data_10016 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10016 _Entry.Title ; Backbone 1H, 13C and 15N Chemical Shift Assignments for the Nucleotide-Free Form of Human ABCB6 C-Terminal Domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-12-08 _Entry.Accession_date 2005-12-08 _Entry.Last_release_date . _Entry.Original_release_date . _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 Kaori Kurashima-Ito . . . 10016 2 Teppei Ikeya . . . 10016 3 Hiroshi Senbongi . . . 10016 4 Hidehito Tochio . . . 10016 5 Tsutomu Mikawa . . . 10016 6 Takehiko Shibata . . . 10016 7 Yutaka Ito . . . 10016 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Cellular and Molecular Biology Laboratory, RIKEN' . 10016 2 . 'Molecular and Cellular Physiology Laboratory, Yokohama City University' . 10016 3 . 'Molecular Biophysics Laboratory, Yokohama City University' . 10016 4 . 'CREST/Japan Science and Technology Agency' . 10016 5 . 'National Institute of Advanced Industrial Science and Technology (AIST)' . 10016 6 . 'Department of Chemistry, Tokyo Metropolitan University' . 10016 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 10016 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 1016 10016 '15N chemical shifts' 368 10016 '1H chemical shifts' 368 10016 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 2 . . 2008-07-01 2005-12-08 update BMRB 'complete entry citation' 10016 1 . . 2006-06-27 2005-12-08 original author 'original release' 10016 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 10017 'ADP-BOUND Form of Human ABCB6 C-Terminal Domain' 10016 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10016 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16791740 _Citation.Full_citation . _Citation.Title ; Heteronuclear multidimensional NMR and homology modelling studies of the C-terminal nucleotide-binding domain of the human mitochondrial ABC transporter ABCB6 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 35 _Citation.Journal_issue 1 _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 53 _Citation.Page_last 71 _Citation.Year 2006 _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 Kaori Kurashima-Ito . . . 10016 1 2 Teppei Ikeya . . . 10016 1 3 Hiroshi Senbongi . . . 10016 1 4 Hidehito Tochio . . . 10016 1 5 Tsutomu Mikawa . . . 10016 1 6 Takehiko Shibata . . . 10016 1 7 Yutaka Ito . . . 10016 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'ABC transporter' 10016 1 'Fe homeostasis' 10016 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10016 _Assembly.ID 1 _Assembly.Name ABCB6-C _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details ; the C-terminal nucleotide-binding domain of the human mitochondrial ABC transporter ABCB6 ; _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10016 1 stop_ 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 ABCB6-C 1 $ABCB6-C . . yes native no no . . . 10016 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_ABCB6-C _Entity.Sf_category entity _Entity.Sf_framecode ABCB6-C _Entity.Entry_ID 10016 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name ; the C-terminal nucleotide-binding domain of the human mitochondrial ABC transporter ABCB6 ; _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 ; FIDMENMFDLLKEETEVKDL PGAGPLRFQKGRIEFENVHF SYADGRETLQDVSFTVMPGQ TLALVGPSGAGKSTILRLLF RFYDISSGCIRIDGQDISQV TQASLRSHIGVVPQDTVLFN DTIADNIRYGRVTAGNDEVE AAAQAAGIHDAIMAFPEGYR TQVGERGLKLSGGEKQRVAI ARTILKAPGIILLDEATSAL DTSNERAIQASLAKVCANRT TIVVAHRLSTVVNADQILVI KDGCIVERGRHEALLSRGGV YADMWQLQQGQEETSEDTKP QTMER ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'residues from Phe558 to the C-terminal Arg842' _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 285 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _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 2015-11-26 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 10017 . "the C-terminal nucleotide-binding domain of the human mitochondrial ABC" . . . . . 