 . . . . 57 SER HA . 6643 1 513 . 1 1 57 57 SER HB2 H 1 3.90 0.03 . 2 . . . . 57 SER HB2 . 6643 1 514 . 1 1 57 57 SER CA C 13 57.94 0.40 . 1 . . . . 57 SER CA . 6643 1 515 . 1 1 57 57 SER CB C 13 63.84 0.40 . 1 . . . . 57 SER CB . 6643 1 516 . 1 1 60 60 THR H H 1 7.40 0.03 . 1 . . . . 60 THR H . 6643 1 517 . 1 1 60 60 THR HA H 1 3.99 0.03 . 1 . . . . 60 THR HA . 6643 1 518 . 1 1 60 60 THR HB H 1 4.46 0.03 . 1 . . . . 60 THR HB . 6643 1 519 . 1 1 60 60 THR HG21 H 1 0.63 0.03 . 1 . . . . 60 THR HG2 . 6643 1 520 . 1 1 60 60 THR HG22 H 1 0.63 0.03 . 1 . . . . 60 THR HG2 . 6643 1 521 . 1 1 60 60 THR HG23 H 1 0.63 0.03 . 1 . . . . 60 THR HG2 . 6643 1 522 . 1 1 60 60 THR CA C 13 61.97 0.40 . 1 . . . . 60 THR CA . 6643 1 523 . 1 1 60 60 THR CB C 13 68.15 0.40 . 1 . . . . 60 THR CB . 6643 1 524 . 1 1 60 60 THR CG2 C 13 21.88 0.40 . 1 . . . . 60 THR CG2 . 6643 1 525 . 1 1 60 60 THR N N 15 107.91 0.10 . 1 . . . . 60 THR N . 6643 1 526 . 1 1 61 61 SER H H 1 7.91 0.03 . 1 . . . . 61 SER H . 6643 1 527 . 1 1 61 61 SER CA C 13 61.49 0.40 . 1 . . . . 61 SER CA . 6643 1 528 . 1 1 61 61 SER CB C 13 63.21 0.40 . 1 . . . . 61 SER CB . 6643 1 529 . 1 1 61 61 SER N N 15 117.96 0.10 . 1 . . . . 61 SER N . 6643 1 530 . 1 1 62 62 SER HA H 1 4.35 0.03 . 1 . . . . 62 SER HA . 6643 1 531 . 1 1 62 62 SER HB2 H 1 3.87 0.03 . 2 . . . . 62 SER HB2 . 6643 1 532 . 1 1 62 62 SER HB3 H 1 3.98 0.03 . 2 . . . . 62 SER HB3 . 6643 1 533 . 1 1 62 62 SER C C 13 174.87 0.40 . 1 . . . . 62 SER C . 6643 1 534 . 1 1 62 62 SER CA C 13 59.07 0.40 . 1 . . . . 62 SER CA . 6643 1 535 . 1 1 62 62 SER CB C 13 62.78 0.40 . 1 . . . . 62 SER CB . 6643 1 536 . 1 1 63 63 LEU H H 1 7.50 0.03 . 1 . . . . 63 LEU H . 6643 1 537 . 1 1 63 63 LEU HA H 1 4.37 0.03 . 1 . . . . 63 LEU HA . 6643 1 538 . 1 1 63 63 LEU HB2 H 1 1.37 0.03 . 2 . . . . 63 LEU HB2 . 6643 1 539 . 1 1 63 63 LEU HB3 H 1 1.85 0.03 . 2 . . . . 63 LEU HB3 . 6643 1 540 . 1 1 63 63 LEU HG H 1 1.59 0.03 . 1 . . . . 63 LEU HG . 6643 1 541 . 1 1 63 63 LEU HD11 H 1 0.89 0.03 . 2 . . . . 63 LEU HD1 . 6643 1 542 . 1 1 63 63 LEU HD12 H 1 0.89 0.03 . 2 . . . . 63 LEU HD1 . 6643 1 543 . 1 1 63 63 LEU HD13 H 1 0.89 0.03 . 2 . . . . 63 LEU HD1 . 6643 1 544 . 1 1 63 63 LEU HD21 H 1 0.90 0.03 . 2 . . . . 63 LEU HD2 . 6643 1 545 . 1 1 63 63 LEU HD22 H 1 0.90 0.03 . 2 . . . . 63 LEU HD2 . 6643 1 546 . 1 1 63 63 LEU HD23 H 1 0.90 0.03 . 2 . . . . 63 LEU HD2 . 6643 1 547 . 1 1 63 63 LEU C C 13 176.15 0.40 . 1 . . . . 63 LEU C . 6643 1 548 . 1 1 63 63 LEU CA C 13 54.34 0.40 . 1 . . . . 63 LEU CA . 6643 1 549 . 1 1 63 63 LEU CB C 13 42.56 0.40 . 1 . . . . 63 LEU CB . 6643 1 550 . 1 1 63 63 LEU CG C 13 27.08 0.40 . 1 . . . . 63 LEU CG . 6643 1 551 . 1 1 63 63 LEU CD1 C 13 25.98 0.40 . 2 . . . . 63 LEU CD1 . 6643 1 552 . 1 1 63 63 LEU CD2 C 13 23.35 0.40 . 2 . . . . 63 LEU CD2 . 6643 1 553 . 1 1 63 63 LEU N N 15 122.79 0.10 . 1 . . . . 63 LEU N . 6643 1 554 . 1 1 64 64 ALA H H 1 8.34 0.03 . 1 . . . . 64 ALA H . 6643 1 555 . 1 1 64 64 ALA HA H 1 4.43 0.03 . 1 . . . . 64 ALA HA . 6643 1 556 . 1 1 64 64 ALA HB1 H 1 1.32 0.03 . 1 . . . . 64 ALA HB . 6643 1 557 . 1 1 64 64 ALA HB2 H 1 1.32 0.03 . 1 . . . . 64 ALA HB . 6643 1 558 . 1 1 64 64 ALA HB3 H 1 1.32 0.03 . 1 . . . . 64 ALA HB . 6643 1 559 . 1 1 64 64 ALA C C 13 176.85 0.40 . 1 . . . . 64 ALA C . 6643 1 560 . 1 1 64 64 ALA CA C 13 51.92 0.40 . 1 . . . . 64 ALA CA . 6643 1 561 . 1 1 64 64 ALA CB C 13 17.63 0.40 . 1 . . . . 64 ALA CB . 6643 1 562 . 1 1 64 64 ALA N N 15 126.60 0.10 . 1 . . . . 64 ALA N . 6643 1 563 . 1 1 65 65 THR H H 1 8.02 0.03 . 1 . . . . 65 THR H . 6643 1 564 . 1 1 65 65 THR HA H 1 4.56 0.03 . 1 . . . . 65 THR HA . 6643 1 565 . 1 1 65 65 THR HB H 1 4.63 0.03 . 1 . . . . 65 THR HB . 6643 1 566 . 1 1 65 65 THR HG21 H 1 1.28 0.03 . 1 . . . . 65 THR HG2 . 6643 1 567 . 1 1 65 65 THR HG22 H 1 1.28 0.03 . 1 . . . . 65 THR HG2 . 6643 1 568 . 1 1 65 65 THR HG23 H 1 1.28 0.03 . 1 . . . . 65 THR HG2 . 6643 1 569 . 1 1 65 65 THR C C 13 173.22 0.40 . 1 . . . . 65 THR C . 6643 1 570 . 1 1 65 65 THR CA C 13 57.85 0.40 . 1 . . . . 65 THR CA . 6643 1 571 . 1 1 65 65 THR CB C 13 68.55 0.40 . 1 . . . . 65 THR CB . 6643 1 572 . 1 1 65 65 THR CG2 C 13 22.44 0.40 . 1 . . . . 65 THR CG2 . 6643 1 573 . 1 1 65 65 THR N N 15 112.79 0.10 . 1 . . . . 65 THR N . 6643 1 574 . 1 1 66 66 PRO HA H 1 4.48 0.03 . 1 . . . . 66 PRO HA . 6643 1 575 . 1 1 66 66 PRO HB2 H 1 1.81 0.03 . 2 . . . . 66 PRO HB2 . 6643 1 576 . 1 1 66 66 PRO HG2 H 1 1.80 0.03 . 2 . . . . 66 PRO HG2 . 6643 1 577 . 1 1 66 66 PRO HG3 H 1 1.57 0.03 . 2 . . . . 66 PRO HG3 . 6643 1 578 . 1 1 66 66 PRO HD2 H 1 3.38 0.03 . 2 . . . . 66 PRO HD2 . 6643 1 579 . 1 1 66 66 PRO HD3 H 1 3.47 0.03 . 2 . . . . 66 PRO HD3 . 6643 1 580 . 1 1 66 66 PRO CA C 13 62.69 0.40 . 1 . . . . 66 PRO CA . 6643 1 581 . 1 1 66 66 PRO CB C 13 31.41 0.40 . 1 . . . . 66 PRO CB . 6643 1 582 . 1 1 66 66 PRO CG C 13 27.57 0.40 . 1 . . . . 66 PRO CG . 6643 1 583 . 1 1 66 66 PRO CD C 13 50.04 0.40 . 1 . . . . 66 PRO CD . 6643 1 584 . 1 1 68 68 ASP H H 1 7.60 0.03 . 1 . . . . 68 ASP H . 6643 1 585 . 1 1 68 68 ASP HA H 1 4.71 0.03 . 1 . . . . 68 ASP HA . 6643 1 586 . 1 1 68 68 ASP HB2 H 1 2.81 0.03 . 2 . . . . 68 ASP HB2 . 6643 1 587 . 1 1 68 68 ASP HB3 H 1 2.98 0.03 . 2 . . . . 68 ASP HB3 . 6643 1 588 . 1 1 68 68 ASP C C 13 176.42 0.40 . 1 . . . . 68 ASP C . 6643 1 589 . 1 1 68 68 ASP CA C 13 52.90 0.40 . 1 . . . . 68 ASP CA . 6643 1 590 . 1 1 68 68 ASP CB C 13 42.70 0.40 . 1 . . . . 68 ASP CB . 6643 1 591 . 1 1 68 68 ASP N N 15 116.35 0.10 . 1 . . . . 68 ASP N . 6643 1 592 . 1 1 69 69 LYS HA H 1 4.03 0.03 . 1 . . . . 69 LYS HA . 6643 1 593 . 1 1 69 69 LYS HB2 H 1 1.85 0.03 . 2 . . . . 69 LYS HB2 . 6643 1 594 . 1 1 69 69 LYS HB3 H 1 1.93 0.03 . 2 . . . . 69 LYS HB3 . 6643 1 595 . 1 1 69 69 LYS HG2 H 1 1.49 0.03 . 2 . . . . 69 LYS HG2 . 6643 1 596 . 1 1 69 69 LYS HG3 H 1 1.42 0.03 . 2 . . . . 69 LYS HG3 . 6643 1 597 . 1 1 69 69 LYS HD2 H 1 1.72 0.03 . 2 . . . . 69 LYS HD2 . 6643 1 598 . 1 1 69 69 LYS CA C 13 59.21 0.40 . 1 . . . . 69 LYS CA . 6643 1 599 . 1 1 69 69 LYS CB C 13 32.59 0.40 . 1 . . . . 69 LYS CB . 6643 1 600 . 1 1 69 69 LYS CG C 13 24.82 0.40 . 1 . . . . 69 LYS CG . 6643 1 601 . 1 1 69 69 LYS CD C 13 29.29 0.40 . 1 . . . . 69 LYS CD . 6643 1 602 . 1 1 70 70 GLU H H 1 8.33 0.03 . 1 . . . . 70 GLU H . 6643 1 603 . 1 1 70 70 GLU C C 13 179.22 0.40 . 1 . . . . 70 GLU C . 6643 1 604 . 1 1 70 70 GLU CA C 13 59.66 0.40 . 1 . . . . 70 GLU CA . 6643 1 605 . 1 1 70 70 GLU CB C 13 29.02 0.40 . 1 . . . . 70 GLU CB . 6643 1 606 . 1 1 70 70 GLU N N 15 120.47 0.10 . 1 . . . . 70 GLU N . 6643 1 607 . 1 1 71 71 GLN H H 1 8.54 0.03 . 1 . . . . 71 GLN H . 6643 1 608 . 1 1 71 71 GLN HA H 1 4.03 0.03 . 1 . . . . 71 GLN HA . 6643 1 609 . 1 1 71 71 GLN HB2 H 1 2.03 0.03 . 2 . . . . 71 GLN HB2 . 6643 1 610 . 1 1 71 71 GLN HG2 H 1 2.74 0.03 . 2 . . . . 71 GLN HG2 . 6643 1 611 . 1 1 71 71 GLN HG3 H 1 2.40 0.03 . 2 . . . . 71 GLN HG3 . 6643 1 612 . 1 1 71 71 GLN C C 13 179.17 0.40 . 1 . . . . 71 GLN C . 6643 1 613 . 1 1 71 71 GLN CA C 13 58.48 0.40 . 1 . . . . 71 GLN CA . 6643 1 614 . 1 1 71 71 GLN CB C 13 28.98 0.40 . 1 . . . . 71 GLN CB . 6643 1 615 . 1 1 71 71 GLN CG C 13 34.18 0.40 . 1 . . . . 71 GLN CG . 6643 1 616 . 1 1 71 71 GLN N N 15 118.39 0.10 . 1 . . . . 71 GLN N . 6643 1 617 . 1 1 72 72 ALA H H 1 7.93 0.03 . 1 . . . . 72 ALA H . 6643 1 618 . 1 1 72 72 ALA HA H 1 3.72 0.03 . 1 . . . . 72 ALA HA . 6643 1 619 . 1 1 72 72 ALA HB1 H 1 1.41 0.03 . 1 . . . . 72 ALA HB . 6643 1 620 . 1 1 72 72 ALA HB2 H 1 1.41 0.03 . 1 . . . . 72 ALA HB . 6643 1 621 . 1 1 72 72 ALA HB3 H 1 1.41 0.03 . 1 . . . . 72 ALA HB . 6643 1 622 . 1 1 72 72 ALA C C 13 178.74 0.40 . 1 . . . . 72 ALA C . 6643 1 623 . 1 1 72 72 ALA CA C 13 54.63 0.40 . 1 . . . . 72 ALA CA . 6643 1 624 . 1 1 72 72 ALA CB C 13 18.41 0.40 . 1 . . . . 72 ALA CB . 6643 1 625 . 1 1 72 72 ALA N N 15 121.59 0.10 . 1 . . . . 72 ALA N . 6643 1 626 . 1 1 73 73 GLN H H 1 8.07 0.03 . 1 . . . . 73 GLN H . 6643 1 627 . 1 1 73 73 GLN HA H 1 4.14 0.03 . 1 . . . . 73 GLN HA . 6643 1 628 . 1 1 73 73 GLN HB2 H 1 2.13 0.03 . 2 . . . . 73 GLN HB2 . 6643 1 629 . 1 1 73 73 GLN HG2 H 1 2.50 0.03 . 2 . . . . 73 GLN HG2 . 6643 1 630 . 1 1 73 73 GLN HG3 H 1 2.47 0.03 . 2 . . . . 73 GLN HG3 . 6643 1 631 . 1 1 73 73 GLN HE21 H 1 7.57 0.03 . 2 . . . . 73 GLN HE21 . 6643 1 632 . 1 1 73 73 GLN HE22 H 1 6.82 0.03 . 2 . . . . 73 GLN HE22 . 6643 1 633 . 1 1 73 73 GLN C C 13 176.71 0.40 . 1 . . . . 73 GLN C . 6643 1 634 . 1 1 73 73 GLN CA C 13 57.90 0.40 . 1 . . . . 73 GLN CA . 6643 1 635 . 1 1 73 73 GLN CB C 13 28.77 0.40 . 1 . . . . 73 GLN CB . 6643 1 636 . 1 1 73 73 GLN CG C 13 34.06 0.40 . 1 . . . . 73 GLN CG . 6643 1 637 . 1 1 73 73 GLN CD C 13 180.35 0.40 . 1 . . . . 73 GLN CD . 6643 1 638 . 1 1 73 73 GLN N N 15 115.55 0.10 . 1 . . . . 73 GLN N . 6643 1 639 . 1 1 73 73 GLN NE2 N 15 111.74 0.10 . 1 . . . . 73 GLN NE2 . 6643 1 640 . 1 1 74 74 GLN H H 1 7.36 0.03 . 1 . . . . 74 GLN H . 6643 1 641 . 1 1 74 74 GLN HA H 1 4.22 0.03 . 1 . . . . 74 GLN HA . 6643 1 642 . 1 1 74 74 GLN HB2 H 1 1.98 0.03 . 2 . . . . 74 GLN HB2 . 6643 1 643 . 1 1 74 74 GLN HB3 H 1 2.21 0.03 . 2 . . . . 74 GLN HB3 . 6643 1 644 . 1 1 74 74 GLN HG2 H 1 2.44 0.03 . 2 . . . . 74 GLN HG2 . 6643 1 645 . 1 1 74 74 GLN HG3 H 1 2.51 0.03 . 2 . . . . 74 GLN HG3 . 6643 1 646 . 1 1 74 74 GLN HE21 H 1 6.75 0.03 . 2 . . . . 74 GLN HE21 . 6643 1 647 . 1 1 74 74 GLN HE22 H 1 7.39 0.03 . 2 . . . . 74 GLN HE22 . 6643 1 648 . 1 1 74 74 GLN CA C 13 55.79 0.40 . 1 . . . . 74 GLN CA . 6643 1 649 . 1 1 74 74 GLN CB C 13 29.34 0.40 . 1 . . . . 74 GLN CB . 6643 1 650 . 1 1 74 74 GLN CG C 13 33.90 0.40 . 1 . . . . 74 GLN CG . 6643 1 651 . 1 1 74 74 GLN CD C 13 180.35 0.40 . 1 . . . . 74 GLN CD . 6643 1 652 . 1 1 74 74 GLN N N 15 114.82 0.10 . 1 . . . . 74 GLN N . 6643 1 653 . 1 1 74 74 GLN NE2 N 15 111.09 0.10 . 1 . . . . 74 GLN NE2 . 6643 1 654 . 1 1 75 75 MET H H 1 7.25 0.03 . 1 . . . . 75 MET H . 6643 1 655 . 1 1 75 75 MET HA H 1 4.24 0.03 . 1 . . . . 75 MET HA . 6643 1 656 . 1 1 75 75 MET HB2 H 1 1.82 0.03 . 2 . . . . 75 MET HB2 . 6643 1 657 . 1 1 75 75 MET HB3 H 1 1.73 0.03 . 2 . . . . 75 MET HB3 . 6643 1 658 . 1 1 75 75 MET HG2 H 1 2.35 0.03 . 2 . . . . 75 MET HG2 . 6643 1 659 . 1 1 75 75 MET HG3 H 1 2.41 0.03 . 2 . . . . 75 MET HG3 . 6643 1 660 . 1 1 75 75 MET HE1 H 1 1.75 0.03 . 1 . . . . 75 MET HE . 6643 1 661 . 1 1 75 75 MET HE2 H 1 1.75 0.03 . 1 . . . . 75 MET HE . 6643 1 662 . 1 1 75 75 MET HE3 H 1 1.75 0.03 . 1 . . . . 75 MET HE . 6643 1 663 . 1 1 75 75 MET C C 13 175.90 0.40 . 1 . . . . 75 MET C . 6643 1 664 . 1 1 75 75 MET CA C 13 56.01 0.40 . 1 . . . . 75 MET CA . 6643 1 665 . 1 1 75 75 MET CB C 13 33.29 0.40 . 1 . . . . 75 MET CB . 6643 1 666 . 1 1 75 75 MET CG C 13 32.28 0.40 . 1 . . . . 75 MET CG . 6643 1 667 . 1 1 75 75 MET CE C 13 16.88 0.40 . 1 . . . . 75 MET CE . 6643 1 668 . 1 1 75 75 MET N N 15 120.01 0.10 . 1 . . . . 75 MET N . 6643 1 669 . 1 1 76 76 ASN HA H 1 4.61 0.03 . 1 . . . . 76 ASN HA . 6643 1 670 . 1 1 76 76 ASN HB2 H 1 2.87 0.03 . 2 . . . . 76 ASN HB2 . 6643 1 671 . 1 1 76 76 ASN HB3 H 1 3.04 0.03 . 2 . . . . 76 ASN HB3 . 6643 1 672 . 1 1 76 76 ASN CA C 13 53.51 0.40 . 1 . . . . 76 ASN CA . 6643 1 673 . 1 1 76 76 ASN CB C 13 39.30 0.40 . 1 . . . . 76 ASN CB . 6643 1 674 . 1 1 78 78 LYS H H 1 8.19 0.03 . 1 . . . . 78 LYS H . 6643 1 675 . 1 1 78 78 LYS HA H 1 3.74 0.03 . 1 . . . . 78 LYS HA . 6643 1 676 . 1 1 78 78 LYS HB2 H 1 1.56 0.03 . 2 . . . . 78 LYS HB2 . 6643 1 677 . 1 1 78 78 LYS HG2 H 1 1.12 0.03 . 2 . . . . 78 LYS HG2 . 6643 1 678 . 1 1 78 78 LYS HD2 H 1 1.48 0.03 . 2 . . . . 78 LYS HD2 . 6643 1 679 . 1 1 78 78 LYS HD3 H 1 1.46 0.03 . 2 . . . . 78 LYS HD3 . 6643 1 680 . 1 1 78 78 LYS HE2 H 1 2.86 0.03 . 2 . . . . 78 LYS HE2 . 6643 1 681 . 1 1 78 78 LYS C C 13 178.49 0.40 . 1 . . . . 78 LYS C . 6643 1 682 . 1 1 78 78 LYS CA C 13 60.03 0.40 . 1 . . . . 78 LYS CA . 6643 1 683 . 1 1 78 78 LYS CB C 13 31.54 0.40 . 1 . . . . 78 LYS CB . 6643 1 684 . 1 1 78 78 LYS CG C 13 24.56 0.40 . 1 . . . . 78 LYS CG . 6643 1 685 . 1 1 78 78 LYS CD C 13 29.15 0.40 . 1 . . . . 78 LYS CD . 6643 1 686 . 1 1 78 78 LYS CE C 13 41.69 0.40 . 1 . . . . 78 LYS CE . 6643 1 687 . 1 1 78 78 LYS N N 15 119.98 0.10 . 1 . . . . 78 LYS N . 6643 1 688 . 1 1 79 79 ASP H H 1 7.86 0.03 . 1 . . . . 79 ASP H . 6643 1 689 . 1 1 79 79 ASP HA H 1 4.39 0.03 . 1 . . . . 79 ASP HA . 6643 1 690 . 1 1 79 79 ASP HB2 H 1 2.65 0.03 . 2 . . . . 79 ASP HB2 . 6643 1 691 . 1 1 79 79 ASP C C 13 178.80 0.40 . 1 . . . . 79 ASP C . 6643 1 692 . 1 1 79 79 ASP CA C 13 56.93 0.40 . 1 . . . . 79 ASP CA . 6643 1 693 . 1 1 79 79 ASP CB C 13 40.34 0.40 . 1 . . . . 79 ASP CB . 6643 1 694 . 1 1 79 79 ASP N N 15 119.81 0.10 . 1 . . . . 79 ASP N . 6643 1 695 . 1 1 80 80 PHE H H 1 8.33 0.03 . 1 . . . . 80 PHE H . 6643 1 696 . 1 1 80 80 PHE HA H 1 4.47 0.03 . 1 . . . . 80 PHE HA . 6643 1 697 . 1 1 80 80 PHE HB2 H 1 3.18 0.03 . 2 . . . . 80 PHE HB2 . 6643 1 698 . 1 1 80 80 PHE HD1 H 1 7.12 0.03 . 3 . . . . 