100.00 300 100.00 100.00 0.00e+00 . . . . 10016 1 2 no PDB 3NH6 . "Nucleotide Binding Domain Of Human Abcb6 (Apo Structure)" . . . . . 100.00 306 100.00 100.00 0.00e+00 . . . . 10016 1 3 no PDB 3NH9 . "Nucleotide Binding Domain Of Human Abcb6 (Atp Bound Structure)" . . . . . 100.00 306 100.00 100.00 0.00e+00 . . . . 10016 1 4 no PDB 3NHA . "Nucleotide Binding Domain Of Human Abcb6 (Adp Mg Bound Structure)" . . . . . 100.00 306 100.00 100.00 0.00e+00 . . . . 10016 1 5 no PDB 3NHB . "Nucleotide Binding Domain Of Human Abcb6 (Adp Bound Structure)" . . . . . 100.00 306 100.00 100.00 0.00e+00 . . . . 10016 1 6 no DBJ BAA96733 . "mitochondrial ABC transporter 3 [Homo sapiens]" . . . . . 100.00 842 100.00 100.00 0.00e+00 . . . . 10016 1 7 no DBJ BAB71347 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 766 100.00 100.00 0.00e+00 . . . . 10016 1 8 no DBJ BAD18782 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 571 99.30 99.30 0.00e+00 . . . . 10016 1 9 no DBJ BAK62401 . "ATP-binding cassette sub-family B member 6, mitochondrial precursor [Pan troglodytes]" . . . . . 100.35 474 99.30 99.30 0.00e+00 . . . . 10016 1 10 no DBJ BAK62910 . "ATP-binding cassette sub-family B member 6, mitochondrial precursor [Pan troglodytes]" . . . . . 100.35 437 99.30 99.30 0.00e+00 . . . . 10016 1 11 no EMBL CAB95766 . "ABC transporter umat [Homo sapiens]" . . . . . 100.00 842 100.00 100.00 0.00e+00 . . . . 10016 1 12 no GB AAC28653 . "ABC transporter [Homo sapiens]" . . . . . 100.00 511 100.00 100.00 0.00e+00 . . . . 10016 1 13 no GB AAF75107 . "MT-ABC transporter [Homo sapiens]" . . . . . 100.00 842 100.00 100.00 0.00e+00 . . . . 10016 1 14 no GB AAG33617 . "ATP-binding cassette half-transporter [Homo sapiens]" . . . . . 100.00 896 100.00 100.00 0.00e+00 . . . . 10016 1 15 no GB AAH00559 . "ATP-binding cassette, sub-family B (MDR/TAP), member 6 [Homo sapiens]" . . . . . 100.00 842 100.00 100.00 0.00e+00 . . . . 10016 1 16 no GB AAH43423 . "ABCB6 protein [Homo sapiens]" . . . . . 100.00 301 100.00 100.00 0.00e+00 . . . . 10016 1 17 no REF NP_005680 . "ATP-binding cassette sub-family B member 6, mitochondrial [Homo sapiens]" . . . . . 100.00 842 100.00 100.00 0.00e+00 . . . . 10016 1 18 no REF XP_001161097 . "PREDICTED: ATP-binding cassette sub-family B member 6, mitochondrial isoform X1 [Pan troglodytes]" . . . . . 100.35 843 99.30 99.30 0.00e+00 . . . . 10016 1 19 no REF XP_002799099 . "PREDICTED: ATP-binding cassette sub-family B member 6, mitochondrial-like isoform 1 [Macaca mulatta]" . . . . . 100.35 843 98.25 98.95 0.00e+00 . . . . 10016 1 20 no REF XP_002799100 . "PREDICTED: ATP-binding cassette sub-family B member 6, mitochondrial-like isoform 2 [Macaca mulatta]" . . . . . 100.35 767 98.25 98.95 0.00e+00 . . . . 10016 1 21 no REF XP_002812920 . "PREDICTED: ATP-binding cassette sub-family B member 6, mitochondrial isoform X1 [Pongo abelii]" . . . . . 100.35 843 97.20 98.25 0.00e+00 . . . . 10016 1 22 no SP Q9NP58 . "RecName: Full=ATP-binding cassette sub-family B member 6, mitochondrial; AltName: Full=Mitochondrial ABC transporter 3; Short=M" . . . . . 100.00 842 100.00 100.00 0.00e+00 . . . . 10016 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'iron ion homeostasis' 10016 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ABC transporter' . 10016 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID 'ABC transporter' 10016 1 'nucleotide binding domain' 10016 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 1 558 PHE . 10016 1 2 559 ILE . 10016 1 3 560 ASP . 10016 1 4 561 MET . 10016 1 5 562 GLU . 10016 1 6 563 ASN . 10016 1 7 564 MET . 10016 1 8 565 PHE . 10016 1 9 566 ASP . 10016 1 10 567 LEU . 10016 1 11 568 LEU . 10016 1 12 569 LYS . 10016 1 13 570 GLU . 10016 1 14 571 GLU . 10016 1 15 572 THR . 10016 1 16 573 GLU . 10016 1 17 574 VAL . 10016 1 18 575 LYS . 10016 1 19 576 ASP . 10016 1 20 577 LEU . 10016 1 21 578 PRO . 