80 PHE HD1 . 6643 1 699 . 1 1 80 80 PHE HE1 H 1 6.73 0.03 . 3 . . . . 80 PHE HE1 . 6643 1 700 . 1 1 80 80 PHE HZ H 1 6.90 0.03 . 1 . . . . 80 PHE HZ . 6643 1 701 . 1 1 80 80 PHE C C 13 178.03 0.40 . 1 . . . . 80 PHE C . 6643 1 702 . 1 1 80 80 PHE CA C 13 59.32 0.40 . 1 . . . . 80 PHE CA . 6643 1 703 . 1 1 80 80 PHE CB C 13 39.51 0.40 . 1 . . . . 80 PHE CB . 6643 1 704 . 1 1 80 80 PHE CD1 C 13 130.66 0.40 . 3 . . . . 80 PHE CD1 . 6643 1 705 . 1 1 80 80 PHE CE1 C 13 130.70 0.40 . 3 . . . . 80 PHE CE1 . 6643 1 706 . 1 1 80 80 PHE CZ C 13 128.90 0.40 . 1 . . . . 80 PHE CZ . 6643 1 707 . 1 1 80 80 PHE N N 15 121.60 0.10 . 1 . . . . 80 PHE N . 6643 1 708 . 1 1 81 81 LEU H H 1 8.34 0.03 . 1 . . . . 81 LEU H . 6643 1 709 . 1 1 81 81 LEU HA H 1 3.92 0.03 . 1 . . . . 81 LEU HA . 6643 1 710 . 1 1 81 81 LEU HB2 H 1 1.60 0.03 . 2 . . . . 81 LEU HB2 . 6643 1 711 . 1 1 81 81 LEU HB3 H 1 2.05 0.03 . 2 . . . . 81 LEU HB3 . 6643 1 712 . 1 1 81 81 LEU HG H 1 1.02 0.03 . 1 . . . . 81 LEU HG . 6643 1 713 . 1 1 81 81 LEU C C 13 178.39 0.40 . 1 . . . . 81 LEU C . 6643 1 714 . 1 1 81 81 LEU CA C 13 58.65 0.40 . 1 . . . . 81 LEU CA . 6643 1 715 . 1 1 81 81 LEU CB C 13 41.74 0.40 . 1 . . . . 81 LEU CB . 6643 1 716 . 1 1 81 81 LEU CG C 13 25.87 0.40 . 1 . . . . 81 LEU CG . 6643 1 717 . 1 1 81 81 LEU N N 15 118.35 0.10 . 1 . . . . 81 LEU N . 6643 1 718 . 1 1 82 82 SER H H 1 8.12 0.03 . 1 . . . . 82 SER H . 6643 1 719 . 1 1 82 82 SER HA H 1 4.20 0.03 . 1 . . . . 82 SER HA . 6643 1 720 . 1 1 82 82 SER HB2 H 1 4.03 0.03 . 2 . . . . 82 SER HB2 . 6643 1 721 . 1 1 82 82 SER C C 13 176.80 0.40 . 1 . . . . 82 SER C . 6643 1 722 . 1 1 82 82 SER CA C 13 62.07 0.40 . 1 . . . . 82 SER CA . 6643 1 723 . 1 1 82 82 SER CB C 13 62.87 0.40 . 1 . . . . 82 SER CB . 6643 1 724 . 1 1 82 82 SER N N 15 112.82 0.10 . 1 . . . . 82 SER N . 6643 1 725 . 1 1 83 83 LEU H H 1 7.97 0.03 . 1 . . . . 83 LEU H . 6643 1 726 . 1 1 83 83 LEU HA H 1 4.25 0.03 . 1 . . . . 83 LEU HA . 6643 1 727 . 1 1 83 83 LEU HB2 H 1 1.90 0.03 . 2 . . . . 83 LEU HB2 . 6643 1 728 . 1 1 83 83 LEU HB3 H 1 2.09 0.03 . 2 . . . . 83 LEU HB3 . 6643 1 729 . 1 1 83 83 LEU HG H 1 1.76 0.03 . 1 . . . . 83 LEU HG . 6643 1 730 . 1 1 83 83 LEU HD11 H 1 0.93 0.03 . 2 . . . . 83 LEU HD1 . 6643 1 731 . 1 1 83 83 LEU HD12 H 1 0.93 0.03 . 2 . . . . 83 LEU HD1 . 6643 1 732 . 1 1 83 83 LEU HD13 H 1 0.93 0.03 . 2 . . . . 83 LEU HD1 . 6643 1 733 . 1 1 83 83 LEU HD21 H 1 0.98 0.03 . 2 . . . . 83 LEU HD2 . 6643 1 734 . 1 1 83 83 LEU HD22 H 1 0.98 0.03 . 2 . . . . 83 LEU HD2 . 6643 1 735 . 1 1 83 83 LEU HD23 H 1 0.98 0.03 . 2 . . . . 83 LEU HD2 . 6643 1 736 . 1 1 83 83 LEU C C 13 178.19 0.40 . 1 . . . . 83 LEU C . 6643 1 737 . 1 1 83 83 LEU CA C 13 58.25 0.40 . 1 . . . . 83 LEU CA . 6643 1 738 . 1 1 83 83 LEU CB C 13 42.09 0.40 . 1 . . . . 83 LEU CB . 6643 1 739 . 1 1 83 83 LEU CG C 13 27.09 0.40 . 1 . . . . 83 LEU CG . 6643 1 740 . 1 1 83 83 LEU CD1 C 13 25.93 0.40 . 2 . . . . 83 LEU CD1 . 6643 1 741 . 1 1 83 83 LEU CD2 C 13 24.81 0.40 . 2 . . . . 83 LEU CD2 . 6643 1 742 . 1 1 83 83 LEU N N 15 123.61 0.10 . 1 . . . . 83 LEU N . 6643 1 743 . 1 1 84 84 ILE H H 1 7.85 0.03 . 1 . . . . 84 ILE H . 6643 1 744 . 1 1 84 84 ILE HA H 1 3.57 0.03 . 1 . . . . 84 ILE HA . 6643 1 745 . 1 1 84 84 ILE HB H 1 2.10 0.03 . 1 . . . . 84 ILE HB . 6643 1 746 . 1 1 84 84 ILE HG21 H 1 1.03 0.03 . 1 . . . . 84 ILE HG2 . 6643 1 747 . 1 1 84 84 ILE HG22 H 1 1.03 0.03 . 1 . . . . 84 ILE HG2 . 6643 1 748 . 1 1 84 84 ILE HG23 H 1 1.03 0.03 . 1 . . . . 84 ILE HG2 . 6643 1 749 . 1 1 84 84 ILE HD11 H 1 0.78 0.03 . 1 . . . . 84 ILE HD1 . 6643 1 750 . 1 1 84 84 ILE HD12 H 1 0.78 0.03 . 1 . . . . 84 ILE HD1 . 6643 1 751 . 1 1 84 84 ILE HD13 H 1 0.78 0.03 . 1 . . . . 84 ILE HD1 . 6643 1 752 . 1 1 84 84 ILE C C 13 177.56 0.40 . 1 . . . . 84 ILE C . 6643 1 753 . 1 1 84 84 ILE CA C 13 66.22 0.40 . 1 . . . . 84 ILE CA . 6643 1 754 . 1 1 84 84 ILE CB C 13 38.55 0.40 . 1 . . . . 84 ILE CB . 6643 1 755 . 1 1 84 84 ILE CG2 C 13 17.71 0.40 . 1 . . . . 84 ILE CG2 . 6643 1 756 . 1 1 84 84 ILE CD1 C 13 14.74 0.40 . 1 . . . . 84 ILE CD1 . 6643 1 757 . 1 1 84 84 ILE N N 15 117.97 0.10 . 1 . . . . 84 ILE N . 6643 1 758 . 1 1 85 85 VAL H H 1 7.86 0.03 . 1 . . . . 85 VAL H . 6643 1 759 . 1 1 85 85 VAL HA H 1 3.47 0.03 . 1 . . . . 85 VAL HA . 6643 1 760 . 1 1 85 85 VAL HB H 1 2.24 0.03 . 1 . . . . 85 VAL HB . 6643 1 761 . 1 1 85 85 VAL HG11 H 1 0.97 0.03 . 2 . . . . 85 VAL HG1 . 6643 1 762 . 1 1 85 85 VAL HG12 H 1 0.97 0.03 . 2 . . . . 85 VAL HG1 . 6643 1 763 . 1 1 85 85 VAL HG13 H 1 0.97 0.03 . 2 . . . . 85 VAL HG1 . 6643 1 764 . 1 1 85 85 VAL C C 13 177.29 0.40 . 1 . . . . 85 VAL C . 6643 1 765 . 1 1 85 85 VAL CA C 13 67.76 0.40 . 1 . . . . 85 VAL CA . 6643 1 766 . 1 1 85 85 VAL CB C 13 31.63 0.40 . 1 . . . . 85 VAL CB . 6643 1 767 . 1 1 85 85 VAL CG1 C 13 21.50 0.40 . 2 . . . . 85 VAL CG1 . 6643 1 768 . 1 1 85 85 VAL N N 15 117.42 0.10 . 1 . . . . 85 VAL N . 6643 1 769 . 1 1 86 86 SER H H 1 8.50 0.03 . 1 . . . . 86 SER H . 6643 1 770 . 1 1 86 86 SER HA H 1 4.26 0.03 . 1 . . . . 86 SER HA . 6643 1 771 . 1 1 86 86 SER HB2 H 1 4.00 0.03 . 2 . . . . 86 SER HB2 . 6643 1 772 . 1 1 86 86 SER C C 13 176.66 0.40 . 1 . . . . 86 SER C . 6643 1 773 . 1 1 86 86 SER CA C 13 63.17 0.40 . 1 . . . . 86 SER CA . 6643 1 774 . 1 1 86 86 SER CB C 13 63.28 0.40 . 1 . . . . 86 SER CB . 6643 1 775 . 1 1 86 86 SER N N 15 115.95 0.10 . 1 . . . . 86 SER N . 6643 1 776 . 1 1 87 87 ILE H H 1 8.42 0.03 . 1 . . . . 87 ILE H . 6643 1 777 . 1 1 87 87 ILE HA H 1 3.58 0.03 . 1 . . . . 87 ILE HA . 6643 1 778 . 1 1 87 87 ILE HB H 1 2.07 0.03 . 1 . . . . 87 ILE HB . 6643 1 779 . 1 1 87 87 ILE HG21 H 1 1.09 0.03 . 1 . . . . 87 ILE HG2 . 6643 1 780 . 1 1 87 87 ILE HG22 H 1 1.09 0.03 . 1 . . . . 87 ILE HG2 . 6643 1 781 . 1 1 87 87 ILE HG23 H 1 1.09 0.03 . 1 . . . . 87 ILE HG2 . 6643 1 782 . 1 1 87 87 ILE HD11 H 1 0.96 0.03 . 1 . . . . 87 ILE HD1 . 6643 1 783 . 1 1 87 87 ILE HD12 H 1 0.96 0.03 . 1 . . . . 87 ILE HD1 . 6643 1 784 . 1 1 87 87 ILE HD13 H 1 0.96 0.03 . 1 . . . . 87 ILE HD1 . 6643 1 785 . 1 1 87 87 ILE C C 13 178.89 0.40 . 1 . . . . 87 ILE C . 6643 1 786 . 1 1 87 87 ILE CA C 13 66.40 0.40 . 1 . . . . 87 ILE CA . 6643 1 787 . 1 1 87 87 ILE CB C 13 38.38 0.40 . 1 . . . . 87 ILE CB . 6643 1 788 . 1 1 87 87 ILE CG2 C 13 18.02 0.40 . 1 . . . . 87 ILE CG2 . 6643 1 789 . 1 1 87 87 ILE CD1 C 13 13.47 0.40 . 1 . . . . 87 ILE CD1 . 6643 1 790 . 1 1 87 87 ILE N N 15 121.31 0.10 . 1 . . . . 87 ILE N . 6643 1 791 . 1 1 88 88 LEU H H 1 8.12 0.03 . 1 . . . . 88 LEU H . 6643 1 792 . 1 1 88 88 LEU HA H 1 4.07 0.03 . 1 . . . . 88 LEU HA . 6643 1 793 . 1 1 88 88 LEU HB2 H 1 2.12 0.03 . 2 . . . . 88 LEU HB2 . 6643 1 794 . 1 1 88 88 LEU HG H 1 1.36 0.03 . 1 . . . . 88 LEU HG . 6643 1 795 . 1 1 88 88 LEU HD11 H 1 0.80 0.03 . 2 . . . . 88 LEU HD1 . 6643 1 796 . 1 1 88 88 LEU HD12 H 1 0.80 0.03 . 2 . . . . 88 LEU HD1 . 6643 1 797 . 1 1 88 88 LEU HD13 H 1 0.80 0.03 . 2 . . . . 88 LEU HD1 . 6643 1 798 . 1 1 88 88 LEU C C 13 179.73 0.40 . 1 . . . . 88 LEU C . 6643 1 799 . 1 1 88 88 LEU CA C 13 58.95 0.40 . 1 . . . . 88 LEU CA . 6643 1 800 . 1 1 88 88 LEU CB C 13 43.42 0.40 . 1 . . . . 88 LEU CB . 6643 1 801 . 1 1 88 88 LEU N N 15 119.18 0.10 . 1 . . . . 88 LEU N . 6643 1 802 . 1 1 89 89 ARG H H 1 8.99 0.03 . 1 . . . . 89 ARG H . 6643 1 803 . 1 1 89 89 ARG HA H 1 3.85 0.03 . 1 . . . . 89 ARG HA . 6643 1 804 . 1 1 89 89 ARG HB2 H 1 1.47 0.03 . 2 . . . . 89 ARG HB2 . 6643 1 805 . 1 1 89 89 ARG HG2 H 1 1.44 0.03 . 2 . . . . 89 ARG HG2 . 6643 1 806 . 1 1 89 89 ARG HD2 H 1 3.04 0.03 . 2 . . . . 89 ARG HD2 . 6643 1 807 . 1 1 89 89 ARG C C 13 179.61 0.40 . 1 . . . . 89 ARG C . 6643 1 808 . 1 1 89 89 ARG CA C 13 59.48 0.40 . 1 . . . . 89 ARG CA . 6643 1 809 . 1 1 89 89 ARG CB C 13 29.59 0.40 . 1 . . . . 89 ARG CB . 6643 1 810 . 1 1 89 89 ARG CG C 13 28.93 0.40 . 1 . . . . 89 ARG CG . 6643 1 811 . 1 1 89 89 ARG CD C 13 43.44 0.40 . 1 . . . . 89 ARG CD . 6643 1 812 . 1 1 89 89 ARG N N 15 117.93 0.10 . 1 . . . . 89 ARG N . 6643 1 813 . 1 1 90 90 SER H H 1 7.89 0.03 . 1 . . . . 90 SER H . 6643 1 814 . 1 1 90 90 SER HA H 1 4.29 0.03 . 1 . . . . 90 SER HA . 6643 1 815 . 1 1 90 90 SER HB2 H 1 4.23 0.03 . 2 . . . . 90 SER HB2 . 6643 1 816 . 1 1 90 90 SER HB3 H 1 3.95 0.03 . 2 . . . . 90 SER HB3 . 6643 1 817 . 1 1 90 90 SER C C 13 175.64 0.40 . 1 . . . . 90 SER C . 6643 1 818 . 1 1 90 90 SER CA C 13 61.02 0.40 . 1 . . . . 90 SER CA . 6643 1 819 . 1 1 90 90 SER CB C 13 63.41 0.40 . 1 . . . . 90 SER CB . 6643 1 820 . 1 1 90 90 SER N N 15 114.11 0.10 . 1 . . . . 90 SER N . 6643 1 821 . 1 1 91 91 TRP H H 1 7.76 0.03 . 1 . . . . 91 TRP H . 6643 1 822 . 1 1 91 91 TRP HA H 1 4.58 0.03 . 1 . . . . 91 TRP HA . 6643 1 823 . 1 1 91 91 TRP HB2 H 1 3.52 0.03 . 2 . . . . 91 TRP HB2 . 6643 1 824 . 1 1 91 91 TRP HB3 H 1 3.10 0.03 . 2 . . . . 91 TRP HB3 . 6643 1 825 . 1 1 91 91 TRP HE3 H 1 6.69 0.03 . 1 . . . . 91 TRP HE3 . 6643 1 826 . 1 1 91 91 TRP HZ2 H 1 7.20 0.03 . 1 . . . . 91 TRP HZ2 . 6643 1 827 . 1 1 91 91 TRP HZ3 H 1 7.62 0.03 . 1 . . . . 91 TRP HZ3 . 6643 1 828 . 1 1 91 91 TRP HH2 H 1 7.48 0.03 . 1 . . . . 91 TRP HH2 . 6643 1 829 . 1 1 91 91 TRP C C 13 176.48 0.40 . 1 . . . . 91 TRP C . 6643 1 830 . 1 1 91 91 TRP CA C 13 59.40 0.40 . 1 . . . . 91 TRP CA . 6643 1 831 . 1 1 91 91 TRP CB C 13 29.98 0.40 . 1 . . . . 91 TRP CB . 6643 1 832 . 1 1 91 91 TRP CE3 C 13 120.10 0.40 . 1 . . . . 91 TRP CE3 . 6643 1 833 . 1 1 91 91 TRP CZ2 C 13 113.64 0.40 . 1 . . . . 91 TRP CZ2 . 6643 1 834 . 1 1 91 91 TRP CZ3 C 13 120.58 0.40 . 1 . . . . 91 TRP CZ3 . 6643 1 835 . 1 1 91 91 TRP CH2 C 13 124.42 0.40 . 1 . . . . 91 TRP CH2 . 6643 1 836 . 1 1 91 91 TRP N N 15 121.45 0.10 . 1 . . . . 91 TRP N . 6643 1 837 . 1 1 92 92 ASN H H 1 7.35 0.03 . 1 . . . . 92 ASN H . 6643 1 838 . 1 1 92 92 ASN HA H 1 4.55 0.03 . 1 . . . . 92 ASN HA . 6643 1 839 . 1 1 92 92 ASN HB2 H 1 2.92 0.03 . 2 . . . . 92 ASN HB2 . 6643 1 840 . 1 1 92 92 ASN C C 13 177.10 0.40 . 1 . . . . 92 ASN C . 6643 1 841 . 1 1 92 92 ASN CA C 13 57.76 0.40 . 1 . . . . 92 ASN CA . 6643 1 842 . 1 1 92 92 ASN CB C 13 38.92 0.40 . 1 . . . . 92 ASN CB . 6643 1 843 . 1 1 92 92 ASN N N 15 119.58 0.10 . 1 . . . . 92 ASN N . 6643 1 844 . 1 1 93 93 GLU H H 1 9.17 0.03 . 1 . . . . 93 GLU H . 6643 1 845 . 1 1 93 93 GLU HA H 1 4.47 0.03 . 1 . . . . 93 GLU HA . 6643 1 846 . 1 1 93 93 GLU HB2 H 1 2.32 0.03 . 2 . . . . 93 GLU HB2 . 6643 1 847 . 1 1 93 93 GLU HG2 H 1 2.57 0.03 . 2 . . . . 93 GLU HG2 . 6643 1 848 . 1 1 93 93 GLU HG3 H 1 2.51 0.03 . 2 . . . . 93 GLU HG3 . 6643 1 849 . 1 1 93 93 GLU C C 13 175.64 0.40 . 1 . . . . 93 GLU C . 6643 1 850 . 1 1 93 93 GLU CA C 13 61.10 0.40 . 1 . . . . 93 GLU CA . 6643 1 851 . 1 1 93 93 GLU CB C 13 27.42 0.40 . 1 . . . . 93 GLU CB . 6643 1 852 . 1 1 93 93 GLU CG C 13 37.57 0.40 . 1 . . . . 93 GLU CG . 6643 1 853 . 1 1 93 93 GLU N N 15 119.13 0.10 . 1 . . . . 93 GLU N . 6643 1 854 . 1 1 94 94 PRO HA H 1 3.34 0.03 . 1 . . . . 94 PRO HA . 6643 1 855 . 1 1 94 94 PRO HB2 H 1 1.43 0.03 . 2 . . . . 94 PRO HB2 . 6643 1 856 . 1 1 94 94 PRO HG2 H 1 0.69 0.03 . 2 . . . . 94 PRO HG2 . 6643 1 857 . 1 1 94 94 PRO HG3 H 1 1.65 0.03 . 2 . . . . 94 PRO HG3 . 6643 1 858 . 1 1 94 94 PRO HD2 H 1 3.61 0.03 . 2 . . . . 94 PRO HD2 . 6643 1 859 . 1 1 94 94 PRO HD3 H 1 3.20 0.03 . 2 . . . . 94 PRO HD3 . 6643 1 860 . 1 1 94 94 PRO C C 13 178.16 0.40 . 1 . . . . 94 PRO C . 6643 1 861 . 1 1 94 94 PRO CA C 13 66.15 0.40 . 1 . . . . 94 PRO CA . 6643 1 862 . 1 1 94 94 PRO CB C 13 29.77 0.40 . 1 . . . . 94 PRO CB . 6643 1 863 . 1 1 94 94 PRO CG C 13 27.60 0.40 . 1 . . . . 94 PRO CG . 6643 1 864 . 1 1 94 94 PRO CD C 13 49.08 0.40 . 1 . . . . 94 PRO CD . 6643 1 865 . 1 1 95 95 LEU H H 1 7.80 0.03 . 1 . . . . 95 LEU H . 6643 1 866 . 1 1 95 95 LEU HA H 1 4.20 0.03 . 1 . . . . 95 LEU HA . 6643 1 867 . 1 1 95 95 LEU HB2 H 1 2.37 0.03 . 2 . . . . 95 LEU HB2 . 6643 1 868 . 1 1 95 95 LEU HB3 H 1 1.25 0.03 . 2 . . . . 95 LEU HB3 . 6643 1 869 . 1 1 95 95 LEU HG H 1 2.40 0.03 . 1 . . . . 95 LEU HG . 6643 1 870 . 1 1 95 95 LEU HD11 H 1 0.96 0.03 . 2 . . . . 95 LEU HD1 . 6643 1 871 . 1 1 95 95 LEU HD12 H 1 0.96 0.03 . 2 . . . . 95 LEU HD1 . 6643 1 872 . 1 1 95 95 LEU HD13 H 1 0.96 0.03 . 2 . . . . 95 LEU HD1 . 6643 1 873 . 1 1 95 95 LEU HD21 H 1 0.86 0.03 . 2 . . . . 95 LEU HD2 . 6643 1 874 . 1 1 95 95 LEU HD22 H 1 0.86 0.03 . 2 . . . . 95 LEU HD2 . 6643 1 875 . 1 1 95 95 LEU HD23 H 1 0.86 0.03 . 2 . . . . 95 LEU HD2 . 6643 1 876 . 1 1 95 95 LEU C C 13 178.15 0.40 . 1 . . . . 95 LEU C . 6643 1 877 . 1 1 95 95 LEU CA C 13 58.50 0.40 . 1 . . . . 95 LEU CA . 6643 1 878 . 1 1 95 95 LEU CB C 13 41.67 0.40 . 1 . . . . 95 LEU CB . 6643 1 879 . 1 1 95 95 LEU CG C 13 27.77 0.40 . 1 . . . . 95 LEU CG . 6643 1 880 . 1 1 95 95 LEU CD1 C 13 26.83 0.40 . 2 . . . . 95 LEU CD1 . 6643 1 881 . 1 1 95 95 LEU CD2 C 13 23.00 0.40 . 2 . . . . 95 LEU CD2 . 6643 1 882 . 1 1 95 95 LEU N N 15 113.66 0.10 . 1 . . . . 95 LEU N . 6643 1 883 . 1 1 96 96 TYR H H 1 7.81 0.03 . 1 . . . . 96 TYR H . 6643 1 884 . 1 1 96 96 TYR HA H 1 4.24 0.03 . 1 . . . . 96 TYR HA . 6643 1 885 . 1 1 96 96 TYR HB2 H 1 3.23 0.03 . 2 . . . . 96 TYR HB2 . 6643 1 886 . 1 1 96 96 TYR HB3 H 1 3.19 0.03 . 2 . . . . 96 TYR HB3 . 6643 1 887 . 1 1 96 96 TYR HD1 H 1 6.69 0.03 . 3 . . . . 96 TYR HD1 . 6643 1 888 . 1 1 96 96 TYR HE1 H 1 6.68 0.03 . 3 . . . . 96 TYR HE1 . 6643 1 889 . 1 1 96 96 TYR C C 13 179.27 0.40 . 1 . . . . 96 TYR C . 6643 1 890 . 1 1 96 96 TYR CA C 13 61.25 0.40 . 1 . . . . 96 TYR CA . 6643 1 891 . 1 1 96 96 TYR CB C 13 37.75 0.40 . 1 . . . . 96 TYR CB . 6643 1 892 . 1 1 96 96 TYR CD1 C 13 133.14 0.40 . 3 . . . . 96 TYR CD1 . 6643 1 893 . 1 1 96 96 TYR CE1 C 13 118.08 0.40 . 3 . . . . 96 TYR CE1 . 6643 1 894 . 1 1 96 96 TYR N N 15 120.03 0.10 . 1 . . . . 96 TYR N . 6643 1 895 . 1 1 97 97 HIS H H 1 8.22 0.03 . 1 . . . . 97 HIS H . 6643 1 896 . 1 1 97 97 HIS HA H 1 4.20 0.03 . 1 . . . . 97 HIS HA . 6643 1 897 . 1 1 97 97 HIS HB2 H 1 3.16 0.03 . 2 . . . . 97 HIS HB2 . 6643 1 898 . 1 1 97 97 HIS HD2 H 1 7.26 0.03 . 1 . . . . 97 HIS HD2 . 6643 1 899 . 1 1 97 97 HIS C C 13 177.02 0.40 . 1 . . . . 97 HIS C . 6643 1 900 . 1 1 97 97 HIS CA C 13 60.12 0.40 . 1 . . . . 97 HIS CA . 6643 1 901 . 1 1 97 97 HIS CB C 13 30.65 0.40 . 1 . . . . 97 HIS CB . 6643 1 902 . 1 1 97 97 HIS N N 15 119.74 0.10 . 1 . . . . 97 HIS N . 6643 1 903 . 1 1 98 98 LEU H H 1 8.82 0.03 . 1 . . . . 98 LEU H . 6643 1 904 . 1 1 98 98 LEU HA H 1 3.97 0.03 . 1 . . . . 98 LEU HA . 6643 1 905 . 1 1 98 98 LEU HB2 H 1 2.11 0.03 . 2 . . . . 98 LEU HB2 . 6643 1 906 . 1 1 98 98 LEU HG H 1 1.51 0.03 . 1 . . . . 98 LEU HG . 6643 1 907 . 1 1 98 98 LEU HD11 H 1 0.92 0.03 . 2 . . . . 98 LEU HD1 . 6643 1 908 . 1 1 98 98 LEU HD12 H 1 0.92 0.03 . 2 . . . . 98 LEU HD1 . 6643 1 909 . 1 1 98 98 LEU HD13 H 1 0.92 0.03 . 2 . . . . 98 LEU HD1 . 6643 1 910 . 1 1 98 98 LEU HD21 H 1 0.86 0.03 . 2 . . . . 98 LEU HD2 . 6643 1 911 . 1 1 98 98 LEU HD22 H 1 0.86 0.03 . 2 . . . . 98 LEU HD2 . 6643 1 912 . 1 1 98 98 LEU HD23 H 1 0.86 0.03 . 2 . . . . 98 LEU HD2 . 6643 1 913 . 1 1 98 98 LEU C C 13 177.60 0.40 . 1 . . . . 98 LEU C . 6643 1 914 . 1 1 98 98 LEU CA C 13 58.86 0.40 . 1 . . . . 98 LEU CA . 6643 1 915 . 1 1 98 98 LEU CB C 13 41.98 0.40 . 1 . . . . 98 LEU CB . 6643 1 916 . 1 1 98 98 LEU CG C 13 26.86 0.40 . 1 . . . . 98 LEU CG . 6643 1 917 . 1 1 98 98 LEU CD1 C 13 23.63 0.40 . 2 . . . . 98 LEU CD1 . 6643 1 918 . 1 1 98 98 LEU CD2 C 13 25.74 0.40 . 2 . . . . 98 LEU CD2 . 6643 1 919 . 1 1 98 98 LEU N N 15 121.67 0.10 . 1 . . . . 98 LEU N . 6643 1 920 . 1 1 99 99 VAL H H 1 7.81 0.03 . 1 . . . . 99 VAL H . 6643 1 921 . 1 1 99 99 VAL HA H 1 3.25 0.03 . 1 . . . . 99 VAL HA . 6643 1 922 . 1 1 99 99 VAL HB H 1 2.06 0.03 . 1 . . . . 99 VAL HB . 6643 1 923 . 1 1 99 99 VAL HG11 H 1 0.99 0.03 . 2 . . . . 99 VAL HG1 . 6643 1 924 . 1 1 99 99 VAL HG12 H 1 0.99 0.03 . 2 . . . . 99 VAL HG1 . 6643 1 925 . 1 1 99 99 VAL HG13 H 1 0.99 0.03 . 2 . . . . 99 VAL HG1 . 6643 1 926 . 1 1 99 99 VAL HG21 H 1 0.86 0.03 . 2 . . . . 99 VAL HG2 . 6643 1 927 . 1 1 99 99 VAL HG22 H 1 0.86 0.03 . 2 . . . . 99 VAL HG2 . 6643 1 928 . 1 1 99 99 VAL HG23 H 1 0.86 0.03 . 2 . . . . 99 VAL HG2 . 6643 1 929 . 1 1 99 99 VAL C C 13 177.33 0.40 . 1 . . . . 99 VAL C . 6643 1 930 . 1 1 99 99 VAL CA C 13 67.41 0.40 . 1 . . . . 99 VAL CA . 6643 1 931 . 1 1 99 99 VAL CB C 13 32.00 0.40 . 1 . . . . 99 VAL CB . 6643 1 932 . 1 1 99 99 VAL CG1 C 13 23.74 0.40 . 2 . . . . 99 VAL CG1 . 6643 1 933 . 1 1 99 99 VAL CG2 C 13 21.99 0.40 . 2 . . . . 99 VAL CG2 . 6643 1 934 . 1 1 99 99 VAL N N 15 116.39 0.10 . 1 . . . . 99 VAL N . 6643 1 935 . 1 1 100 100 THR H H 1 7.62 0.03 . 1 . . . . 100 THR H . 6643 1 936 . 1 1 100 100 THR HA H 1 3.62 0.03 . 1 . . . . 100 THR HA . 6643 1 937 . 1 1 100 100 THR HB H 1 4.12 0.03 . 1 . . . . 100 THR HB . 6643 1 938 . 1 1 100 100 THR HG21 H 1 1.10 0.03 . 1 . . . . 100 THR HG2 . 6643 1 939 . 1 1 100 100 THR HG22 H 1 1.10 0.03 . 1 . . . . 100 THR HG2 . 6643 1 940 . 1 1 100 100 THR HG23 H 1 1.10 0.03 . 1 . . . . 100 THR HG2 . 6643 1 941 . 1 1 100 100 THR C C 13 177.54 0.40 . 1 . . . . 100 THR C . 6643 1 942 . 1 1 100 100 THR CA C 13 66.79 0.40 . 1 . . . . 100 THR CA . 6643 1 943 . 1 1 100 100 THR CB C 13 68.64 0.40 . 1 . . . . 100 THR CB . 6643 1 944 . 1 1 100 100 THR CG2 C 13 21.60 0.40 . 1 . . . . 100 THR CG2 . 6643 1 945 . 1 1 100 100 THR N N 15 113.53 0.10 . 1 . . . . 100 THR N . 6643 1 946 . 1 1 101 101 GLU HA H 1 4.00 0.03 . 1 . . . . 101 GLU HA . 6643 1 947 . 1 1 101 101 GLU HB2 H 1 2.13 0.03 . 2 . . . . 101 GLU HB2 . 6643 1 948 . 1 1 101 101 GLU HG2 H 1 3.13 0.03 . 2 . . . . 101 GLU HG2 . 6643 1 949 . 1 1 101 101 GLU CA C 13 58.91 0.40 . 1 . . . . 101 GLU CA . 6643 1 950 . 1 1 102 102 VAL H H 1 8.50 0.03 . 1 . . . . 102 VAL H . 6643 1 951 . 1 1 102 102 VAL HA H 1 3.90 0.03 . 1 . . . . 102 VAL HA . 6643 1 952 . 1 1 102 102 VAL HB H 1 2.21 0.03 . 1 . . . . 102 VAL HB . 6643 1 953 . 1 1 102 102 VAL HG11 H 1 0.95 0.03 . 2 . . . . 102 VAL HG1 . 6643 1 954 . 1 1 102 102 VAL HG12 H 1 0.95 0.03 . 2 . . . . 102 VAL HG1 . 6643 1 955 . 1 1 102 102 VAL HG13 H 1 0.95 0.03 . 2 . . . . 102 VAL HG1 . 6643 1 956 . 1 1 102 102 VAL HG21 H 1 1.08 0.03 . 2 . . . . 102 VAL HG2 . 6643 1 957 . 1 1 102 102 VAL HG22 H 1 1.08 0.03 . 2 . . . . 102 VAL HG2 . 6643 1 958 . 1 1 102 102 VAL HG23 H 1 1.08 0.03 . 2 . . . . 102 VAL HG2 . 6643 1 959 . 1 1 102 102 VAL CA C 13 66.09 0.40 . 1 . . . . 102 VAL CA . 6643 1 960 . 1 1 102 102 VAL CB C 13 31.01 0.40 . 1 . . . . 102 VAL CB . 6643 1 961 . 1 1 102 102 VAL CG1 C 13 22.41 0.40 . 2 . . . . 102 VAL CG1 . 6643 1 962 . 1 1 102 102 VAL CG2 C 13 23.13 0.40 . 2 . . . . 102 VAL CG2 . 6643 1 963 . 1 1 102 102 VAL N N 15 119.89 0.10 . 1 . . . . 102 VAL N . 6643 1 964 . 1 1 103 103 ARG H H 1 8.24 0.03 . 1 . . . . 103 ARG H . 6643 1 965 . 1 1 103 103 ARG HA H 1 3.95 0.03 . 1 . . . . 103 ARG HA . 6643 1 966 . 1 1 103 103 ARG HB2 H 1 1.94 0.03 . 2 . . . . 103 ARG HB2 . 6643 1 967 . 1 1 103 103 ARG HB3 H 1 1.83 0.03 . 2 . . . . 103 ARG HB3 . 6643 1 968 . 1 1 103 103 ARG HG2 H 1 1.69 0.03 . 2 . . . . 103 ARG HG2 . 6643 1 969 . 1 1 103 103 ARG HG3 H 1 1.82 0.03 . 2 . . . . 103 ARG HG3 . 6643 1 970 . 1 1 103 103 ARG HD2 H 1 3.20 0.03 . 2 . . . . 103 ARG HD2 . 6643 1 971 . 1 1 103 103 ARG HD3 H 1 3.15 0.03 . 2 . . . . 103 ARG HD3 . 6643 1 972 . 1 1 103 103 ARG C C 13 177.61 0.40 . 1 . . . . 103 ARG C . 6643 1 973 . 1 1 103 103 ARG CA C 13 59.31 0.40 . 1 . . . . 103 ARG CA . 6643 1 974 . 1 1 103 103 ARG CB C 13 30.10 0.40 . 1 . . . . 103 ARG CB . 6643 1 975 . 1 1 103 103 ARG CG C 13 28.47 0.40 . 1 . . . . 103 ARG CG . 6643 1 976 . 1 1 103 103 ARG CD C 13 43.62 0.40 . 1 . . . . 103 ARG CD . 6643 1 977 . 1 1 103 103 ARG N N 15 118.92 0.10 . 1 . . . . 103 ARG N . 6643 1 978 . 1 1 104 104 GLY H H 1 7.45 0.03 . 1 . . . . 104 GLY H . 6643 1 979 . 1 1 104 104 GLY HA2 H 1 4.21 0.03 . 2 . . . . 104 GLY HA2 . 6643 1 980 . 1 1 104 104 GLY HA3 H 1 3.79 0.03 . 2 . . . . 104 GLY HA3 . 6643 1 981 . 1 1 104 104 GLY C C 13 174.39 0.40 . 1 . . . . 104 GLY C . 6643 1 982 . 1 1 104 104 GLY CA C 13 45.09 0.40 . 1 . . . . 104 GLY CA . 6643 1 983 . 1 1 104 104 GLY N N 15 103.52 0.10 . 1 . . . . 104 GLY N . 6643 1 984 . 1 1 105 105 MET H H 1 7.51 0.03 . 1 . . . . 105 MET H . 6643 1 985 . 1 1 105 105 MET HA H 1 4.35 0.03 . 1 . . . . 105 MET HA . 6643 1 986 . 1 1 105 105 MET HB2 H 1 2.15 0.03 . 2 . . . . 105 MET HB2 . 6643 1 987 . 1 1 105 105 MET HB3 H 1 2.20 0.03 . 2 . . . . 105 MET HB3 . 6643 1 988 . 1 1 105 105 MET HG2 H 1 2.93 0.03 . 2 . . . . 105 MET HG2 . 6643 1 989 . 1 1 105 105 MET HG3 H 1 2.59 0.03 . 2 . . . . 105 MET HG3 . 6643 1 990 . 1 1 105 105 MET HE1 H 1 1.86 0.03 . 1 . . . . 105 MET HE . 6643 1 991 . 1 1 105 105 MET HE2 H 1 1.86 0.03 . 1 . . . . 105 MET HE . 6643 1 992 . 1 1 105 105 MET HE3 H 1 1.86 0.03 . 1 . . . . 105 MET HE . 6643 1 993 . 1 1 105 105 MET C C 13 176.30 0.40 . 1 . . . . 105 MET C . 6643 1 994 . 1 1 105 105 MET CA C 13 56.29 0.40 . 1 . . . . 105 MET CA . 6643 1 995 . 1 1 105 105 MET CB C 13 33.46 0.40 . 1 . . . . 105 MET CB . 6643 1 996 . 1 1 105 105 MET CG C 13 32.58 0.40 . 1 . . . . 105 MET CG . 6643 1 997 . 1 1 105 105 MET CE C 13 16.83 0.40 . 1 . . . . 105 MET CE . 6643 1 998 . 1 1 105 105 MET N N 15 121.46 0.10 . 1 . . . . 105 MET N . 6643 1 999 . 1 1 107 107 GLU HA H 1 4.20 0.03 . 1 . . . . 107 GLU HA . 6643 1 1000 . 1 1 107 107 GLU C C 13 175.59 0.40 . 1 . . . . 107 GLU C . 6643 1 1001 . 1 1 108 108 ALA H H 1 7.79 0.03 . 1 . . . . 108 ALA H . 6643 1 1002 . 1 1 108 108 ALA HA H 1 4.49 0.03 . 1 . . . . 108 ALA HA . 6643 1 1003 . 1 1 108 108 ALA HB1 H 1 1.42 0.03 . 1 . . . . 108 ALA HB . 6643 1 1004 . 1 1 108 108 ALA HB2 H 1 1.42 0.03 . 1 . . . . 108 ALA HB . 6643 1 1005 . 1 1 108 108 ALA HB3 H 1 1.42 0.03 . 1 . . . . 108 ALA HB . 6643 1 1006 . 1 1 108 108 ALA C C 13 176.16 0.40 . 1 . . . . 108 ALA C . 6643 1 1007 . 1 1 108 108 ALA CA C 13 50.92 0.40 . 1 . . . . 108 ALA CA . 6643 1 1008 . 1 1 108 108 ALA CB C 13 18.53 0.40 . 1 . . . . 108 ALA CB . 6643 1 1009 . 1 1 108 108 ALA N N 15 124.27 0.10 . 1 . . . . 108 ALA N . 6643 1 1010 . 1 1 109 109 PRO HA H 1 4.57 0.03 . 1 . . . . 109 PRO HA . 6643 1 1011 . 1 1 109 109 PRO HB2 H 1 2.00 0.03 . 2 . . . . 109 PRO HB2 . 6643 1 1012 . 1 1 109 109 PRO HB3 H 1 2.37 0.03 . 2 . . . . 109 PRO HB3 . 6643 1 1013 . 1 1 109 109 PRO HG2 H 1 2.13 0.03 . 2 . . . . 109 PRO HG2 . 6643 1 1014 . 1 1 109 109 PRO HD2 H 1 4.03 0.03 . 2 . . . . 109 PRO HD2 . 6643 1 1015 . 1 1 109 109 PRO HD3 H 1 3.61 0.03 . 2 . . . . 109 PRO HD3 . 6643 1 1016 . 1 1 109 109 PRO C C 13 175.93 0.40 . 1 . . . . 109 PRO C . 6643 1 1017 . 1 1 109 109 PRO CA C 13 62.55 0.40 . 1 . . . . 109 PRO CA . 6643 1 1018 . 1 1 109 109 PRO CB C 13 31.55 0.40 . 1 . . . . 109 PRO CB . 6643 1 1019 . 1 1 109 109 PRO CG C 13 28.11 0.40 . 1 . . . . 109 PRO CG . 6643 1 1020 . 1 1 109 109 PRO CD C 13 50.63 0.40 . 1 . . . . 109 PRO CD . 6643 1 1021 . 1 1 111 111 ALA HA H 1 4.22 0.03 . 1 . . . . 111 ALA HA . 6643 1 1022 . 1 1 111 111 ALA HB1 H 1 1.40 0.03 . 1 . . . . 111 ALA HB . 6643 1 1023 . 1 1 111 111 ALA HB2 H 1 1.40 0.03 . 1 . . . . 111 ALA HB . 6643 1 1024 . 1 1 111 111 ALA HB3 H 1 1.40 0.03 . 1 . . . . 111 ALA HB . 6643 1 1025 . 1 1 111 111 ALA CA C 13 54.63 0.40 . 1 . . . . 111 ALA CA . 6643 1 1026 . 1 1 111 111 ALA CB C 13 19.00 0.40 . 1 . . . . 111 ALA CB . 6643 1 1027 . 1 1 112 112 ILE H H 1 7.26 0.03 . 1 . . . . 112 ILE H . 6643 1 1028 . 1 1 112 112 ILE HA H 1 3.91 0.03 . 1 . . . . 112 ILE HA . 6643 1 1029 . 1 1 112 112 ILE HB H 1 2.02 0.03 . 1 . . . . 112 ILE HB . 6643 1 1030 . 1 1 112 112 ILE HG12 H 1 1.76 0.03 . 2 . . . . 112 ILE HG12 . 6643 1 1031 . 1 1 112 112 ILE HG13 H 1 1.29 0.03 . 2 . . . . 112 ILE HG13 . 6643 1 1032 . 1 1 112 112 ILE HG21 H 1 1.04 0.03 . 1 . . . . 112 ILE HG2 . 6643 1 1033 . 1 1 112 112 ILE HG22 H 1 1.04 0.03 . 1 . . . . 112 ILE HG2 . 6643 1 1034 . 1 1 112 112 ILE HG23 H 1 1.04 0.03 . 1 . . . . 112 ILE HG2 . 6643 1 1035 . 1 1 112 112 ILE HD11 H 1 1.06 0.03 . 1 . . . . 112 ILE HD1 . 6643 1 1036 . 1 1 112 112 ILE HD12 H 1 1.06 0.03 . 1 . . . . 112 ILE HD1 . 6643 1 1037 . 1 1 112 112 ILE HD13 H 1 1.06 0.03 . 1 . . . . 112 ILE HD1 . 6643 1 1038 . 1 1 112 112 ILE C C 13 176.43 0.40 . 1 . . . . 112 ILE C . 6643 1 1039 . 1 1 112 112 ILE CA C 13 63.95 0.40 . 1 . . . . 112 ILE CA . 6643 1 1040 . 1 1 112 112 ILE CB C 13 38.14 0.40 . 1 . . . . 112 ILE CB . 6643 1 1041 . 1 1 112 112 ILE CG1 C 13 29.30 0.40 . 1 . . . . 112 ILE CG1 . 6643 1 1042 . 1 1 112 112 ILE CG2 C 13 17.01 0.40 . 1 . . . . 112 ILE CG2 . 6643 1 1043 . 1 1 112 112 ILE CD1 C 13 13.27 0.40 . 1 . . . . 112 ILE CD1 . 6643 1 1044 . 1 1 112 112 ILE N N 15 113.89 0.10 . 1 . . . . 112 ILE N . 6643 1 1045 . 1 1 113 113 LEU H H 1 7.87 0.03 . 1 . . . . 113 LEU H . 6643 1 1046 . 1 1 113 113 LEU HA H 1 4.00 0.03 . 1 . . . . 113 LEU HA . 6643 1 1047 . 1 1 113 113 LEU HB2 H 1 1.44 0.03 . 2 . . . . 113 LEU HB2 . 6643 1 1048 . 1 1 113 113 LEU HB3 H 1 1.88 0.03 . 2 . . . . 113 LEU HB3 . 6643 1 1049 . 1 1 113 113 LEU HG H 1 1.67 0.03 . 1 . . . . 113 LEU HG . 6643 1 1050 . 1 1 113 113 LEU HD11 H 1 0.93 0.03 . 2 . . . . 113 LEU HD1 . 6643 1 1051 . 1 1 113 113 LEU HD12 H 1 0.93 0.03 . 2 . . . . 113 LEU HD1 . 6643 1 1052 . 1 1 113 113 LEU HD13 H 1 0.93 0.03 . 2 . . . . 113 LEU HD1 . 6643 1 1053 . 1 1 113 113 LEU HD21 H 1 0.95 0.03 . 2 . . . . 113 LEU HD2 . 6643 1 1054 . 1 1 113 113 LEU HD22 H 1 0.95 0.03 . 2 . . . . 113 LEU HD2 . 6643 1 1055 . 1 1 113 113 LEU HD23 H 1 0.95 0.03 . 2 . . . . 113 LEU HD2 . 6643 1 1056 . 1 1 113 113 LEU C C 13 177.66 0.40 . 1 . . . . 113 LEU C . 6643 1 1057 . 1 1 113 113 LEU CA C 13 58.68 0.40 . 1 . . . . 113 LEU CA . 6643 1 1058 . 1 1 113 113 LEU CB C 13 41.64 0.40 . 1 . . . . 113 LEU CB . 6643 1 1059 . 1 1 113 113 LEU CG C 13 27.16 0.40 . 1 . . . . 113 LEU CG . 6643 1 1060 . 1 1 113 113 LEU CD1 C 13 24.00 0.40 . 2 . . . . 113 LEU CD1 . 6643 1 1061 . 1 1 113 113 LEU CD2 C 13 25.82 0.40 . 2 . . . . 113 LEU CD2 . 6643 1 1062 . 1 1 113 113 LEU N N 15 120.40 0.10 . 1 . . . . 113 LEU N . 6643 1 1063 . 1 1 114 114 SER H H 1 8.49 0.03 . 1 . . . . 114 SER H . 6643 1 1064 . 1 1 114 114 SER HA H 1 4.10 0.03 . 1 . . . . 114 SER HA . 6643 1 1065 . 1 1 114 114 SER HB2 H 1 3.97 0.03 . 2 . . . . 114 SER HB2 . 6643 1 1066 . 1 1 114 114 SER C C 13 177.85 0.40 . 1 . . . . 114 SER C . 6643 1 1067 . 1 1 114 114 SER CA C 13 61.66 0.40 . 1 . . . . 114 SER CA . 6643 1 1068 . 1 1 114 114 SER CB C 13 62.57 0.40 . 1 . . . . 114 SER CB . 6643 1 1069 . 1 1 114 114 SER N N 15 111.09 0.10 . 1 . . . . 114 SER N . 6643 1 1070 . 1 1 115 115 LYS H H 1 7.21 0.03 . 1 . . . . 115 LYS H . 6643 1 1071 . 1 1 115 115 LYS HA H 1 4.19 0.03 . 1 . . . . 115 LYS HA . 6643 1 1072 . 1 1 115 115 LYS HB2 H 1 1.75 0.03 . 2 . . . . 115 LYS HB2 . 6643 1 1073 . 1 1 115 115 LYS HB3 H 1 1.99 0.03 . 2 . . . . 115 LYS HB3 . 6643 1 1074 . 1 1 115 115 LYS HG2 H 1 1.52 0.03 . 2 . . . . 115 LYS HG2 . 6643 1 1075 . 1 1 115 115 LYS HD2 H 1 1.52 0.03 . 2 . . . . 115 LYS HD2 . 6643 1 1076 . 1 1 115 115 LYS HE2 H 1 2.98 0.03 . 2 . . . . 115 LYS HE2 . 6643 1 1077 . 1 1 115 115 LYS C C 13 176.95 0.40 . 1 . . . . 115 LYS C . 6643 1 1078 . 1 1 115 115 LYS CA C 13 59.37 0.40 . 1 . . . . 115 LYS CA . 6643 1 1079 . 1 1 115 115 LYS CB C 13 33.06 0.40 . 1 . . . . 115 LYS CB . 6643 1 1080 . 1 1 115 115 LYS CG C 13 26.66 0.40 . 1 . . . . 115 LYS CG . 6643 1 1081 . 1 1 115 115 LYS CD C 13 28.89 0.40 . 1 . . . . 115 LYS CD . 6643 1 1082 . 1 1 115 115 LYS CE C 13 42.19 0.40 . 1 . . . . 115 LYS CE . 6643 1 1083 . 1 1 115 115 LYS N N 15 120.72 0.10 . 1 . . . . 115 LYS N . 6643 1 1084 . 1 1 116 116 ALA H H 1 8.32 0.03 . 1 . . . . 116 ALA H . 6643 1 1085 . 1 1 116 116 ALA HA H 1 3.84 0.03 . 1 . . . . 116 ALA HA . 6643 1 1086 . 1 1 116 116 ALA HB1 H 1 1.49 0.03 . 1 . . . . 116 ALA HB . 6643 1 1087 . 1 1 116 116 ALA HB2 H 1 1.49 0.03 . 1 . . . . 116 ALA HB . 6643 1 1088 . 1 1 116 116 ALA HB3 H 1 1.49 0.03 . 1 . . . . 116 ALA HB . 6643 1 1089 . 1 1 116 116 ALA C C 13 178.67 0.40 . 1 . . . . 116 ALA C . 6643 1 1090 . 1 1 116 116 ALA CA C 13 55.80 0.40 . 1 . . . . 116 ALA CA . 6643 1 1091 . 1 1 116 116 ALA CB C 13 17.60 0.40 . 1 . . . . 116 ALA CB . 6643 1 1092 . 1 1 116 116 ALA N N 15 123.10 0.10 . 1 . . . . 116 ALA N . 6643 1 1093 . 1 1 117 117 VAL H H 1 8.25 0.03 . 1 . . . . 117 VAL H . 6643 1 1094 . 1 1 117 117 VAL HA H 1 3.72 0.03 . 1 . . . . 117 VAL HA . 6643 1 1095 . 1 1 117 117 VAL HB H 1 2.16 0.03 . 1 . . . . 117 VAL HB . 6643 1 1096 . 1 1 117 117 VAL HG11 H 1 1.02 0.03 . 2 . . . . 117 VAL HG1 . 6643 1 1097 . 1 1 117 117 VAL HG12 H 1 1.02 0.03 . 2 . . . . 117 VAL HG1 . 6643 1 1098 . 1 1 117 117 VAL HG13 H 1 1.02 0.03 . 2 . . . . 117 VAL HG1 . 6643 1 1099 . 1 1 117 117 VAL HG21 H 1 1.13 0.03 . 2 . . . . 117 VAL HG2 . 6643 1 1100 . 1 1 117 117 VAL HG22 H 1 1.13 0.03 . 2 . . . . 117 VAL HG2 . 6643 1 1101 . 1 1 117 117 VAL HG23 H 1 1.13 0.03 . 2 . . . . 117 VAL HG2 . 6643 1 1102 . 1 1 117 117 VAL C C 13 178.95 0.40 . 1 . . . . 117 VAL C . 6643 1 1103 . 1 1 117 117 VAL CA C 13 66.00 0.40 . 1 . . . . 117 VAL CA . 6643 1 1104 . 1 1 117 117 VAL CB C 13 32.40 0.40 . 1 . . . . 117 VAL CB . 6643 1 1105 . 1 1 117 117 VAL CG1 C 13 21.04 0.40 . 2 . . . . 117 VAL CG1 . 6643 1 1106 . 1 1 117 117 VAL CG2 C 13 23.34 0.40 . 2 . . . . 117 VAL CG2 . 6643 1 1107 . 1 1 117 117 VAL N N 15 116.67 0.10 . 1 . . . . 117 VAL N . 6643 1 1108 . 1 1 118 118 GLU H H 1 7.52 0.03 . 1 . . . . 118 GLU H . 6643 1 1109 . 1 1 118 118 GLU HA H 1 4.42 0.03 . 1 . . . . 118 GLU HA . 6643 1 1110 . 1 1 118 118 GLU HB2 H 1 2.11 0.03 . 2 . . . . 118 GLU HB2 . 6643 1 1111 . 1 1 118 118 GLU HB3 H 1 2.21 0.03 . 2 . . . . 118 GLU HB3 . 6643 1 1112 . 1 1 118 118 GLU HG2 H 1 2.36 0.03 . 2 . . . . 118 GLU HG2 . 6643 1 1113 . 1 1 118 118 GLU C C 13 178.86 0.40 . 1 . . . . 118 GLU C . 6643 1 1114 . 1 1 118 118 GLU CA C 13 59.29 0.40 . 1 . . . . 118 GLU CA . 6643 1 1115 . 1 1 118 118 GLU CB C 13 29.99 0.40 . 1 . . . . 118 GLU CB . 6643 1 1116 . 1 1 118 118 GLU CG C 13 36.13 0.40 . 1 . . . . 118 GLU CG . 6643 1 1117 . 1 1 118 118 GLU N N 15 120.41 0.10 . 1 . . . . 118 GLU N . 6643 1 1118 . 1 1 119 119 ILE H H 1 8.94 0.03 . 1 . . . . 119 ILE H . 6643 1 1119 . 1 1 119 119 ILE HA H 1 3.48 0.03 . 1 . . . . 119 ILE HA . 6643 1 1120 . 1 1 119 119 ILE HB H 1 1.79 0.03 . 1 . . . . 119 ILE HB . 6643 1 1121 . 1 1 119 119 ILE HG12 H 1 1.81 0.03 . 2 . . . . 119 ILE HG12 . 6643 1 1122 . 1 1 119 119 ILE HG13 H 1 0.77 0.03 . 2 . . . . 119 ILE HG13 . 6643 1 1123 . 1 1 119 119 ILE HG21 H 1 0.87 0.03 . 1 . . . . 119 ILE HG2 . 6643 1 1124 . 1 1 119 119 ILE HG22 H 1 0.87 0.03 . 1 . . . . 119 ILE HG2 . 6643 1 1125 . 1 1 119 119 ILE HG23 H 1 0.87 0.03 . 1 . . . . 119 ILE HG2 . 6643 1 1126 . 1 1 119 119 ILE HD11 H 1 0.67 0.03 . 1 . . . . 119 ILE HD1 . 6643 1 1127 . 1 1 119 119 ILE HD12 H 1 0.67 0.03 . 1 . . . . 119 ILE HD1 . 6643 1 1128 . 1 1 119 119 ILE HD13 H 1 0.67 0.03 . 1 . . . . 119 ILE HD1 . 6643 1 1129 . 1 1 119 119 ILE C C 13 178.57 0.40 . 1 . . . . 119 ILE C . 6643 1 1130 . 1 1 119 119 ILE CA C 13 66.47 0.40 . 1 . . . . 119 ILE CA . 6643 1 1131 . 1 1 119 119 ILE CB C 13 38.15 0.40 . 1 . . . . 119 ILE CB . 6643 1 1132 . 1 1 119 119 ILE CG1 C 13 31.55 0.40 . 1 . . . . 119 ILE CG1 . 6643 1 1133 . 1 1 119 119 ILE CG2 C 13 18.23 0.40 . 1 . . . . 119 ILE CG2 . 6643 1 1134 . 1 1 119 119 ILE CD1 C 13 14.52 0.40 . 1 . . . . 119 ILE CD1 . 6643 1 1135 . 1 1 119 119 ILE N N 15 120.16 0.10 . 1 . . . . 119 ILE N . 6643 1 1136 . 1 1 120 120 GLU H H 1 8.42 0.03 . 1 . . . . 120 GLU H . 6643 1 1137 . 1 1 120 120 GLU HA H 1 3.88 0.03 . 1 . . . . 120 GLU HA . 6643 1 1138 . 1 1 120 120 GLU HB2 H 1 2.41 0.03 . 2 . . . . 120 GLU HB2 . 6643 1 1139 . 1 1 120 120 GLU C C 13 177.88 0.40 . 1 . . . . 120 GLU C . 6643 1 1140 . 1 1 120 120 GLU CA C 13 61.08 0.40 . 1 . . . . 120 GLU CA . 6643 1 1141 . 1 1 120 120 GLU CB C 13 29.10 0.40 . 1 . . . . 120 GLU CB . 6643 1 1142 . 1 1 120 120 GLU N N 15 124.31 0.10 . 1 . . . . 120 GLU N . 6643 1 1143 . 1 1 121 121 GLU H H 1 7.73 0.03 . 1 . . . . 121 GLU H . 6643 1 1144 . 1 1 121 121 GLU HA H 1 4.12 0.03 . 1 . . . . 121 GLU HA . 6643 1 1145 . 1 1 121 121 GLU HB2 H 1 2.26 0.03 . 2 . . . . 121 GLU HB2 . 6643 1 1146 . 1 1 121 121 GLU HB3 H 1 2.10 0.03 . 2 . . . . 121 GLU HB3 . 6643 1 1147 . 1 1 121 121 GLU HG2 H 1 2.33 0.03 . 2 . . . . 121 GLU HG2 . 6643 1 1148 . 1 1 121 121 GLU C C 13 179.57 0.40 . 1 . . . . 121 GLU C . 6643 1 1149 . 1 1 121 121 GLU CA C 13 59.39 0.40 . 1 . . . . 121 GLU CA . 6643 1 1150 . 1 1 121 121 GLU CB C 13 29.88 0.40 . 1 . . . . 121 GLU CB . 6643 1 1151 . 1 1 121 121 GLU N N 15 117.88 0.10 . 1 . . . . 121 GLU N . 6643 1 1152 . 1 1 122 122 GLN H H 1 9.02 0.03 . 1 . . . . 122 GLN H . 6643 1 1153 . 1 1 122 122 GLN HA H 1 4.36 0.03 . 1 . . . . 122 GLN HA . 6643 1 1154 . 1 1 122 122 GLN HB2 H 1 2.26 0.03 . 2 . . . . 122 GLN HB2 . 6643 1 1155 . 1 1 122 122 GLN C C 13 179.10 0.40 . 1 . . . . 122 GLN C . 6643 1 1156 . 1 1 122 122 GLN CA C 13 58.03 0.40 . 1 . . . . 122 GLN CA . 6643 1 1157 . 1 1 122 122 GLN CB C 13 27.73 0.40 . 1 . . . . 122 GLN CB . 6643 1 1158 . 1 1 122 122 GLN N N 15 116.15 0.10 . 1 . . . . 122 GLN N . 6643 1 1159 . 1 1 123 123 THR H H 1 8.54 0.03 . 1 . . . . 123 THR H . 6643 1 1160 . 1 1 123 123 THR HA H 1 4.14 0.03 . 1 . . . . 123 THR HA . 6643 1 1161 . 1 1 123 123 THR HB H 1 3.80 0.03 . 1 . . . . 123 THR HB . 6643 1 1162 . 1 1 123 123 THR HG21 H 1 1.12 0.03 . 1 . . . . 123 THR HG2 . 6643 1 1163 . 1 1 123 123 THR HG22 H 1 1.12 0.03 . 1 . . . . 123 THR HG2 . 6643 1 1164 . 1 1 123 123 THR HG23 H 1 1.12 0.03 . 1 . . . . 123 THR HG2 . 6643 1 1165 . 1 1 123 123 THR CA C 13 67.95 0.40 . 1 . . . . 123 THR CA . 6643 1 1166 . 1 1 123 123 THR CB C 13 67.95 0.40 . 1 . . . . 123 THR CB . 6643 1 1167 . 1 1 123 123 THR CG2 C 13 21.30 0.40 . 1 . . . . 123 THR CG2 . 6643 1 1168 . 1 1 123 123 THR N N 15 116.28 0.10 . 1 . . . . 123 THR N . 6643 1 1169 . 1 1 124 124 LYS H H 1 7.25 0.03 . 1 . . . . 124 LYS H . 6643 1 1170 . 1 1 124 124 LYS HA H 1 4.00 0.03 . 1 . . . . 124 LYS HA . 6643 1 1171 . 1 1 124 124 LYS HB2 H 1 2.12 0.03 . 2 . . . . 124 LYS HB2 . 6643 1 1172 . 1 1 124 124 LYS HB3 H 1 1.91 0.03 . 2 . . . . 124 LYS HB3 . 6643 1 1173 . 1 1 124 124 LYS HG2 H 1 1.82 0.03 . 2 . . . . 124 LYS HG2 . 6643 1 1174 . 1 1 124 124 LYS HG3 H 1 1.48 0.03 . 2 . . . . 124 LYS HG3 . 6643 1 1175 . 1 1 124 124 LYS HD2 H 1 1.73 0.03 . 2 . . . . 124 LYS HD2 . 6643 1 1176 . 1 1 124 124 LYS HE2 H 1 2.98 0.03 . 2 . . . . 124 LYS HE2 . 6643 1 1177 . 1 1 124 124 LYS C C 13 179.69 0.40 . 1 . . . . 124 LYS C . 6643 1 1178 . 1 1 124 124 LYS CA C 13 60.17 0.40 . 1 . . . . 124 LYS CA . 6643 1 1179 . 1 1 124 124 LYS CB C 13 31.99 0.40 . 1 . . . . 124 LYS CB . 6643 1 1180 . 1 1 124 124 LYS CG C 13 25.81 0.40 . 1 . . . . 124 LYS CG . 6643 1 1181 . 1 1 124 124 LYS CD C 13 29.31 0.40 . 1 . . . . 124 LYS CD . 6643 1 1182 . 1 1 124 124 LYS CE C 13 42.08 0.40 . 1 . . . . 124 LYS CE . 6643 1 1183 . 1 1 124 124 LYS N N 15 121.27 0.10 . 1 . . . . 124 LYS N . 6643 1 1184 . 1 1 125 125 ARG H H 1 7.73 0.03 . 1 . . . . 125 ARG H . 6643 1 1185 . 1 1 125 125 ARG HA H 1 4.21 0.03 . 1 . . . . 125 ARG HA . 6643 1 1186 . 1 1 125 125 ARG HB2 H 1 1.86 0.03 . 2 . . . . 125 ARG HB2 . 6643 1 1187 . 1 1 125 125 ARG HD2 H 1 2.59 0.03 . 2 . . . . 125 ARG HD2 . 6643 1 1188 . 1 1 125 125 ARG HD3 H 1 3.26 0.03 . 2 . . . . 125 ARG HD3 . 6643 1 1189 . 1 1 125 125 ARG C C 13 179.68 0.40 . 1 . . . . 125 ARG C . 6643 1 1190 . 1 1 125 125 ARG CA C 13 58.65 0.40 . 1 . . . . 125 ARG CA . 6643 1 1191 . 1 1 125 125 ARG CB C 13 30.35 0.40 . 1 . . . . 125 ARG CB . 6643 1 1192 . 1 1 125 125 ARG CG C 13 26.97 0.40 . 1 . . . . 125 ARG CG . 6643 1 1193 . 1 1 125 125 ARG CD C 13 43.35 0.40 . 1 . . . . 125 ARG CD . 6643 1 1194 . 1 1 125 125 ARG N N 15 118.98 0.10 . 1 . . . . 125 ARG N . 6643 1 1195 . 1 1 126 126 LEU H H 1 8.80 0.03 . 1 . . . . 126 LEU H . 6643 1 1196 . 1 1 126 126 LEU HA H 1 4.19 0.03 . 1 . . . . 126 LEU HA . 6643 1 1197 . 1 1 126 126 LEU HB2 H 1 1.44 0.03 . 2 . . . . 126 LEU HB2 . 6643 1 1198 . 1 1 126 126 LEU HB3 H 1 2.04 0.03 . 2 . . . . 126 LEU HB3 . 6643 1 1199 . 1 1 126 126 LEU HG H 1 0.84 0.03 . 1 . . . . 126 LEU HG . 6643 1 1200 . 1 1 126 126 LEU HD11 H 1 1.09 0.03 . 2 . . . . 126 LEU HD1 . 6643 1 1201 . 1 1 126 126 LEU HD12 H 1 1.09 0.03 . 2 . . . . 126 LEU HD1 . 6643 1 1202 . 1 1 126 126 LEU HD13 H 1 1.09 0.03 . 2 . . . . 126 LEU HD1 . 6643 1 1203 . 1 1 126 126 LEU C C 13 178.20 0.40 . 1 . . . . 126 LEU C . 6643 1 1204 . 1 1 126 126 LEU CA C 13 57.86 0.40 . 1 . . . . 126 LEU CA . 6643 1 1205 . 1 1 126 126 LEU CB C 13 40.72 0.40 . 1 . . . . 126 LEU CB . 6643 1 1206 . 1 1 126 126 LEU CG C 13 27.08 0.40 . 1 . . . . 126 LEU CG . 6643 1 1207 . 1 1 126 126 LEU CD1 C 13 23.03 0.40 . 2 . . . . 126 LEU CD1 . 6643 1 1208 . 1 1 126 126 LEU N N 15 123.18 0.10 . 1 . . . . 126 LEU N . 6643 1 1209 . 1 1 127 127 LEU H H 1 8.52 0.03 . 1 . . . . 127 LEU H . 6643 1 1210 . 1 1 127 127 LEU HA H 1 3.98 0.03 . 1 . . . . 127 LEU HA . 6643 1 1211 . 1 1 127 127 LEU HB2 H 1 1.58 0.03 . 2 . . . . 127 LEU HB2 . 6643 1 1212 . 1 1 127 127 LEU HB3 H 1 2.07 0.03 . 2 . . . . 127 LEU HB3 . 6643 1 1213 . 1 1 127 127 LEU HG H 1 1.67 0.03 . 1 . . . . 127 LEU HG . 6643 1 1214 . 1 1 127 127 LEU HD11 H 1 1.04 0.03 . 2 . . . . 127 LEU HD1 . 6643 1 1215 . 1 1 127 127 LEU HD12 H 1 1.04 0.03 . 2 . . . . 127 LEU HD1 . 6643 1 1216 . 1 1 127 127 LEU HD13 H 1 1.04 0.03 . 2 . . . . 127 LEU HD1 . 6643 1 1217 . 1 1 127 127 LEU HD21 H 1 0.98 0.03 . 2 . . . . 127 LEU HD2 . 6643 1 1218 . 1 1 127 127 LEU HD22 H 1 0.98 0.03 . 2 . . . . 127 LEU HD2 . 6643 1 1219 . 1 1 127 127 LEU HD23 H 1 0.98 0.03 . 2 . . . . 127 LEU HD2 . 6643 1 1220 . 1 1 127 127 LEU C C 13 177.78 0.40 . 1 . . . . 127 LEU C . 6643 1 1221 . 1 1 127 127 LEU CA C 13 58.78 0.40 . 1 . . . . 127 LEU CA . 6643 1 1222 . 1 1 127 127 LEU CB C 13 41.27 0.40 . 1 . . . . 127 LEU CB . 6643 1 1223 . 1 1 127 127 LEU CG C 13 27.37 0.40 . 1 . . . . 127 LEU CG . 6643 1 1224 . 1 1 127 127 LEU CD1 C 13 23.99 0.40 . 2 . . . . 127 LEU CD1 . 6643 1 1225 . 1 1 127 127 LEU CD2 C 13 26.38 0.40 . 2 . . . . 127 LEU CD2 . 6643 1 1226 . 1 1 127 127 LEU N N 15 121.27 0.10 . 1 . . . . 127 LEU N . 6643 1 1227 . 1 1 128 128 GLU H H 1 8.00 0.03 . 1 . . . . 128 GLU H . 6643 1 1228 . 1 1 128 128 GLU HA H 1 4.12 0.03 . 1 . . . . 128 GLU HA . 6643 1 1229 . 1 1 128 128 GLU HB2 H 1 2.21 0.03 . 2 . . . . 128 GLU HB2 . 6643 1 1230 . 1 1 128 128 GLU HB3 H 1 2.09 0.03 . 2 . . . . 128 GLU HB3 . 6643 1 1231 . 1 1 128 128 GLU C C 13 179.98 0.40 . 1 . . . . 128 GLU C . 6643 1 1232 . 1 1 128 128 GLU CA C 13 59.56 0.40 . 1 . . . . 128 GLU CA . 6643 1 1233 . 1 1 128 128 GLU CB C 13 29.80 0.40 . 1 . . . . 128 GLU CB . 6643 1 1234 . 1 1 128 128 GLU N N 15 118.55 0.10 . 1 . . . . 128 GLU N . 6643 1 1235 . 1 1 129 129 GLY H H 1 8.03 0.03 . 1 . . . . 129 GLY H . 6643 1 1236 . 1 1 129 129 GLY HA2 H 1 3.82 0.03 . 2 . . . . 129 GLY HA2 . 6643 1 1237 . 1 1 129 129 GLY C C 13 175.86 0.40 . 1 . . . . 129 GLY C . 6643 1 1238 . 1 1 129 129 GLY CA C 13 47.22 0.40 . 1 . . . . 129 GLY CA . 6643 1 1239 . 1 1 129 129 GLY N N 15 106.43 0.10 . 1 . . . . 129 GLY N . 6643 1 1240 . 1 1 130 130 MET H H 1 8.81 0.03 . 1 . . . . 130 MET H . 6643 1 1241 . 1 1 130 130 MET HA H 1 4.43 0.03 . 1 . . . . 130 MET HA . 6643 1 1242 . 1 1 130 130 MET HB2 H 1 2.34 0.03 . 2 . . . . 130 MET HB2 . 6643 1 1243 . 1 1 130 130 MET HB3 H 1 1.82 0.03 . 2 . . . . 130 MET HB3 . 6643 1 1244 . 1 1 130 130 MET HG2 H 1 2.44 0.03 . 2 . . . . 130 MET HG2 . 6643 1 1245 . 1 1 130 130 MET HE1 H 1 1.73 0.03 . 1 . . . . 130 MET HE . 6643 1 1246 . 1 1 130 130 MET HE2 H 1 1.73 0.03 . 1 . . . . 130 MET HE . 6643 1 1247 . 1 1 130 130 MET HE3 H 1 1.73 0.03 . 1 . . . . 130 MET HE . 6643 1 1248 . 1 1 130 130 MET C C 13 179.09 0.40 . 1 . . . . 130 MET C . 6643 1 1249 . 1 1 130 130 MET CA C 13 55.66 0.40 . 1 . . . . 130 MET CA . 6643 1 1250 . 1 1 130 130 MET CB C 13 29.43 0.40 . 1 . . . . 130 MET CB . 6643 1 1251 . 1 1 130 130 MET CG C 13 30.60 0.40 . 1 . . . . 130 MET CG . 6643 1 1252 . 1 1 130 130 MET CE C 13 15.05 0.40 . 1 . . . . 130 MET CE . 6643 1 1253 . 1 1 130 130 MET N N 15 119.83 0.10 . 1 . . . . 130 MET N . 6643 1 1254 . 1 1 131 131 GLU H H 1 8.70 0.03 . 1 . . . . 131 GLU H . 6643 1 1255 . 1 1 131 131 GLU HA H 1 4.00 0.03 . 1 . . . . 131 GLU HA . 6643 1 1256 . 1 1 131 131 GLU HB2 H 1 2.27 0.03 . 2 . . . . 131 GLU HB2 . 6643 1 1257 . 1 1 131 131 GLU HB3 H 1 2.02 0.03 . 2 . . . . 131 GLU HB3 . 6643 1 1258 . 1 1 131 131 GLU HG2 H 1 2.61 0.03 . 2 . . . . 131 GLU HG2 . 6643 1 1259 . 1 1 131 131 GLU HG3 H 1 2.13 0.03 . 2 . . . . 131 GLU HG3 . 6643 1 1260 . 1 1 131 131 GLU C C 13 180.10 0.40 . 1 . . . . 131 GLU C . 6643 1 1261 . 1 1 131 131 GLU CA C 13 60.19 0.40 . 1 . . . . 131 GLU CA . 6643 1 1262 . 1 1 131 131 GLU CB C 13 29.33 0.40 . 1 . . . . 131 GLU CB . 6643 1 1263 . 1 1 131 131 GLU CG C 13 37.59 0.40 . 1 . . . . 131 GLU CG . 6643 1 1264 . 1 1 131 131 GLU N N 15 119.96 0.10 . 1 . . . . 131 GLU N . 6643 1 1265 . 1 1 132 132 LEU H H 1 7.64 0.03 . 1 . . . . 132 LEU H . 6643 1 1266 . 1 1 132 132 LEU HA H 1 4.20 0.03 . 1 . . . . 132 LEU HA . 6643 1 1267 . 1 1 132 132 LEU HB3 H 1 1.95 0.03 . 2 . . . . 132 LEU HB3 . 6643 1 1268 . 1 1 132 132 LEU HG H 1 1.81 0.03 . 1 . . . . 132 LEU HG . 6643 1 1269 . 1 1 132 132 LEU HD11 H 1 0.76 0.03 . 2 . . . . 132 LEU HD1 . 6643 1 1270 . 1 1 132 132 LEU HD12 H 1 0.76 0.03 . 2 . . . . 132 LEU HD1 . 6643 1 1271 . 1 1 132 132 LEU HD13 H 1 0.76 0.03 . 2 . . . . 132 LEU HD1 . 6643 1 1272 . 1 1 132 132 LEU HD21 H 1 0.86 0.03 . 2 . . . . 132 LEU HD2 . 6643 1 1273 . 1 1 132 132 LEU HD22 H 1 0.86 0.03 . 2 . . . . 132 LEU HD2 . 6643 1 1274 . 1 1 132 132 LEU HD23 H 1 0.86 0.03 . 2 . . . . 132 LEU HD2 . 6643 1 1275 . 1 1 132 132 LEU C C 13 179.96 0.40 . 1 . . . . 132 LEU C . 6643 1 1276 . 1 1 132 132 LEU CA C 13 57.96 0.40 . 1 . . . . 132 LEU CA . 6643 1 1277 . 1 1 132 132 LEU CB C 13 41.93 0.40 . 1 . . . . 132 LEU CB . 6643 1 1278 . 1 1 132 132 LEU CG C 13 27.09 0.40 . 1 . . . . 132 LEU CG . 6643 1 1279 . 1 1 132 132 LEU CD1 C 13 25.74 0.40 . 2 . . . . 132 LEU CD1 . 6643 1 1280 . 1 1 132 132 LEU CD2 C 13 23.49 0.40 . 2 . . . . 132 LEU CD2 . 6643 1 1281 . 1 1 132 132 LEU N N 15 120.79 0.10 . 1 . . . . 132 LEU N . 6643 1 1282 . 1 1 133 133 ILE H H 1 7.97 0.03 . 1 . . . . 133 ILE H . 6643 1 1283 . 1 1 133 133 ILE HA H 1 3.37 0.03 . 1 . . . . 133 ILE HA . 6643 1 1284 . 1 1 133 133 ILE HB H 1 1.99 0.03 . 1 . . . . 133 ILE HB . 6643 1 1285 . 1 1 133 133 ILE HG12 H 1 0.43 0.03 . 2 . . . . 133 ILE HG12 . 6643 1 1286 . 1 1 133 133 ILE HG13 H 1 1.78 0.03 . 2 . . . . 133 ILE HG13 . 6643 1 1287 . 1 1 133 133 ILE HG21 H 1 0.68 0.03 . 1 . . . . 133 ILE HG2 . 6643 1 1288 . 1 1 133 133 ILE HG22 H 1 0.68 0.03 . 1 . . . . 133 ILE HG2 . 6643 1 1289 . 1 1 133 133 ILE HG23 H 1 0.68 0.03 . 1 . . . . 133 ILE HG2 . 6643 1 1290 . 1 1 133 133 ILE HD11 H 1 0.06 0.03 . 1 . . . . 133 ILE HD1 . 6643 1 1291 . 1 1 133 133 ILE HD12 H 1 0.06 0.03 . 1 . . . . 133 ILE HD1 . 6643 1 1292 . 1 1 133 133 ILE HD13 H 1 0.06 0.03 . 1 . . . . 133 ILE HD1 . 6643 1 1293 . 1 1 133 133 ILE CA C 13 66.68 0.40 . 1 . . . . 133 ILE CA . 6643 1 1294 . 1 1 133 133 ILE CB C 13 38.19 0.40 . 1 . . . . 133 ILE CB . 6643 1 1295 . 1 1 133 133 ILE CG1 C 13 31.06 0.40 . 1 . . . . 133 ILE CG1 . 6643 1 1296 . 1 1 133 133 ILE CG2 C 13 17.50 0.40 . 1 . . . . 133 ILE CG2 . 6643 1 1297 . 1 1 133 133 ILE CD1 C 13 11.76 0.40 . 1 . . . . 133 ILE CD1 . 6643 1 1298 . 1 1 133 133 ILE N N 15 120.94 0.10 . 1 . . . . 133 ILE N . 6643 1 1299 . 1 1 134 134 VAL H H 1 8.77 0.03 . 1 . . . . 134 VAL H . 6643 1 1300 . 1 1 134 134 VAL HA H 1 3.46 0.03 . 1 . . . . 134 VAL HA . 6643 1 1301 . 1 1 134 134 VAL HB H 1 2.22 0.03 . 1 . . . . 134 VAL HB . 6643 1 1302 . 1 1 134 134 VAL HG11 H 1 1.11 0.03 . 2 . . . . 134 VAL HG1 . 6643 1 1303 . 1 1 134 134 VAL HG12 H 1 1.11 0.03 . 2 . . . . 134 VAL HG1 . 6643 1 1304 . 1 1 134 134 VAL HG13 H 1 1.11 0.03 . 2 . . . . 134 VAL HG1 . 6643 1 1305 . 1 1 134 134 VAL HG21 H 1 1.03 0.03 . 2 . . . . 134 VAL HG2 . 6643 1 1306 . 1 1 134 134 VAL HG22 H 1 1.03 0.03 . 2 . . . . 134 VAL HG2 . 6643 1 1307 . 1 1 134 134 VAL HG23 H 1 1.03 0.03 . 2 . . . . 134 VAL HG2 . 6643 1 1308 . 1 1 134 134 VAL C C 13 177.61 0.40 . 1 . . . . 134 VAL C . 6643 1 1309 . 1 1 134 134 VAL CA C 13 67.82 0.40 . 1 . . . . 134 VAL CA . 6643 1 1310 . 1 1 134 134 VAL CB C 13 31.59 0.40 . 1 . . . . 134 VAL CB . 6643 1 1311 . 1 1 134 134 VAL CG1 C 13 23.89 0.40 . 2 . . . . 134 VAL CG1 . 6643 1 1312 . 1 1 134 134 VAL CG2 C 13 22.03 0.40 . 2 . . . . 134 VAL CG2 . 6643 1 1313 . 1 1 134 134 VAL N N 15 119.61 0.10 . 1 . . . . 134 VAL N . 6643 1 1314 . 1 1 135 135 SER H H 1 7.82 0.03 . 1 . . . . 135 SER H . 6643 1 1315 . 1 1 135 135 SER HA H 1 4.17 0.03 . 1 . . . . 135 SER HA . 6643 1 1316 . 1 1 135 135 SER HB2 H 1 4.03 0.03 . 2 . . . . 135 SER HB2 . 6643 1 1317 . 1 1 135 135 SER C C 13 174.86 0.40 . 1 . . . . 135 SER C . 6643 1 1318 . 1 1 135 135 SER CA C 13 61.57 0.40 . 1 . . . . 135 SER CA . 6643 1 1319 . 1 1 135 135 SER CB C 13 63.34 0.40 . 1 . . . . 135 SER CB . 6643 1 1320 . 1 1 135 135 SER N N 15 112.56 0.10 . 1 . . . . 135 SER N . 6643 1 1321 . 1 1 136 136 GLN H H 1 7.48 0.03 . 1 . . . . 136 GLN H . 6643 1 1322 . 1 1 136 136 GLN HA H 1 4.30 0.03 . 1 . . . . 136 GLN HA . 6643 1 1323 . 1 1 136 136 GLN HB2 H 1 2.21 0.03 . 2 . . . . 136 GLN HB2 . 6643 1 1324 . 1 1 136 136 GLN HB3 H 1 2.08 0.03 . 2 . . . . 136 GLN HB3 . 6643 1 1325 . 1 1 136 136 GLN HG2 H 1 2.34 0.03 . 2 . . . . 136 GLN HG2 . 6643 1 1326 . 1 1 136 136 GLN HG3 H 1 2.42 0.03 . 2 . . . . 136 GLN HG3 . 6643 1 1327 . 1 1 136 136 GLN C C 13 177.24 0.40 . 1 . . . . 136 GLN C . 6643 1 1328 . 1 1 136 136 GLN CA C 13 57.41 0.40 . 1 . . . . 136 GLN CA . 6643 1 1329 . 1 1 136 136 GLN CB C 13 29.91 0.40 . 1 . . . . 136 GLN CB . 6643 1 1330 . 1 1 136 136 GLN N N 15 117.08 0.10 . 1 . . . . 136 GLN N . 6643 1 1331 . 1 1 137 137 VAL H H 1 8.01 0.03 . 1 . . . . 137 VAL H . 6643 1 1332 . 1 1 137 137 VAL HA H 1 4.05 0.03 . 1 . . . . 137 VAL HA . 6643 1 1333 . 1 1 137 137 VAL HB H 1 1.86 0.03 . 1 . . . . 137 VAL HB . 6643 1 1334 . 1 1 137 137 VAL HG11 H 1 0.79 0.03 . 2 . . . . 137 VAL HG1 . 6643 1 1335 . 1 1 137 137 VAL HG12 H 1 0.79 0.03 . 2 . . . . 137 VAL HG1 . 6643 1 1336 . 1 1 137 137 VAL HG13 H 1 0.79 0.03 . 2 . . . . 137 VAL HG1 . 6643 1 1337 . 1 1 137 137 VAL HG21 H 1 1.02 0.03 . 2 . . . . 137 VAL HG2 . 6643 1 1338 . 1 1 137 137 VAL HG22 H 1 1.02 0.03 . 2 . . . . 137 VAL HG2 . 6643 1 1339 . 1 1 137 137 VAL HG23 H 1 1.02 0.03 . 2 . . . . 137 VAL HG2 . 6643 1 1340 . 1 1 137 137 VAL C C 13 175.47 0.40 . 1 . . . . 137 VAL C . 6643 1 1341 . 1 1 137 137 VAL CA C 13 63.93 0.40 . 1 . . . . 137 VAL CA . 6643 1 1342 . 1 1 137 137 VAL CB C 13 33.44 0.40 . 1 . . . . 137 VAL CB . 6643 1 1343 . 1 1 137 137 VAL CG1 C 13 22.27 0.40 . 2 . . . . 137 VAL CG1 . 6643 1 1344 . 1 1 137 137 VAL CG2 C 13 22.43 0.40 . 2 . . . . 137 VAL CG2 . 6643 1 1345 . 1 1 137 137 VAL N N 15 116.22 0.10 . 1 . . . . 137 VAL N . 6643 1 1346 . 1 1 138 138 HIS H H 1 8.60 0.03 . 1 . . . . 138 HIS H . 6643 1 1347 . 1 1 138 138 HIS HA H 1 5.18 0.03 . 1 . . . . 138 HIS HA . 6643 1 1348 . 1 1 138 138 HIS HB2 H 1 2.90 0.03 . 2 . . . . 138 HIS HB2 . 6643 1 1349 . 1 1 138 138 HIS HD2 H 1 6.77 0.03 . 1 . . . . 138 HIS HD2 . 6643 1 1350 . 1 1 138 138 HIS C C 13 172.34 0.40 . 1 . . . . 138 HIS C . 6643 1 1351 . 1 1 138 138 HIS CA C 13 53.99 0.40 . 1 . . . . 138 HIS CA . 6643 1 1352 . 1 1 138 138 HIS CB C 13 30.62 0.40 . 1 . . . . 138 HIS CB . 6643 1 1353 . 1 1 138 138 HIS N N 15 118.02 0.10 . 1 . . . . 138 HIS N . 6643 1 1354 . 1 1 139 139 PRO HA H 1 4.44 0.03 . 1 . . . . 139 PRO HA . 6643 1 1355 . 1 1 139 139 PRO HB2 H 1 2.02 0.03 . 2 . . . . 139 PRO HB2 . 6643 1 1356 . 1 1 139 139 PRO HB3 H 1 2.50 0.03 . 2 . . . . 139 PRO HB3 . 6643 1 1357 . 1 1 139 139 PRO HG2 H 1 2.05 0.03 . 2 . . . . 139 PRO HG2 . 6643 1 1358 . 1 1 139 139 PRO HG3 H 1 1.99 0.03 . 2 . . . . 139 PRO HG3 . 6643 1 1359 . 1 1 139 139 PRO HD2 H 1 3.67 0.03 . 2 . . . . 139 PRO HD2 . 6643 1 1360 . 1 1 139 139 PRO HD3 H 1 3.30 0.03 . 2 . . . . 139 PRO HD3 . 6643 1 1361 . 1 1 139 139 PRO CA C 13 64.49 0.40 . 1 . . . . 139 PRO CA . 6643 1 1362 . 1 1 139 139 PRO CB C 13 31.85 0.40 . 1 . . . . 139 PRO CB . 6643 1 1363 . 1 1 139 139 PRO CG C 13 27.19 0.40 . 1 . . . . 139 PRO CG . 6643 1 1364 . 1 1 139 139 PRO CD C 13 50.34 0.40 . 1 . . . . 139 PRO CD . 6643 1 1365 . 1 1 141 141 THR H H 1 7.97 0.03 . 1 . . . . 141 THR H . 6643 1 1366 . 1 1 141 141 THR HA H 1 4.19 0.03 . 1 . . . . 141 THR HA . 6643 1 1367 . 1 1 141 141 THR HB H 1 4.13 0.03 . 1 . . . . 141 THR HB . 6643 1 1368 . 1 1 141 141 THR HG21 H 1 1.23 0.03 . 1 . . . . 141 THR HG2 . 6643 1 1369 . 1 1 141 141 THR HG22 H 1 1.23 0.03 . 1 . . . . 141 THR HG2 . 6643 1 1370 . 1 1 141 141 THR HG23 H 1 1.23 0.03 . 1 . . . . 141 THR HG2 . 6643 1 1371 . 1 1 141 141 THR CA C 13 63.04 0.40 . 1 . . . . 141 THR CA . 6643 1 1372 . 1 1 141 141 THR CB C 13 69.52 0.40 . 1 . . . . 141 THR CB . 6643 1 1373 . 1 1 141 141 THR CG2 C 13 21.67 0.40 . 1 . . . . 141 THR CG2 . 6643 1 1374 . 1 1 141 141 THR N N 15 116.80 0.10 . 1 . . . . 141 THR N . 6643 1 1375 . 1 1 142 142 LYS H H 1 8.24 0.03 . 1 . . . . 142 LYS H . 6643 1 1376 . 1 1 142 142 LYS HA H 1 4.41 0.03 . 1 . . . . 142 LYS HA . 6643 1 1377 . 1 1 142 142 LYS HB2 H 1 1.78 0.03 . 2 . . . . 142 LYS HB2 . 6643 1 1378 . 1 1 142 142 LYS HB3 H 1 1.88 0.03 . 2 . . . . 142 LYS HB3 . 6643 1 1379 . 1 1 142 142 LYS HG2 H 1 1.47 0.03 . 2 . . . . 142 LYS HG2 . 6643 1 1380 . 1 1 142 142 LYS HD2 H 1 1.71 0.03 . 2 . . . . 142 LYS HD2 . 6643 1 1381 . 1 1 142 142 LYS HE2 H 1 3.01 0.03 . 2 . . . . 142 LYS HE2 . 6643 1 1382 . 1 1 142 142 LYS CA C 13 55.98 0.40 . 1 . . . . 142 LYS CA . 6643 1 1383 . 1 1 142 142 LYS CB C 13 33.08 0.40 . 1 . . . . 142 LYS CB . 6643 1 1384 . 1 1 142 142 LYS CG C 13 24.63 0.40 . 1 . . . . 142 LYS CG . 6643 1 1385 . 1 1 142 142 LYS CD C 13 29.00 0.40 . 1 . . . . 142 LYS CD . 6643 1 1386 . 1 1 142 142 LYS CE C 13 41.93 0.40 . 1 . . . . 142 LYS CE . 6643 1 1387 . 1 1 142 142 LYS N N 15 124.98 0.10 . 1 . . . . 142 LYS N . 6643 1 1388 . 1 1 143 143 GLU HA H 1 4.28 0.03 . 1 . . . . 143 GLU HA . 6643 1 1389 . 1 1 143 143 GLU HB2 H 1 1.96 0.03 . 2 . . . . 143 GLU HB2 . 6643 1 1390 . 1 1 143 143 GLU HB3 H 1 2.08 0.03 . 2 . . . . 143 GLU HB3 . 6643 1 1391 . 1 1 143 143 GLU HG2 H 1 2.28 0.03 . 2 . . . . 143 GLU HG2 . 6643 1 1392 . 1 1 143 143 GLU CA C 13 56.68 0.40 . 1 . . . . 143 GLU CA . 6643 1 1393 . 1 1 143 143 GLU CB C 13 30.30 0.40 . 1 . . . . 143 GLU CB . 6643 1 1394 . 1 1 143 143 GLU CG C 13 36.37 0.40 . 1 . . . . 143 GLU CG . 6643 1 1395 . 1 1 144 144 ASN HA H 1 4.71 0.03 . 1 . . . . 144 ASN HA . 6643 1 1396 . 1 1 144 144 ASN HB2 H 1 2.77 0.03 . 2 . . . . 144 ASN HB2 . 6643 1 1397 . 1 1 144 144 ASN HB3 H 1 2.83 0.03 . 2 . . . . 144 ASN HB3 . 6643 1 1398 . 1 1 144 144 ASN CA C 13 53.07 0.40 . 1 . . . . 144 ASN CA . 6643 1 1399 . 1 1 144 144 ASN CB C 13 38.84 0.40 . 1 . . . . 144 ASN CB . 6643 1 1400 . 1 1 145 145 GLU HA H 1 4.35 0.03 . 1 . . . . 145 GLU HA . 6643 1 1401 . 1 1 145 145 GLU HB2 H 1 1.94 0.03 . 2 . . . . 145 GLU HB2 . 6643 1 1402 . 1 1 145 145 GLU HB3 H 1 2.08 0.03 . 2 . . . . 145 GLU HB3 . 6643 1 1403 . 1 1 145 145 GLU HG2 H 1 2.31 0.03 . 2 . . . . 145 GLU HG2 . 6643 1 1404 . 1 1 145 145 GLU HG3 H 1 2.24 0.03 . 2 . . . . 145 GLU HG3 . 6643 1 1405 . 1 1 145 145 GLU C C 13 176.02 0.40 . 1 . . . . 145 GLU C . 6643 1 1406 . 1 1 145 145 GLU CA C 13 56.52 0.40 . 1 . . . . 145 GLU CA . 6643 1 1407 . 1 1 145 145 GLU CB C 13 30.44 0.40 . 1 . . . . 145 GLU CB . 6643 1 1408 . 1 1 145 145 GLU CG C 13 36.52 0.40 . 1 . . . . 145 GLU CG . 6643 1 1409 . 1 1 146 146 ILE H H 1 8.01 0.03 . 1 . . . . 146 ILE H . 6643 1 1410 . 1 1 146 146 ILE HA H 1 4.13 0.03 . 1 . . . . 146 ILE HA . 6643 1 1411 . 1 1 146 146 ILE HB H 1 1.81 0.03 . 1 . . . . 146 ILE HB . 6643 1 1412 . 1 1 146 146 ILE HG12 H 1 1.14 0.03 . 2 . . . . 146 ILE HG12 . 6643 1 1413 . 1 1 146 146 ILE HG13 H 1 1.41 0.03 . 2 . . . . 146 ILE HG13 . 6643 1 1414 . 1 1 146 146 ILE HG21 H 1 0.81 0.03 . 1 . . . . 146 ILE HG2 . 6643 1 1415 . 1 1 146 146 ILE HG22 H 1 0.81 0.03 . 1 . . . . 146 ILE HG2 . 6643 1 1416 . 1 1 146 146 ILE HG23 H 1 0.81 0.03 . 1 . . . . 146 ILE HG2 . 6643 1 1417 . 1 1 146 146 ILE HD11 H 1 0.81 0.03 . 1 . . . . 146 ILE HD1 . 6643 1 1418 . 1 1 146 146 ILE HD12 H 1 0.81 0.03 . 1 . . . . 146 ILE HD1 . 6643 1 1419 . 1 1 146 146 ILE HD13 H 1 0.81 0.03 . 1 . . . . 146 ILE HD1 . 6643 1 1420 . 1 1 146 146 ILE C C 13 174.87 0.40 . 1 . . . . 146 ILE C . 6643 1 1421 . 1 1 146 146 ILE CA C 13 60.81 0.40 . 1 . . . . 146 ILE CA . 6643 1 1422 . 1 1 146 146 ILE CB C 13 38.81 0.40 . 1 . . . . 146 ILE CB . 6643 1 1423 . 1 1 146 146 ILE CG1 C 13 27.12 0.40 . 1 . . . . 146 ILE CG1 . 6643 1 1424 . 1 1 146 146 ILE CG2 C 13 17.50 0.40 . 1 . . . . 146 ILE CG2 . 6643 1 1425 . 1 1 146 146 ILE CD1 C 13 12.81 0.40 . 1 . . . . 146 ILE CD1 . 6643 1 1426 . 1 1 146 146 ILE N N 15 121.51 0.10 . 1 . . . . 146 ILE N . 6643 1 1427 . 1 1 147 147 TYR H H 1 7.47 0.03 . 1 . . . . 147 TYR H . 6643 1 1428 . 1 1 147 147 TYR HA H 1 4.97 0.03 . 1 . . . . 147 TYR HA . 6643 1 1429 . 1 1 147 147 TYR HB2 H 1 3.10 0.03 . 2 . . . . 147 TYR HB2 . 6643 1 1430 . 1 1 147 147 TYR HD1 H 1 7.01 0.03 . 3 . . . . 147 TYR HD1 . 6643 1 1431 . 1 1 147 147 TYR HE1 H 1 6.86 0.03 . 3 . . . . 147 TYR HE1 . 6643 1 1432 . 1 1 147 147 TYR C C 13 172.79 0.40 . 1 . . . . 147 TYR C . 6643 1 1433 . 1 1 147 147 TYR CA C 13 54.58 0.40 . 1 . . . . 147 TYR CA . 6643 1 1434 . 1 1 147 147 TYR CB C 13 37.91 0.40 . 1 . . . . 147 TYR CB . 6643 1 1435 . 1 1 147 147 TYR CD1 C 13 134.29 0.40 . 3 . . . . 147 TYR CD1 . 6643 1 1436 . 1 1 147 147 TYR CE1 C 13 117.96 0.40 . 3 . . . . 147 TYR CE1 . 6643 1 1437 . 1 1 147 147 TYR N N 15 122.84 0.10 . 1 . . . . 147 TYR N . 6643 1 1438 . 1 1 148 148 PRO HA H 1 4.46 0.03 . 1 . . . . 148 PRO HA . 6643 1 1439 . 1 1 148 148 PRO HB2 H 1 1.97 0.03 . 2 . . . . 148 PRO HB2 . 6643 1 1440 . 1 1 148 148 PRO HB3 H 1 2.32 0.03 . 2 . . . . 148 PRO HB3 . 6643 1 1441 . 1 1 148 148 PRO HG2 H 1 2.03 0.03 . 2 . . . . 148 PRO HG2 . 6643 1 1442 . 1 1 148 148 PRO HG3 H 1 1.96 0.03 . 2 . . . . 148 PRO HG3 . 6643 1 1443 . 1 1 148 148 PRO HD2 H 1 3.78 0.03 . 2 . . . . 148 PRO HD2 . 6643 1 1444 . 1 1 148 148 PRO CA C 13 62.93 0.40 . 1 . . . . 148 PRO CA . 6643 1 1445 . 1 1 148 148 PRO CB C 13 32.11 0.40 . 1 . . . . 148 PRO CB . 6643 1 1446 . 1 1 148 148 PRO CG C 13 28.05 0.40 . 1 . . . . 148 PRO CG . 6643 1 1447 . 1 1 148 148 PRO CD C 13 50.34 0.40 . 1 . . . . 148 PRO CD . 6643 1 1448 . 1 1 149 149 VAL H H 1 8.16 0.03 . 1 . . . . 149 VAL H . 6643 1 1449 . 1 1 149 149 VAL HA H 1 4.26 0.03 . 1 . . . . 149 VAL HA . 6643 1 1450 . 1 1 149 149 VAL HB H 1 2.02 0.03 . 1 . . . . 149 VAL HB . 6643 1 1451 . 1 1 149 149 VAL HG11 H 1 0.95 0.03 . 2 . . . . 149 VAL HG1 . 6643 1 1452 . 1 1 149 149 VAL HG12 H 1 0.95 0.03 . 2 . . . . 149 VAL HG1 . 6643 1 1453 . 1 1 149 149 VAL HG13 H 1 0.95 0.03 . 2 . . . . 149 VAL HG1 . 6643 1 1454 . 1 1 149 149 VAL C C 13 175.98 0.40 . 1 . . . . 149 VAL C . 6643 1 1455 . 1 1 149 149 VAL CA C 13 61.89 0.40 . 1 . . . . 149 VAL CA . 6643 1 1456 . 1 1 149 149 VAL CB C 13 33.45 0.40 . 1 . . . . 149 VAL CB . 6643 1 1457 . 1 1 149 149 VAL CG1 C 13 21.12 0.40 . 2 . . . . 149 VAL CG1 . 6643 1 1458 . 1 1 149 149 VAL N N 15 122.11 0.10 . 1 . . . . 149 VAL N . 6643 1 1459 . 1 1 150 150 TRP H H 1 8.81 0.03 . 1 . . . . 150 TRP H . 6643 1 1460 . 1 1 150 150 TRP HE3 H 1 7.50 0.03 . 1 . . . . 150 TRP HE3 . 6643 1 1461 . 1 1 150 150 TRP HZ2 H 1 7.15 0.03 . 1 . . . . 150 TRP HZ2 . 6643 1 1462 . 1 1 150 150 TRP HZ3 H 1 6.97 0.03 . 1 . . . . 150 TRP HZ3 . 6643 1 1463 . 1 1 150 150 TRP HH2 H 1 6.86 0.03 . 1 . . . . 150 TRP HH2 . 6643 1 1464 . 1 1 150 150 TRP C C 13 175.91 0.40 . 1 . . . . 150 TRP C . 6643 1 1465 . 1 1 150 150 TRP CA C 13 57.21 0.40 . 1 . . . . 150 TRP CA . 6643 1 1466 . 1 1 150 150 TRP CE3 C 13 120.73 0.40 . 1 . . . . 150 TRP CE3 . 6643 1 1467 . 1 1 150 150 TRP CZ2 C 13 113.90 0.40 . 1 . . . . 150 TRP CZ2 . 6643 1 1468 . 1 1 150 150 TRP CZ3 C 13 122.52 0.40 . 1 . . . . 150 TRP CZ3 . 6643 1 1469 . 1 1 150 150 TRP CH2 C 13 124.04 0.40 . 1 . . . . 150 TRP CH2 . 6643 1 1470 . 1 1 150 150 TRP N N 15 127.83 0.10 . 1 . . . . 150 TRP N . 6643 1 1471 . 1 1 151 151 SER HA H 1 4.36 0.03 . 1 . . . . 151 SER HA . 6643 1 1472 . 1 1 151 151 SER HB2 H 1 3.69 0.03 . 2 . . . . 151 SER HB2 . 6643 1 1473 . 1 1 151 151 SER HB3 H 1 3.77 0.03 . 2 . . . . 151 SER HB3 . 6643 1 1474 . 1 1 151 151 SER CA C 13 57.45 0.40 . 1 . . . . 151 SER CA . 6643 1 1475 . 1 1 151 151 SER CB C 13 63.16 0.40 . 1 . . . . 151 SER CB . 6643 1 1476 . 1 1 153 153 LEU HA H 1 4.11 0.03 . 1 . . . . 153 LEU HA . 6643 1 1477 . 1 1 153 153 LEU HB2 H 1 1.57 0.03 . 2 . . . . 153 LEU HB2 . 6643 1 1478 . 1 1 153 153 LEU HB3 H 1 1.78 0.03 . 2 . . . . 153 LEU HB3 . 6643 1 1479 . 1 1 153 153 LEU HG H 1 1.72 0.03 . 1 . . . . 153 LEU HG . 6643 1 1480 . 1 1 153 153 LEU HD11 H 1 0.79 0.03 . 2 . . . . 153 LEU HD1 . 6643 1 1481 . 1 1 153 153 LEU HD12 H 1 0.79 0.03 . 2 . . . . 153 LEU HD1 . 6643 1 1482 . 1 1 153 153 LEU HD13 H 1 0.79 0.03 . 2 . . . . 153 LEU HD1 . 6643 1 1483 . 1 1 153 153 LEU HD21 H 1 0.35 0.03 . 2 . . . . 153 LEU HD2 . 6643 1 1484 . 1 1 153 153 LEU HD22 H 1 0.35 0.03 . 2 . . . . 153 LEU HD2 . 6643 1 1485 . 1 1 153 153 LEU HD23 H 1 0.35 0.03 . 2 . . . . 153 LEU HD2 . 6643 1 1486 . 1 1 153 153 LEU CA C 13 56.35 0.40 . 1 . . . . 153 LEU CA . 6643 1 1487 . 1 1 153 153 LEU CB C 13 41.78 0.40 . 1 . . . . 153 LEU CB . 6643 1 1488 . 1 1 153 153 LEU CG C 13 26.99 0.40 . 1 . . . . 153 LEU CG . 6643 1 1489 . 1 1 153 153 LEU CD1 C 13 24.73 0.40 . 2 . . . . 153 LEU CD1 . 6643 1 1490 . 1 1 153 153 LEU CD2 C 13 21.66 0.40 . 2 . . . . 153 LEU CD2 . 6643 1 1491 . 1 1 156 156 LEU HA H 1 3.92 0.03 . 1 . . . . 156 LEU HA . 6643 1 1492 . 1 1 156 156 LEU HB2 H 1 1.03 0.03 . 2 . . . . 156 LEU HB2 . 6643 1 1493 . 1 1 156 156 LEU HB3 H 1 1.46 0.03 . 2 . . . . 156 LEU HB3 . 6643 1 1494 . 1 1 156 156 LEU HG H 1 1.25 0.03 . 1 . . . . 156 LEU HG . 6643 1 1495 . 1 1 156 156 LEU HD11 H 1 0.81 0.03 . 2 . . . . 156 LEU HD1 . 6643 1 1496 . 1 1 156 156 LEU HD12 H 1 0.81 0.03 . 2 . . . . 156 LEU HD1 . 6643 1 1497 . 1 1 156 156 LEU HD13 H 1 0.81 0.03 . 2 . . . . 156 LEU HD1 . 6643 1 1498 . 1 1 156 156 LEU HD21 H 1 0.57 0.03 . 2 . . . . 156 LEU HD2 . 6643 1 1499 . 1 1 156 156 LEU HD22 H 1 0.57 0.03 . 2 . . . . 156 LEU HD2 . 6643 1 1500 . 1 1 156 156 LEU HD23 H 1 0.57 0.03 . 2 . . . . 156 LEU HD2 . 6643 1 1501 . 1 1 156 156 LEU CA C 13 58.17 0.40 . 1 . . . . 156 LEU CA . 6643 1 1502 . 1 1 156 156 LEU CB C 13 39.33 0.40 . 1 . . . . 156 LEU CB . 6643 1 1503 . 1 1 156 156 LEU CG C 13 26.93 0.40 . 1 . . . . 156 LEU CG . 6643 1 1504 . 1 1 156 156 LEU CD1 C 13 23.35 0.40 . 2 . . . . 156 LEU CD1 . 6643 1 1505 . 1 1 156 156 LEU CD2 C 13 24.82 0.40 . 2 . . . . 156 LEU CD2 . 6643 1 1506 . 1 1 158 158 MET HA H 1 4.33 0.03 . 1 . . . . 158 MET HA . 6643 1 1507 . 1 1 158 158 MET HB2 H 1 2.01 0.03 . 2 . . . . 158 MET HB2 . 6643 1 1508 . 1 1 158 158 MET HB3 H 1 2.16 0.03 . 2 . . . . 158 MET HB3 . 6643 1 1509 . 1 1 158 158 MET HG2 H 1 2.80 0.03 . 2 . . . . 158 MET HG2 . 6643 1 1510 . 1 1 158 158 MET HG3 H 1 2.73 0.03 . 2 . . . . 158 MET HG3 . 6643 1 1511 . 1 1 158 158 MET HE1 H 1 2.13 0.03 . 1 . . . . 158 MET HE . 6643 1 1512 . 1 1 158 158 MET HE2 H 1 2.13 0.03 . 1 . . . . 158 MET HE . 6643 1 1513 . 1 1 158 158 MET HE3 H 1 2.13 0.03 . 1 . . . . 158 MET HE . 6643 1 1514 . 1 1 158 158 MET CA C 13 56.03 0.40 . 1 . . . . 158 MET CA . 6643 1 1515 . 1 1 158 158 MET CB C 13 33.35 0.40 . 1 . . . . 158 MET CB . 6643 1 1516 . 1 1 158 158 MET CG C 13 32.55 0.40 . 1 . . . . 158 MET CG . 6643 1 1517 . 1 1 158 158 MET CE C 13 17.26 0.40 . 1 . . . . 158 MET CE . 6643 1 1518 . 1 1 159 159 ALA HA H 1 4.20 0.03 . 1 . . . . 159 ALA HA . 6643 1 1519 . 1 1 159 159 ALA HB1 H 1 1.48 0.03 . 1 . . . . 159 ALA HB . 6643 1 1520 . 1 1 159 159 ALA HB2 H 1 1.48 0.03 . 1 . . . . 159 ALA HB . 6643 1 1521 . 1 1 159 159 ALA HB3 H 1 1.48 0.03 . 1 . . . . 159 ALA HB . 6643 1 1522 . 1 1 159 159 ALA C C 13 178.01 0.40 . 1 . . . . 159 ALA C . 6643 1 1523 . 1 1 159 159 ALA CA C 13 53.54 0.40 . 1 . . . . 159 ALA CA . 6643 1 1524 . 1 1 159 159 ALA CB C 13 19.12 0.40 . 1 . . . . 159 ALA CB . 6643 1 1525 . 1 1 160 160 ASP H H 1 7.84 0.03 . 1 . . . . 160 ASP H . 6643 1 1526 . 1 1 160 160 ASP HA H 1 4.63 0.03 . 1 . . . . 160 ASP HA . 6643 1 1527 . 1 1 160 160 ASP HB2 H 1 2.83 0.03 . 2 . . . . 160 ASP HB2 . 6643 1 1528 . 1 1 160 160 ASP HB3 H 1 2.67 0.03 . 2 . . . . 160 ASP HB3 . 6643 1 1529 . 1 1 160 160 ASP C C 13 175.67 0.40 . 1 . . . . 160 ASP C . 6643 1 1530 . 1 1 160 160 ASP CA C 13 53.81 0.40 . 1 . . . . 160 ASP CA . 6643 1 1531 . 1 1 160 160 ASP CB C 13 42.33 0.40 . 1 . . . . 160 ASP CB . 6643 1 1532 . 1 1 160 160 ASP N N 15 117.42 0.10 . 1 . . . . 160 ASP N . 6643 1 1533 . 1 1 161 161 GLU C C 13 177.74 0.40 . 1 . . . . 161 GLU C . 6643 1 1534 . 1 1 162 162 GLU H H 1 8.58 0.03 . 1 . . . . 162 GLU H . 6643 1 1535 . 1 1 162 162 GLU HA H 1 3.80 0.03 . 1 . . . . 162 GLU HA . 6643 1 1536 . 1 1 162 162 GLU HB2 H 1 2.00 0.03 . 2 . . . . 162 GLU HB2 . 6643 1 1537 . 1 1 162 162 GLU HG2 H 1 2.23 0.03 . 2 . . . . 162 GLU HG2 . 6643 1 1538 . 1 1 162 162 GLU HG3 H 1 2.08 0.03 . 2 . . . . 162 GLU HG3 . 6643 1 1539 . 1 1 162 162 GLU C C 13 179.40 0.40 . 1 . . . . 162 GLU C . 6643 1 1540 . 1 1 162 162 GLU CA C 13 60.37 0.40 . 1 . . . . 162 GLU CA . 6643 1 1541 . 1 1 162 162 GLU CB C 13 29.16 0.40 . 1 . . . . 162 GLU CB . 6643 1 1542 . 1 1 162 162 GLU CG C 13 36.82 0.40 . 1 . . . . 162 GLU CG . 6643 1 1543 . 1 1 162 162 GLU N N 15 118.23 0.10 . 1 . . . . 162 GLU N . 6643 1 1544 . 1 1 163 163 SER H H 1 8.09 0.03 . 1 . . . . 163 SER H . 6643 1 1545 . 1 1 163 163 SER HA H 1 3.99 0.03 . 1 . . . . 163 SER HA . 6643 1 1546 . 1 1 163 163 SER C C 13 176.94 0.40 . 1 . . . . 163 SER C . 6643 1 1547 . 1 1 163 163 SER CA C 13 62.13 0.40 . 1 . . . . 163 SER CA . 6643 1 1548 . 1 1 163 163 SER CB C 13 62.77 0.40 . 1 . . . . 163 SER CB . 6643 1 1549 . 1 1 163 163 SER N N 15 116.13 0.10 . 1 . . . . 163 SER N . 6643 1 1550 . 1 1 164 164 ARG H H 1 8.34 0.03 . 1 . . . . 164 ARG H . 6643 1 1551 . 1 1 164 164 ARG HA H 1 4.25 0.03 . 1 . . . . 164 ARG HA . 6643 1 1552 . 1 1 164 164 ARG HB2 H 1 2.09 0.03 . 2 . . . . 164 ARG HB2 . 6643 1 1553 . 1 1 164 164 ARG HB3 H 1 1.91 0.03 . 2 . . . . 164 ARG HB3 . 6643 1 1554 . 1 1 164 164 ARG HG2 H 1 1.57 0.03 . 2 . . . . 164 ARG HG2 . 6643 1 1555 . 1 1 164 164 ARG HG3 H 1 1.96 0.03 . 2 . . . . 164 ARG HG3 . 6643 1 1556 . 1 1 164 164 ARG HD2 H 1 3.50 0.03 . 2 . . . . 164 ARG HD2 . 6643 1 1557 . 1 1 164 164 ARG HD3 H 1 3.42 0.03 . 2 . . . . 164 ARG HD3 . 6643 1 1558 . 1 1 164 164 ARG C C 13 178.27 0.40 . 1 . . . . 164 ARG C . 6643 1 1559 . 1 1 164 164 ARG CA C 13 59.79 0.40 . 1 . . . . 164 ARG CA . 6643 1 1560 . 1 1 164 164 ARG CB C 13 30.81 0.40 . 1 . . . . 164 ARG CB . 6643 1 1561 . 1 1 164 164 ARG CG C 13 28.15 0.40 . 1 . . . . 164 ARG CG . 6643 1 1562 . 1 1 164 164 ARG CD C 13 43.75 0.40 . 1 . . . . 164 ARG CD . 6643 1 1563 . 1 1 164 164 ARG N N 15 124.21 0.10 . 1 . . . . 164 ARG N . 6643 1 1564 . 1 1 165 165 LEU H H 1 8.77 0.03 . 1 . . . . 165 LEU H . 6643 1 1565 . 1 1 165 165 LEU HA H 1 4.32 0.03 . 1 . . . . 165 LEU HA . 6643 1 1566 . 1 1 165 165 LEU HB2 H 1 1.42 0.03 . 2 . . . . 165 LEU HB2 . 6643 1 1567 . 1 1 165 165 LEU HG H 1 2.01 0.03 . 1 . . . . 165 LEU HG . 6643 1 1568 . 1 1 165 165 LEU HD11 H 1 0.99 0.03 . 2 . . . . 165 LEU HD1 . 6643 1 1569 . 1 1 165 165 LEU HD12 H 1 0.99 0.03 . 2 . . . . 165 LEU HD1 . 6643 1 1570 . 1 1 165 165 LEU HD13 H 1 0.99 0.03 . 2 . . . . 165 LEU HD1 . 6643 1 1571 . 1 1 165 165 LEU HD21 H 1 0.73 0.03 . 2 . . . . 165 LEU HD2 . 6643 1 1572 . 1 1 165 165 LEU HD22 H 1 0.73 0.03 . 2 . . . . 165 LEU HD2 . 6643 1 1573 . 1 1 165 165 LEU HD23 H 1 0.73 0.03 . 2 . . . . 165 LEU HD2 . 6643 1 1574 . 1 1 165 165 LEU C C 13 179.77 0.40 . 1 . . . . 165 LEU C . 6643 1 1575 . 1 1 165 165 LEU CA C 13 58.55 0.40 . 1 . . . . 165 LEU CA . 6643 1 1576 . 1 1 165 165 LEU CB C 13 41.81 0.40 . 1 . . . . 165 LEU CB . 6643 1 1577 . 1 1 165 165 LEU CG C 13 27.22 0.40 . 1 . . . . 165 LEU CG . 6643 1 1578 . 1 1 165 165 LEU CD1 C 13 25.80 0.40 . 2 . . . . 165 LEU CD1 . 6643 1 1579 . 1 1 165 165 LEU CD2 C 13 22.38 0.40 . 2 . . . . 165 LEU CD2 . 6643 1 1580 . 1 1 165 165 LEU N N 15 117.79 0.10 . 1 . . . . 165 LEU N . 6643 1 1581 . 1 1 166 166 SER H H 1 8.05 0.03 . 1 . . . . 166 SER H . 6643 1 1582 . 1 1 166 166 SER HA H 1 4.14 0.03 . 1 . . . . 166 SER HA . 6643 1 1583 . 1 1 166 166 SER HB2 H 1 3.97 0.03 . 2 . . . . 166 SER HB2 . 6643 1 1584 . 1 1 166 166 SER HB3 H 1 4.04 0.03 . 2 . . . . 166 SER HB3 . 6643 1 1585 . 1 1 166 166 SER CA C 13 61.88 0.40 . 1 . . . . 166 SER CA . 6643 1 1586 . 1 1 166 166 SER CB C 13 62.72 0.40 . 1 . . . . 166 SER CB . 6643 1 1587 . 1 1 166 166 SER N N 15 113.77 0.10 . 1 . . . . 166 SER N . 6643 1 1588 . 1 1 167 167 ALA H H 1 7.90 0.03 . 1 . . . . 167 ALA H . 6643 1 1589 . 1 1 167 167 ALA HA H 1 4.33 0.03 . 1 . . . . 167 ALA HA . 6643 1 1590 . 1 1 167 167 ALA HB1 H 1 1.57 0.03 . 1 . . . . 167 ALA HB . 6643 1 1591 . 1 1 167 167 ALA HB2 H 1 1.57 0.03 . 1 . . . . 167 ALA HB . 6643 1 1592 . 1 1 167 167 ALA HB3 H 1 1.57 0.03 . 1 . . . . 167 ALA HB . 6643 1 1593 . 1 1 167 167 ALA C C 13 181.65 0.40 . 1 . . . . 167 ALA C . 6643 1 1594 . 1 1 167 167 ALA CA C 13 55.42 0.40 . 1 . . . . 167 ALA CA . 6643 1 1595 . 1 1 167 167 ALA CB C 13 18.53 0.40 . 1 . . . . 167 ALA CB . 6643 1 1596 . 1 1 167 167 ALA N N 15 125.15 0.10 . 1 . . . . 167 ALA N . 6643 1 1597 . 1 1 168 168 TYR H H 1 8.48 0.03 . 1 . . . . 168 TYR H . 6643 1 1598 . 1 1 168 168 TYR HA H 1 3.95 0.03 . 1 . . . . 168 TYR HA . 6643 1 1599 . 1 1 168 168 TYR HB2 H 1 3.11 0.03 . 2 . . . . 168 TYR HB2 . 6643 1 1600 . 1 1 168 168 TYR HD1 H 1 7.01 0.03 . 3 . . . . 168 TYR HD1 . 6643 1 1601 . 1 1 168 168 TYR HE1 H 1 6.72 0.03 . 3 . . . . 168 TYR HE1 . 6643 1 1602 . 1 1 168 168 TYR C C 13 177.20 0.40 . 1 . . . . 168 TYR C . 6643 1 1603 . 1 1 168 168 TYR CA C 13 62.67 0.40 . 1 . . . . 168 TYR CA . 6643 1 1604 . 1 1 168 168 TYR CB C 13 39.62 0.40 . 1 . . . . 168 TYR CB . 6643 1 1605 . 1 1 168 168 TYR CD1 C 13 131.99 0.40 . 3 . . . . 168 TYR CD1 . 6643 1 1606 . 1 1 168 168 TYR CE1 C 13 117.89 0.40 . 3 . . . . 168 TYR CE1 . 6643 1 1607 . 1 1 168 168 TYR N N 15 119.69 0.10 . 1 . . . . 168 TYR N . 6643 1 1608 . 1 1 169 169 TYR H H 1 8.75 0.03 . 1 . . . . 169 TYR H . 6643 1 1609 . 1 1 169 169 TYR HA H 1 3.78 0.03 . 1 . . . . 169 TYR HA . 6643 1 1610 . 1 1 169 169 TYR HB2 H 1 3.27 0.03 . 2 . . . . 169 TYR HB2 . 6643 1 1611 . 1 1 169 169 TYR HB3 H 1 3.48 0.03 . 2 . . . . 169 TYR HB3 . 6643 1 1612 . 1 1 169 169 TYR HD1 H 1 7.26 0.03 . 3 . . . . 169 TYR HD1 . 6643 1 1613 . 1 1 169 169 TYR HE1 H 1 6.88 0.03 . 3 . . . . 169 TYR HE1 . 6643 1 1614 . 1 1 169 169 TYR C C 13 177.26 0.40 . 1 . . . . 169 TYR C . 6643 1 1615 . 1 1 169 169 TYR CA C 13 62.73 0.40 . 1 . . . . 169 TYR CA . 6643 1 1616 . 1 1 169 169 TYR CB C 13 39.08 0.40 . 1 . . . . 169 TYR CB . 6643 1 1617 . 1 1 169 169 TYR CD1 C 13 133.57 0.40 . 3 . . . . 169 TYR CD1 . 6643 1 1618 . 1 1 169 169 TYR CE1 C 13 118.55 0.40 . 3 . . . . 169 TYR CE1 . 6643 1 1619 . 1 1 169 169 TYR N N 15 120.20 0.10 . 1 . . . . 169 TYR N . 6643 1 1620 . 1 1 170 170 ASN H H 1 8.51 0.03 . 1 . . . . 170 ASN H . 6643 1 1621 . 1 1 170 170 ASN HA H 1 4.54 0.03 . 1 . . . . 170 ASN HA . 6643 1 1622 . 1 1 170 170 ASN HB2 H 1 3.05 0.03 . 2 . . . . 170 ASN HB2 . 6643 1 1623 . 1 1 170 170 ASN HB3 H 1 3.14 0.03 . 2 . . . . 170 ASN HB3 . 6643 1 1624 . 1 1 170 170 ASN C C 13 177.31 0.40 . 1 . . . . 170 ASN C . 6643 1 1625 . 1 1 170 170 ASN CA C 13 57.08 0.40 . 1 . . . . 170 ASN CA . 6643 1 1626 . 1 1 170 170 ASN CB C 13 39.39 0.40 . 1 . . . . 170 ASN CB . 6643 1 1627 . 1 1 170 170 ASN N N 15 116.03 0.10 . 1 . . . . 170 ASN N . 6643 1 1628 . 1 1 171 171 LEU H H 1 8.12 0.03 . 1 . . . . 171 LEU H . 6643 1 1629 . 1 1 171 171 LEU HA H 1 4.34 0.03 . 1 . . . . 171 LEU HA . 6643 1 1630 . 1 1 171 171 LEU HB2 H 1 1.99 0.03 . 2 . . . . 171 LEU HB2 . 6643 1 1631 . 1 1 171 171 LEU HB3 H 1 1.89 0.03 . 2 . . . . 171 LEU HB3 . 6643 1 1632 . 1 1 171 171 LEU HG H 1 0.92 0.03 . 1 . . . . 171 LEU HG . 6643 1 1633 . 1 1 171 171 LEU HD11 H 1 1.00 0.03 . 2 . . . . 171 LEU HD1 . 6643 1 1634 . 1 1 171 171 LEU HD12 H 1 1.00 0.03 . 2 . . . . 171 LEU HD1 . 6643 1 1635 . 1 1 171 171 LEU HD13 H 1 1.00 0.03 . 2 . . . . 171 LEU HD1 . 6643 1 1636 . 1 1 171 171 LEU C C 13 178.80 0.40 . 1 . . . . 171 LEU C . 6643 1 1637 . 1 1 171 171 LEU CA C 13 59.04 0.40 . 1 . . . . 171 LEU CA . 6643 1 1638 . 1 1 171 171 LEU CB C 13 42.70 0.40 . 1 . . . . 171 LEU CB . 6643 1 1639 . 1 1 171 171 LEU CG C 13 26.19 0.40 . 1 . . . . 171 LEU CG . 6643 1 1640 . 1 1 171 171 LEU CD1 C 13 25.25 0.40 . 2 . . . . 171 LEU CD1 . 6643 1 1641 . 1 1 171 171 LEU N N 15 121.71 0.10 . 1 . . . . 171 LEU N . 6643 1 1642 . 1 1 172 172 LEU H H 1 8.54 0.03 . 1 . . . . 172 LEU H . 6643 1 1643 . 1 1 172 172 LEU HA H 1 4.03 0.03 . 1 . . . . 172 LEU HA . 6643 1 1644 . 1 1 172 172 LEU HB2 H 1 1.91 0.03 . 2 . . . . 172 LEU HB2 . 6643 1 1645 . 1 1 172 172 LEU HB3 H 1 1.54 0.03 . 2 . . . . 172 LEU HB3 . 6643 1 1646 . 1 1 172 172 LEU HG H 1 1.90 0.03 . 1 . . . . 172 LEU HG . 6643 1 1647 . 1 1 172 172 LEU HD11 H 1 0.50 0.03 . 2 . . . . 172 LEU HD1 . 6643 1 1648 . 1 1 172 172 LEU HD12 H 1 0.50 0.03 . 2 . . . . 172 LEU HD1 . 6643 1 1649 . 1 1 172 172 LEU HD13 H 1 0.50 0.03 . 2 . . . . 172 LEU HD1 . 6643 1 1650 . 1 1 172 172 LEU HD21 H 1 0.79 0.03 . 2 . . . . 172 LEU HD2 . 6643 1 1651 . 1 1 172 172 LEU HD22 H 1 0.79 0.03 . 2 . . . . 172 LEU HD2 . 6643 1 1652 . 1 1 172 172 LEU HD23 H 1 0.79 0.03 . 2 . . . . 172 LEU HD2 . 6643 1 1653 . 1 1 172 172 LEU C C 13 179.94 0.40 . 1 . . . . 172 LEU C . 6643 1 1654 . 1 1 172 172 LEU CA C 13 57.93 0.40 . 1 . . . . 172 LEU CA . 6643 1 1655 . 1 1 172 172 LEU CB C 13 41.82 0.40 . 1 . . . . 172 LEU CB . 6643 1 1656 . 1 1 172 172 LEU CG C 13 27.51 0.40 . 1 . . . . 172 LEU CG . 6643 1 1657 . 1 1 172 172 LEU CD1 C 13 25.45 0.40 . 2 . . . . 172 LEU CD1 . 6643 1 1658 . 1 1 172 172 LEU CD2 C 13 23.62 0.40 . 2 . . . . 172 LEU CD2 . 6643 1 1659 . 1 1 172 172 LEU N N 15 117.94 0.10 . 1 . . . . 172 LEU N . 6643 1 1660 . 1 1 173 173 HIS H H 1 8.95 0.03 . 1 . . . . 173 HIS H . 6643 1 1661 . 1 1 173 173 HIS HA H 1 3.55 0.03 . 1 . . . . 173 HIS HA . 6643 1 1662 . 1 1 173 173 HIS HB2 H 1 3.32 0.03 . 2 . . . . 173 HIS HB2 . 6643 1 1663 . 1 1 173 173 HIS HB3 H 1 2.91 0.03 . 2 . . . . 173 HIS HB3 . 6643 1 1664 . 1 1 173 173 HIS CA C 13 60.57 0.40 . 1 . . . . 173 HIS CA . 6643 1 1665 . 1 1 173 173 HIS CB C 13 30.51 0.40 . 1 . . . . 173 HIS CB . 6643 1 1666 . 1 1 173 173 HIS N N 15 122.99 0.10 . 1 . . . . 173 HIS N . 6643 1 1667 . 1 1 174 174 CYS H H 1 8.63 0.03 . 1 . . . . 174 CYS H . 6643 1 1668 . 1 1 174 174 CYS HA H 1 4.25 0.03 . 1 . . . . 174 CYS HA . 6643 1 1669 . 1 1 174 174 CYS HB2 H 1 3.46 0.03 . 2 . . . . 174 CYS HB2 . 6643 1 1670 . 1 1 174 174 CYS HB3 H 1 3.71 0.03 . 2 . . . . 174 CYS HB3 . 6643 1 1671 . 1 1 174 174 CYS C C 13 175.84 0.40 . 1 . . . . 174 CYS C . 6643 1 1672 . 1 1 174 174 CYS CA C 13 59.43 0.40 . 1 . . . . 174 CYS CA . 6643 1 1673 . 1 1 174 174 CYS CB C 13 39.26 0.40 . 1 . . . . 174 CYS CB . 6643 1 1674 . 1 1 174 174 CYS N N 15 119.68 0.10 . 1 . . . . 174 CYS N . 6643 1 1675 . 1 1 175 175 LEU H H 1 8.70 0.03 . 1 . . . . 175 LEU H . 6643 1 1676 . 1 1 175 175 LEU HA H 1 3.27 0.03 . 1 . . . . 175 LEU HA . 6643 1 1677 . 1 1 175 175 LEU HB2 H 1 0.96 0.03 . 2 . . . . 175 LEU HB2 . 6643 1 1678 . 1 1 175 175 LEU HB3 H 1 1.66 0.03 . 2 . . . . 175 LEU HB3 . 6643 1 1679 . 1 1 175 175 LEU HG H 1 1.10 0.03 . 1 . . . . 175 LEU HG . 6643 1 1680 . 1 1 175 175 LEU HD11 H 1 0.61 0.03 . 1 . . . . 175 LEU HD1 . 6643 1 1681 . 1 1 175 175 LEU HD12 H 1 0.61 0.03 . 1 . . . . 175 LEU HD1 . 6643 1 1682 . 1 1 175 175 LEU HD13 H 1 0.61 0.03 . 1 . . . . 175 LEU HD1 . 6643 1 1683 . 1 1 175 175 LEU HD21 H 1 -0.32 0.03 . 1 . . . . 175 LEU HD2 . 6643 1 1684 . 1 1 175 175 LEU HD22 H 1 -0.32 0.03 . 1 . . . . 175 LEU HD2 . 6643 1 1685 . 1 1 175 175 LEU HD23 H 1 -0.32 0.03 . 1 . . . . 175 LEU HD2 . 6643 1 1686 . 1 1 175 175 LEU C C 13 179.07 0.40 . 1 . . . . 175 LEU C . 6643 1 1687 . 1 1 175 175 LEU CA C 13 57.79 0.40 . 1 . . . . 175 LEU CA . 6643 1 1688 . 1 1 175 175 LEU CB C 13 40.70 0.40 . 1 . . . . 175 LEU CB . 6643 1 1689 . 1 1 175 175 LEU CG C 13 26.38 0.40 . 1 . . . . 175 LEU CG . 6643 1 1690 . 1 1 175 175 LEU CD1 C 13 25.86 0.40 . 1 . . . . 175 LEU CD1 . 6643 1 1691 . 1 1 175 175 LEU CD2 C 13 19.45 0.40 . 1 . . . . 175 LEU CD2 . 6643 1 1692 . 1 1 175 175 LEU N N 15 123.82 0.10 . 1 . . . . 175 LEU N . 6643 1 1693 . 1 1 176 176 ARG H H 1 7.92 0.03 . 1 . . . . 176 ARG H . 6643 1 1694 . 1 1 176 176 ARG HA H 1 3.95 0.03 . 1 . . . . 176 ARG HA . 6643 1 1695 . 1 1 176 176 ARG HB2 H 1 1.82 0.03 . 2 . . . . 176 ARG HB2 . 6643 1 1696 . 1 1 176 176 ARG HG2 H 1 1.56 0.03 . 2 . . . . 176 ARG HG2 . 6643 1 1697 . 1 1 176 176 ARG HG3 H 1 1.53 0.03 . 2 . . . . 176 ARG HG3 . 6643 1 1698 . 1 1 176 176 ARG HD2 H 1 2.74 0.03 . 2 . . . . 176 ARG HD2 . 6643 1 1699 . 1 1 176 176 ARG HD3 H 1 3.13 0.03 . 2 . . . . 176 ARG HD3 . 6643 1 1700 . 1 1 176 176 ARG C C 13 177.62 0.40 . 1 . . . . 176 ARG C . 6643 1 1701 . 1 1 176 176 ARG CA C 13 59.50 0.40 . 1 . . . . 176 ARG CA . 6643 1 1702 . 1 1 176 176 ARG CB C 13 29.70 0.40 . 1 . . . . 176 ARG CB . 6643 1 1703 . 1 1 176 176 ARG CG C 13 26.64 0.40 . 1 . . . . 176 ARG CG . 6643 1 1704 . 1 1 176 176 ARG CD C 13 43.76 0.40 . 1 . . . . 176 ARG CD . 6643 1 1705 . 1 1 176 176 ARG N N 15 122.09 0.10 . 1 . . . . 176 ARG N . 6643 1 1706 . 1 1 177 177 ARG H H 1 7.83 0.03 . 1 . . . . 177 ARG H . 6643 1 1707 . 1 1 177 177 ARG HA H 1 3.97 0.03 . 1 . . . . 177 ARG HA . 6643 1 1708 . 1 1 177 177 ARG HB2 H 1 1.78 0.03 . 2 . . . . 177 ARG HB2 . 6643 1 1709 . 1 1 177 177 ARG HG2 H 1 1.43 0.03 . 2 . . . . 177 ARG HG2 . 6643 1 1710 . 1 1 177 177 ARG HD2 H 1 3.27 0.03 . 2 . . . . 177 ARG HD2 . 6643 1 1711 . 1 1 177 177 ARG C C 13 179.46 0.40 . 1 . . . . 177 ARG C . 6643 1 1712 . 1 1 177 177 ARG CA C 13 59.11 0.40 . 1 . . . . 177 ARG CA . 6643 1 1713 . 1 1 177 177 ARG CB C 13 30.27 0.40 . 1 . . . . 177 ARG CB . 6643 1 1714 . 1 1 177 177 ARG CG C 13 26.78 0.40 . 1 . . . . 177 ARG CG . 6643 1 1715 . 1 1 177 177 ARG CD C 13 43.48 0.40 . 1 . . . . 177 ARG CD . 6643 1 1716 . 1 1 177 177 ARG N N 15 119.29 0.10 . 1 . . . . 177 ARG N . 6643 1 1717 . 1 1 178 178 ASP H H 1 8.98 0.03 . 1 . . . . 178 ASP H . 6643 1 1718 . 1 1 178 178 ASP HA H 1 4.49 0.03 . 1 . . . . 178 ASP HA . 6643 1 1719 . 1 1 178 178 ASP HB2 H 1 2.78 0.03 . 2 . . . . 178 ASP HB2 . 6643 1 1720 . 1 1 178 178 ASP C C 13 178.57 0.40 . 1 . . . . 178 ASP C . 6643 1 1721 . 1 1 178 178 ASP CA C 13 57.59 0.40 . 1 . . . . 178 ASP CA . 6643 1 1722 . 1 1 178 178 ASP CB C 13 38.83 0.40 . 1 . . . . 178 ASP CB . 6643 1 1723 . 1 1 178 178 ASP N N 15 121.76 0.10 . 1 . . . . 178 ASP N . 6643 1 1724 . 1 1 179 179 SER H H 1 8.67 0.03 . 1 . . . . 179 SER H . 6643 1 1725 . 1 1 179 179 SER HA H 1 3.95 0.03 . 1 . . . . 179 SER HA . 6643 1 1726 . 1 1 179 179 SER CA C 13 62.31 0.40 . 1 . . . . 179 SER CA . 6643 1 1727 . 1 1 179 179 SER N N 15 115.94 0.10 . 1 . . . . 179 SER N . 6643 1 1728 . 1 1 180 180 HIS H H 1 7.72 0.03 . 1 . . . . 180 HIS H . 6643 1 1729 . 1 1 180 180 HIS HA H 1 3.46 0.03 . 1 . . . . 180 HIS HA . 6643 1 1730 . 1 1 180 180 HIS HB2 H 1 2.93 0.03 . 2 . . . . 180 HIS HB2 . 6643 1 1731 . 1 1 180 180 HIS HB3 H 1 3.25 0.03 . 2 . . . . 180 HIS HB3 . 6643 1 1732 . 1 1 180 180 HIS HD2 H 1 6.69 0.03 . 1 . . . . 180 HIS HD2 . 6643 1 1733 . 1 1 180 180 HIS C C 13 176.97 0.40 . 1 . . . . 180 HIS C . 6643 1 1734 . 1 1 180 180 HIS CA C 13 59.40 0.40 . 1 . . . . 180 HIS CA . 6643 1 1735 . 1 1 180 180 HIS CB C 13 30.44 0.40 . 1 . . . . 180 HIS CB . 6643 1 1736 . 1 1 180 180 HIS N N 15 125.50 0.10 . 1 . . . . 180 HIS N . 6643 1 1737 . 1 1 181 181 LYS H H 1 7.69 0.03 . 1 . . . . 181 LYS H . 6643 1 1738 . 1 1 181 181 LYS HA H 1 3.44 0.03 . 1 . . . . 181 LYS HA . 6643 1 1739 . 1 1 181 181 LYS HB2 H 1 1.43 0.03 . 2 . . . . 181 LYS HB2 . 6643 1 1740 . 1 1 181 181 LYS HB3 H 1 1.88 0.03 . 2 . . . . 181 LYS HB3 . 6643 1 1741 . 1 1 181 181 LYS HG2 H 1 1.28 0.03 . 2 . . . . 181 LYS HG2 . 6643 1 1742 . 1 1 181 181 LYS HG3 H 1 1.55 0.03 . 2 . . . . 181 LYS HG3 . 6643 1 1743 . 1 1 181 181 LYS HD2 H 1 1.72 0.03 . 2 . . . . 181 LYS HD2 . 6643 1 1744 . 1 1 181 181 LYS HE2 H 1 2.94 0.03 . 2 . . . . 181 LYS HE2 . 6643 1 1745 . 1 1 181 181 LYS C C 13 177.10 0.40 . 1 . . . . 181 LYS C . 6643 1 1746 . 1 1 181 181 LYS CA C 13 59.79 0.40 . 1 . . . . 181 LYS CA . 6643 1 1747 . 1 1 181 181 LYS CB C 13 32.14 0.40 . 1 . . . . 181 LYS CB . 6643 1 1748 . 1 1 181 181 LYS CG C 13 25.39 0.40 . 1 . . . . 181 LYS CG . 6643 1 1749 . 1 1 181 181 LYS CD C 13 29.69 0.40 . 1 . . . . 181 LYS CD . 6643 1 1750 . 1 1 181 181 LYS CE C 13 41.86 0.40 . 1 . . . . 181 LYS CE . 6643 1 1751 . 1 1 181 181 LYS N N 15 118.71 0.10 . 1 . . . . 181 LYS N . 6643 1 1752 . 1 1 182 182 ILE H H 1 8.16 0.03 . 1 . . . . 182 ILE H . 6643 1 1753 . 1 1 182 182 ILE HA H 1 3.42 0.03 . 1 . . . . 182 ILE HA . 6643 1 1754 . 1 1 182 182 ILE HB H 1 1.91 0.03 . 1 . . . . 182 ILE HB . 6643 1 1755 . 1 1 182 182 ILE HG12 H 1 1.73 0.03 . 2 . . . . 182 ILE HG12 . 6643 1 1756 . 1 1 182 182 ILE HG13 H 1 1.30 0.03 . 2 . . . . 182 ILE HG13 . 6643 1 1757 . 1 1 182 182 ILE HG21 H 1 0.95 0.03 . 1 . . . . 182 ILE HG2 . 6643 1 1758 . 1 1 182 182 ILE HG22 H 1 0.95 0.03 . 1 . . . . 182 ILE HG2 . 6643 1 1759 . 1 1 182 182 ILE HG23 H 1 0.95 0.03 . 1 . . . . 182 ILE HG2 . 6643 1 1760 . 1 1 182 182 ILE HD11 H 1 0.85 0.03 . 1 . . . . 182 ILE HD1 . 6643 1 1761 . 1 1 182 182 ILE HD12 H 1 0.85 0.03 . 1 . . . . 182 ILE HD1 . 6643 1 1762 . 1 1 182 182 ILE HD13 H 1 0.85 0.03 . 1 . . . . 182 ILE HD1 . 6643 1 1763 . 1 1 182 182 ILE C C 13 176.74 0.40 . 1 . . . . 182 ILE C . 6643 1 1764 . 1 1 182 182 ILE CA C 13 65.25 0.40 . 1 . . . . 182 ILE CA . 6643 1 1765 . 1 1 182 182 ILE CB C 13 37.56 0.40 . 1 . . . . 182 ILE CB . 6643 1 1766 . 1 1 182 182 ILE CG1 C 13 28.86 0.40 . 1 . . . . 182 ILE CG1 . 6643 1 1767 . 1 1 182 182 ILE CG2 C 13 17.89 0.40 . 1 . . . . 182 ILE CG2 . 6643 1 1768 . 1 1 182 182 ILE CD1 C 13 13.06 0.40 . 1 . . . . 182 ILE CD1 . 6643 1 1769 . 1 1 182 182 ILE N N 15 115.73 0.10 . 1 . . . . 182 ILE N . 6643 1 1770 . 1 1 183 183 ASP H H 1 7.38 0.03 . 1 . . . . 183 ASP H . 6643 1 1771 . 1 1 183 183 ASP HA H 1 4.45 0.03 . 1 . . . . 183 ASP HA . 6643 1 1772 . 1 1 183 183 ASP HB2 H 1 2.57 0.03 . 2 . . . . 183 ASP HB2 . 6643 1 1773 . 1 1 183 183 ASP HB3 H 1 2.52 0.03 . 2 . . . . 183 ASP HB3 . 6643 1 1774 . 1 1 183 183 ASP C C 13 177.42 0.40 . 1 . . . . 183 ASP C . 6643 1 1775 . 1 1 183 183 ASP CA C 13 57.79 0.40 . 1 . . . . 183 ASP CA . 6643 1 1776 . 1 1 183 183 ASP CB C 13 42.35 0.40 . 1 . . . . 183 ASP CB . 6643 1 1777 . 1 1 183 183 ASP N N 15 118.43 0.10 . 1 . . . . 183 ASP N . 6643 1 1778 . 1 1 184 184 ASN H H 1 7.85 0.03 . 1 . . . . 184 ASN H . 6643 1 1779 . 1 1 184 184 ASN HA H 1 4.24 0.03 . 1 . . . . 184 ASN HA . 6643 1 1780 . 1 1 184 184 ASN HB2 H 1 2.59 0.03 . 2 . . . . 184 ASN HB2 . 6643 1 1781 . 1 1 184 184 ASN HB3 H 1 2.55 0.03 . 2 . . . . 184 ASN HB3 . 6643 1 1782 . 1 1 184 184 ASN C C 13 178.84 0.40 . 1 . . . . 184 ASN C . 6643 1 1783 . 1 1 184 184 ASN CA C 13 56.35 0.40 . 1 . . . . 184 ASN CA . 6643 1 1784 . 1 1 184 184 ASN CB C 13 38.28 0.40 . 1 . . . . 184 ASN CB . 6643 1 1785 . 1 1 184 184 ASN N N 15 115.90 0.10 . 1 . . . . 184 ASN N . 6643 1 1786 . 1 1 185 185 TYR H H 1 9.08 0.03 . 1 . . . . 185 TYR H . 6643 1 1787 . 1 1 185 185 TYR HA H 1 4.53 0.03 . 1 . . . . 185 TYR HA . 6643 1 1788 . 1 1 185 185 TYR HB2 H 1 2.99 0.03 . 2 . . . . 185 TYR HB2 . 6643 1 1789 . 1 1 185 185 TYR HB3 H 1 3.19 0.03 . 2 . . . . 185 TYR HB3 . 6643 1 1790 . 1 1 185 185 TYR HD1 H 1 6.87 0.03 . 3 . . . . 185 TYR HD1 . 6643 1 1791 . 1 1 185 185 TYR HE1 H 1 6.73 0.03 . 3 . . . . 185 TYR HE1 . 6643 1 1792 . 1 1 185 185 TYR C C 13 178.37 0.40 . 1 . . . . 185 TYR C . 6643 1 1793 . 1 1 185 185 TYR CA C 13 57.38 0.40 . 1 . . . . 185 TYR CA . 6643 1 1794 . 1 1 185 185 TYR CB C 13 37.20 0.40 . 1 . . . . 185 TYR CB . 6643 1 1795 . 1 1 185 185 TYR CD1 C 13 130.87 0.40 . 3 . . . . 185 TYR CD1 . 6643 1 1796 . 1 1 185 185 TYR CE1 C 13 117.77 0.40 . 3 . . . . 185 TYR CE1 . 6643 1 1797 . 1 1 185 185 TYR N N 15 119.45 0.10 . 1 . . . . 185 TYR N . 6643 1 1798 . 1 1 186 186 LEU H H 1 8.92 0.03 . 1 . . . . 186 LEU H . 6643 1 1799 . 1 1 186 186 LEU HA H 1 4.08 0.03 . 1 . . . . 186 LEU HA . 6643 1 1800 . 1 1 186 186 LEU HB2 H 1 1.52 0.03 . 2 . . . . 186 LEU HB2 . 6643 1 1801 . 1 1 186 186 LEU HB3 H 1 2.22 0.03 . 2 . . . . 186 LEU HB3 . 6643 1 1802 . 1 1 186 186 LEU HG H 1 1.89 0.03 . 1 . . . . 186 LEU HG . 6643 1 1803 . 1 1 186 186 LEU HD11 H 1 1.00 0.03 . 2 . . . . 186 LEU HD1 . 6643 1 1804 . 1 1 186 186 LEU HD12 H 1 1.00 0.03 . 2 . . . . 186 LEU HD1 . 6643 1 1805 . 1 1 186 186 LEU HD13 H 1 1.00 0.03 . 2 . . . . 186 LEU HD1 . 6643 1 1806 . 1 1 186 186 LEU HD21 H 1 1.00 0.03 . 2 . . . . 186 LEU HD2 . 6643 1 1807 . 1 1 186 186 LEU HD22 H 1 1.00 0.03 . 2 . . . . 186 LEU HD2 . 6643 1 1808 . 1 1 186 186 LEU HD23 H 1 1.00 0.03 . 2 . . . . 186 LEU HD2 . 6643 1 1809 . 1 1 186 186 LEU C C 13 179.19 0.40 . 1 . . . . 186 LEU C . 6643 1 1810 . 1 1 186 186 LEU CA C 13 58.46 0.40 . 1 . . . . 186 LEU CA . 6643 1 1811 . 1 1 186 186 LEU CB C 13 41.90 0.40 . 1 . . . . 186 LEU CB . 6643 1 1812 . 1 1 186 186 LEU CG C 13 27.92 0.40 . 1 . . . . 186 LEU CG . 6643 1 1813 . 1 1 186 186 LEU CD1 C 13 24.06 0.40 . 2 . . . . 186 LEU CD1 . 6643 1 1814 . 1 1 186 186 LEU CD2 C 13 25.98 0.40 . 2 . . . . 186 LEU CD2 . 6643 1 1815 . 1 1 186 186 LEU N N 15 120.92 0.10 . 1 . . . . 186 LEU N . 6643 1 1816 . 1 1 187 187 LYS H H 1 7.92 0.03 . 1 . . . . 187 LYS H . 6643 1 1817 . 1 1 187 187 LYS HA H 1 3.90 0.03 . 1 . . . . 187 LYS HA . 6643 1 1818 . 1 1 187 187 LYS HB2 H 1 1.90 0.03 . 2 . . . . 187 LYS HB2 . 6643 1 1819 . 1 1 187 187 LYS C C 13 179.85 0.40 . 1 . . . . 187 LYS C . 6643 1 1820 . 1 1 187 187 LYS CA C 13 60.86 0.40 . 1 . . . . 187 LYS CA . 6643 1 1821 . 1 1 187 187 LYS CB C 13 32.38 0.40 . 1 . . . . 187 LYS CB . 6643 1 1822 . 1 1 187 187 LYS N N 15 118.98 0.10 . 1 . . . . 187 LYS N . 6643 1 1823 . 1 1 188 188 LEU H H 1 7.78 0.03 . 1 . . . . 188 LEU H . 6643 1 1824 . 1 1 188 188 LEU HA H 1 4.21 0.03 . 1 . . . . 188 LEU HA . 6643 1 1825 . 1 1 188 188 LEU HB2 H 1 1.75 0.03 . 2 . . . . 188 LEU HB2 . 6643 1 1826 . 1 1 188 188 LEU HB3 H 1 1.94 0.03 . 2 . . . . 188 LEU HB3 . 6643 1 1827 . 1 1 188 188 LEU HG H 1 0.97 0.03 . 1 . . . . 188 LEU HG . 6643 1 1828 . 1 1 188 188 LEU HD11 H 1 0.86 0.03 . 2 . . . . 188 LEU HD1 . 6643 1 1829 . 1 1 188 188 LEU HD12 H 1 0.86 0.03 . 2 . . . . 188 LEU HD1 . 6643 1 1830 . 1 1 188 188 LEU HD13 H 1 0.86 0.03 . 2 . . . . 188 LEU HD1 . 6643 1 1831 . 1 1 188 188 LEU C C 13 179.75 0.40 . 1 . . . . 188 LEU C . 6643 1 1832 . 1 1 188 188 LEU CA C 13 58.02 0.40 . 1 . . . . 188 LEU CA . 6643 1 1833 . 1 1 188 188 LEU CB C 13 41.84 0.40 . 1 . . . . 188 LEU CB . 6643 1 1834 . 1 1 188 188 LEU CG C 13 25.26 0.40 . 1 . . . . 188 LEU CG . 6643 1 1835 . 1 1 188 188 LEU CD1 C 13 24.68 0.40 . 2 . . . . 188 LEU CD1 . 6643 1 1836 . 1 1 188 188 LEU N N 15 121.20 0.10 . 1 . . . . 188 LEU N . 6643 1 1837 . 1 1 189 189 LEU H H 1 8.70 0.03 . 1 . . . . 189 LEU H . 6643 1 1838 . 1 1 189 189 LEU HA H 1 4.08 0.03 . 1 . . . . 189 LEU HA . 6643 1 1839 . 1 1 189 189 LEU HB2 H 1 1.52 0.03 . 2 . . . . 189 LEU HB2 . 6643 1 1840 . 1 1 189 189 LEU HB3 H 1 1.87 0.03 . 2 . . . . 189 LEU HB3 . 6643 1 1841 . 1 1 189 189 LEU HG H 1 1.57 0.03 . 1 . . . . 189 LEU HG . 6643 1 1842 . 1 1 189 189 LEU HD11 H 1 0.87 0.03 . 2 . . . . 189 LEU HD1 . 6643 1 1843 . 1 1 189 189 LEU HD12 H 1 0.87 0.03 . 2 . . . . 189 LEU HD1 . 6643 1 1844 . 1 1 189 189 LEU HD13 H 1 0.87 0.03 . 2 . . . . 189 LEU HD1 . 6643 1 1845 . 1 1 189 189 LEU HD21 H 1 0.69 0.03 . 2 . . . . 189 LEU HD2 . 6643 1 1846 . 1 1 189 189 LEU HD22 H 1 0.69 0.03 . 2 . . . . 189 LEU HD2 . 6643 1 1847 . 1 1 189 189 LEU HD23 H 1 0.69 0.03 . 2 . . . . 189 LEU HD2 . 6643 1 1848 . 1 1 189 189 LEU C C 13 178.00 0.40 . 1 . . . . 189 LEU C . 6643 1 1849 . 1 1 189 189 LEU CA C 13 57.98 0.40 . 1 . . . . 189 LEU CA . 6643 1 1850 . 1 1 189 189 LEU CB C 13 42.19 0.40 . 1 . . . . 189 LEU CB . 6643 1 1851 . 1 1 189 189 LEU CG C 13 27.09 0.40 . 1 . . . . 189 LEU CG . 6643 1 1852 . 1 1 189 189 LEU CD1 C 13 24.18 0.40 . 2 . . . . 189 LEU CD1 . 6643 1 1853 . 1 1 189 189 LEU CD2 C 13 25.19 0.40 . 2 . . . . 189 LEU CD2 . 6643 1 1854 . 1 1 189 189 LEU N N 15 120.99 0.10 . 1 . . . . 189 LEU N . 6643 1 1855 . 1 1 190 190 LYS H H 1 8.61 0.03 . 1 . . . . 190 LYS H . 6643 1 1856 . 1 1 190 190 LYS HA H 1 3.91 0.03 . 1 . . . . 190 LYS HA . 6643 1 1857 . 1 1 190 190 LYS HB2 H 1 1.76 0.03 . 2 . . . . 190 LYS HB2 . 6643 1 1858 . 1 1 190 190 LYS HG2 H 1 1.32 0.03 . 2 . . . . 190 LYS HG2 . 6643 1 1859 . 1 1 190 190 LYS HD2 H 1 1.77 0.03 . 2 . . . . 190 LYS HD2 . 6643 1 1860 . 1 1 190 190 LYS HE2 H 1 3.11 0.03 . 2 . . . . 190 LYS HE2 . 6643 1 1861 . 1 1 190 190 LYS HE3 H 1 2.95 0.03 . 2 . . . . 190 LYS HE3 . 6643 1 1862 . 1 1 190 190 LYS C C 13 178.10 0.40 . 1 . . . . 190 LYS C . 6643 1 1863 . 1 1 190 190 LYS CA C 13 60.19 0.40 . 1 . . . . 190 LYS CA . 6643 1 1864 . 1 1 190 190 LYS CB C 13 32.76 0.40 . 1 . . . . 190 LYS CB . 6643 1 1865 . 1 1 190 190 LYS CG C 13 26.16 0.40 . 1 . . . . 190 LYS CG . 6643 1 1866 . 1 1 190 190 LYS CD C 13 30.18 0.40 . 1 . . . . 190 LYS CD . 6643 1 1867 . 1 1 190 190 LYS CE C 13 41.82 0.40 . 1 . . . . 190 LYS CE . 6643 1 1868 . 1 1 190 190 LYS N N 15 120.43 0.10 . 1 . . . . 190 LYS N . 6643 1 1869 . 1 1 191 191 CYS H H 1 7.71 0.03 . 1 . . . . 191 CYS H . 6643 1 1870 . 1 1 191 191 CYS HA H 1 4.22 0.03 . 1 . . . . 191 CYS HA . 6643 1 1871 . 1 1 191 191 CYS HB2 H 1 3.37 0.03 . 2 . . . . 191 CYS HB2 . 6643 1 1872 . 1 1 191 191 CYS HB3 H 1 3.46 0.03 . 2 . . . . 191 CYS HB3 . 6643 1 1873 . 1 1 191 191 CYS CA C 13 60.20 0.40 . 1 . . . . 191 CYS CA . 6643 1 1874 . 1 1 191 191 CYS CB C 13 41.88 0.40 . 1 . . . . 191 CYS CB . 6643 1 1875 . 1 1 191 191 CYS N N 15 116.68 0.10 . 1 . . . . 191 CYS N . 6643 1 1876 . 1 1 192 192 ARG H H 1 8.08 0.03 . 1 . . . . 192 ARG H . 6643 1 1877 . 1 1 192 192 ARG HA H 1 4.02 0.03 . 1 . . . . 192 ARG HA . 6643 1 1878 . 1 1 192 192 ARG HB2 H 1 1.98 0.03 . 2 . . . . 192 ARG HB2 . 6643 1 1879 . 1 1 192 192 ARG C C 13 177.79 0.40 . 1 . . . . 192 ARG C . 6643 1 1880 . 1 1 192 192 ARG CA C 13 59.60 0.40 . 1 . . . . 192 ARG CA . 6643 1 1881 . 1 1 192 192 ARG CB C 13 31.53 0.40 . 1 . . . . 192 ARG CB . 6643 1 1882 . 1 1 192 192 ARG N N 15 118.81 0.10 . 1 . . . . 192 ARG N . 6643 1 1883 . 1 1 193 193 ILE H H 1 8.31 0.03 . 1 . . . . 193 ILE H . 6643 1 1884 . 1 1 193 193 ILE HA H 1 3.88 0.03 . 1 . . . . 193 ILE HA . 6643 1 1885 . 1 1 193 193 ILE HB H 1 1.48 0.03 . 1 . . . . 193 ILE HB . 6643 1 1886 . 1 1 193 193 ILE HG12 H 1 1.62 0.03 . 2 . . . . 193 ILE HG12 . 6643 1 1887 . 1 1 193 193 ILE HG21 H 1 0.84 0.03 . 1 . . . . 193 ILE HG2 . 6643 1 1888 . 1 1 193 193 ILE HG22 H 1 0.84 0.03 . 1 . . . . 193 ILE HG2 . 6643 1 1889 . 1 1 193 193 ILE HG23 H 1 0.84 0.03 . 1 . . . . 193 ILE HG2 . 6643 1 1890 . 1 1 193 193 ILE HD11 H 1 0.85 0.03 . 1 . . . . 193 ILE HD1 . 6643 1 1891 . 1 1 193 193 ILE HD12 H 1 0.85 0.03 . 1 . . . . 193 ILE HD1 . 6643 1 1892 . 1 1 193 193 ILE HD13 H 1 0.85 0.03 . 1 . . . . 193 ILE HD1 . 6643 1 1893 . 1 1 193 193 ILE C C 13 176.79 0.40 . 1 . . . . 193 ILE C . 6643 1 1894 . 1 1 193 193 ILE CA C 13 63.90 0.40 . 1 . . . . 193 ILE CA . 6643 1 1895 . 1 1 193 193 ILE CB C 13 38.41 0.40 . 1 . . . . 193 ILE CB . 6643 1 1896 . 1 1 193 193 ILE CG1 C 13 29.08 0.40 . 1 . . . . 193 ILE CG1 . 6643 1 1897 . 1 1 193 193 ILE CG2 C 13 17.34 0.40 . 1 . . . . 193 ILE CG2 . 6643 1 1898 . 1 1 193 193 ILE CD1 C 13 13.56 0.40 . 1 . . . . 193 ILE CD1 . 6643 1 1899 . 1 1 193 193 ILE N N 15 116.32 0.10 . 1 . . . . 193 ILE N . 6643 1 1900 . 1 1 194 194 ILE H H 1 7.86 0.03 . 1 . . . . 194 ILE H . 6643 1 1901 . 1 1 194 194 ILE HA H 1 4.00 0.03 . 1 . . . . 194 ILE HA . 6643 1 1902 . 1 1 194 194 ILE HB H 1 1.80 0.03 . 1 . . . . 194 ILE HB . 6643 1 1903 . 1 1 194 194 ILE HG12 H 1 1.67 0.03 . 2 . . . . 194 ILE HG12 . 6643 1 1904 . 1 1 194 194 ILE HG13 H 1 1.05 0.03 . 2 . . . . 194 ILE HG13 . 6643 1 1905 . 1 1 194 194 ILE HG21 H 1 0.42 0.03 . 1 . . . . 194 ILE HG2 . 6643 1 1906 . 1 1 194 194 ILE HG22 H 1 0.42 0.03 . 1 . . . . 194 ILE HG2 . 6643 1 1907 . 1 1 194 194 ILE HG23 H 1 0.42 0.03 . 1 . . . . 194 ILE HG2 . 6643 1 1908 . 1 1 194 194 ILE HD11 H 1 0.63 0.03 . 1 . . . . 194 ILE HD1 . 6643 1 1909 . 1 1 194 194 ILE HD12 H 1 0.63 0.03 . 1 . . . . 194 ILE HD1 . 6643 1 1910 . 1 1 194 194 ILE HD13 H 1 0.63 0.03 . 1 . . . . 194 ILE HD1 . 6643 1 1911 . 1 1 194 194 ILE C C 13 176.91 0.40 . 1 . . . . 194 ILE C . 6643 1 1912 . 1 1 194 194 ILE CA C 13 60.36 0.40 . 1 . . . . 194 ILE CA . 6643 1 1913 . 1 1 194 194 ILE CB C 13 35.94 0.40 . 1 . . . . 194 ILE CB . 6643 1 1914 . 1 1 194 194 ILE CG1 C 13 27.32 0.40 . 1 . . . . 194 ILE CG1 . 6643 1 1915 . 1 1 194 194 ILE CG2 C 13 17.07 0.40 . 1 . . . . 194 ILE CG2 . 6643 1 1916 . 1 1 194 194 ILE CD1 C 13 10.09 0.40 . 1 . . . . 194 ILE CD1 . 6643 1 1917 . 1 1 194 194 ILE N N 15 117.06 0.10 . 1 . . . . 194 ILE N . 6643 1 1918 . 1 1 196 196 ASN HA H 1 4.55 0.03 . 1 . . . . 196 ASN HA . 6643 1 1919 . 1 1 196 196 ASN HB2 H 1 2.69 0.03 . 2 . . . . 196 ASN HB2 . 6643 1 1920 . 1 1 196 196 ASN HB3 H 1 3.09 0.03 . 2 . . . . 196 ASN HB3 . 6643 1 1921 . 1 1 196 196 ASN CA C 13 54.44 0.40 . 1 . . . . 196 ASN CA . 6643 1 1922 . 1 1 196 196 ASN CB C 13 37.72 0.40 . 1 . . . . 196 ASN CB . 6643 1 1923 . 1 1 197 197 ASN HA H 1 4.49 0.03 . 1 . . . . 197 ASN HA . 6643 1 1924 . 1 1 197 197 ASN HB2 H 1 2.93 0.03 . 2 . . . . 197 ASN HB2 . 6643 1 1925 . 1 1 197 197 ASN HB3 H 1 3.03 0.03 . 2 . . . . 197 ASN HB3 . 6643 1 1926 . 1 1 197 197 ASN CA C 13 54.15 0.40 . 1 . . . . 197 ASN CA . 6643 1 1927 . 1 1 197 197 ASN CB C 13 38.63 0.40 . 1 . . . . 197 ASN CB . 6643 1 1928 . 1 1 198 198 ASN HA H 1 4.91 0.03 . 1 . . . . 198 ASN HA . 6643 1 1929 . 1 1 198 198 ASN HB2 H 1 2.78 0.03 . 2 . . . . 198 ASN HB2 . 6643 1 1930 . 1 1 198 198 ASN HB3 H 1 2.95 0.03 . 2 . . . . 198 ASN HB3 . 6643 1 1931 . 1 1 198 198 ASN C C 13 173.85 0.40 . 1 . . . . 198 ASN C . 6643 1 1932 . 1 1 198 198 ASN CA C 13 52.96 0.40 . 1 . . . . 198 ASN CA . 6643 1 1933 . 1 1 198 198 ASN CB C 13 38.13 0.40 . 1 . . . . 198 ASN CB . 6643 1 1934 . 1 1 199 199 CYS H H 1 7.75 0.03 . 1 . . . . 199 CYS H . 6643 1 1935 . 1 1 199 199 CYS HA H 1 4.30 0.03 . 1 . . . . 199 CYS HA . 6643 1 1936 . 1 1 199 199 CYS HB2 H 1 3.26 0.03 . 2 . . . . 199 CYS HB2 . 6643 1 1937 . 1 1 199 199 CYS HB3 H 1 3.20 0.03 . 2 . . . . 199 CYS HB3 . 6643 1 1938 . 1 1 199 199 CYS C C 13 178.44 0.40 . 1 . . . . 199 CYS C . 6643 1 1939 . 1 1 199 199 CYS CA C 13 56.55 0.40 . 1 . . . . 199 CYS CA . 6643 1 1940 . 1 1 199 199 CYS CB C 13 45.10 0.40 . 1 . . . . 199 CYS CB . 6643 1 1941 . 1 1 199 199 CYS N N 15 123.05 0.10 . 1 . . . . 199 CYS N . 6643 1 stop_ save_