10016 1 22 579 GLY . 10016 1 23 580 ALA . 10016 1 24 581 GLY . 10016 1 25 582 PRO . 10016 1 26 583 LEU . 10016 1 27 584 ARG . 10016 1 28 585 PHE . 10016 1 29 586 GLN . 10016 1 30 587 LYS . 10016 1 31 588 GLY . 10016 1 32 589 ARG . 10016 1 33 590 ILE . 10016 1 34 591 GLU . 10016 1 35 592 PHE . 10016 1 36 593 GLU . 10016 1 37 594 ASN . 10016 1 38 595 VAL . 10016 1 39 596 HIS . 10016 1 40 597 PHE . 10016 1 41 598 SER . 10016 1 42 599 TYR . 10016 1 43 600 ALA . 10016 1 44 601 ASP . 10016 1 45 602 GLY . 10016 1 46 603 ARG . 10016 1 47 604 GLU . 10016 1 48 605 THR . 10016 1 49 606 LEU . 10016 1 50 607 GLN . 10016 1 51 608 ASP . 10016 1 52 609 VAL . 10016 1 53 610 SER . 10016 1 54 611 PHE . 10016 1 55 612 THR . 10016 1 56 613 VAL . 10016 1 57 614 MET . 10016 1 58 615 PRO . 10016 1 59 616 GLY . 10016 1 60 617 GLN . 10016 1 61 618 THR . 10016 1 62 619 LEU . 10016 1 63 620 ALA . 10016 1 64 621 LEU . 10016 1 65 622 VAL . 10016 1 66 623 GLY . 10016 1 67 624 PRO . 10016 1 68 625 SER . 10016 1 69 626 GLY . 10016 1 70 627 ALA . 10016 1 71 628 GLY . 10016 1 72 629 LYS . 10016 1 73 630 SER . 10016 1 74 631 THR . 10016 1 75 632 ILE . 10016 1 76 633 LEU . 10016 1 77 634 ARG . 10016 1 78 635 LEU . 10016 1 79 636 LEU . 10016 1 80 637 PHE . 10016 1 81 638 ARG . 10016 1 82 639 PHE . 10016 1 83 640 TYR . 10016 1 84 641 ASP . 10016 1 85 642 ILE . 10016 1 86 643 SER . 10016 1 87 644 SER . 10016 1 88 645 GLY . 10016 1 89 646 CYS . 10016 1 90 647 ILE . 10016 1 91 648 ARG . 10016 1 92 649 ILE . 10016 1 93 650 ASP . 10016 1 94 651 GLY . 10016 1 95 652 GLN . 10016 1 96 653 ASP . 10016 1 97 654 ILE . 10016 1 98 655 SER . 10016 1 99 656 GLN . 10016 1 100 657 VAL . 10016 1 101 658 THR . 10016 1 102 659 GLN . 10016 1 103 660 ALA . 10016 1 104 661 SER . 10016 1 105 662 LEU . 10016 1 106 663 ARG . 10016 1 107 664 SER . 10016 1 108 665 HIS . 10016 1 109 666 ILE . 10016 1 110 667 GLY . 10016 1 111 668 VAL . 10016 1 112 669 VAL . 10016 1 113 670 PRO . 10016 1 114 671 GLN . 10016 1 115 672 ASP . 10016 1 116 673 THR . 10016 1 117 674 VAL . 10016 1 118 675 LEU . 10016 1 119 676 PHE . 10016 1 120 677 ASN . 10016 1 121 678 ASP . 10016 1 122 679 THR . 10016 1 123 680 ILE . 10016 1 124 681 ALA . 10016 1 125 682 ASP . 10016 1 126 683 ASN . 10016 1 127 684 ILE . 10016 1 128 685 ARG . 10016 1 129 686 TYR . 10016 1 130 687 GLY . 10016 1 131 688 ARG . 10016 1 132 689 VAL . 10016 1 133 690 THR . 10016 1 134 691 ALA . 10016 1 135 692 GLY . 10016 1 136 693 ASN . 10016 1 137 694 ASP . 10016 1 138 695 GLU . 10016 1 139 696 VAL . 10016 1 140 697 GLU . 10016 1 141 698 ALA . 10016 1 142 699 ALA . 10016 1 143 700 ALA . 10016 1 144 701 GLN . 10016 1 145 702 ALA . 10016 1 146 703 ALA . 10016 1 147 704 GLY . 10016 1 148 705 ILE . 10016 1 149 706 HIS . 10016 1 150 707 ASP . 10016 1 151 708 ALA . 10016 1 152 709 ILE . 10016 1 153 710 MET . 10016 1 154 711 ALA . 10016 1 155 712 PHE . 10016 1 156 713 PRO . 10016 1 157 714 GLU . 10016 1 158 715 GLY . 10016 1 159 716 TYR . 10016 1 160 717 ARG . 10016 1 161 718 THR . 10016 1 162 719 GLN . 10016 1 163 720 VAL . 10016 1 164 721 GLY . 10016 1 165 722 GLU . 10016 1 166 723 ARG . 10016 1 167 724 GLY . 10016 1 168 725 LEU . 10016 1 169 726 LYS . 10016 1 170 727 LEU . 10016 1 171 728 SER . 10016 1 172 729 GLY . 10016 1 173 730 GLY . 10016 1 174 731 GLU . 10016 1 175 732 LYS . 10016 1 176 733 GLN . 10016 1 177 734 ARG . 10016 1 178 735 VAL . 10016 1 179 736 ALA . 10016 1 180 737 ILE . 10016 1 181 738 ALA . 10016 1 182 739 ARG . 10016 1 183 740 THR . 10016 1 184 741 ILE . 10016 1 185 742 LEU . 10016 1 186 743 LYS . 10016 1 187 744 ALA . 10016 1 188 745 PRO . 10016 1 189 746 GLY . 10016 1 190 747 ILE . 10016 1 191 748 ILE . 10016 1 192 749 LEU . 10016 1 193 750 LEU . 10016 1 194 751 ASP . 10016 1 195 752 GLU . 10016 1 196 753 ALA . 10016 1 197 754 THR . 10016 1 198 755 SER . 10016 1 199 756 ALA . 10016 1 200 757 LEU . 10016 1 201 758 ASP . 10016 1 202 759 THR . 10016 1 203 760 SER . 10016 1 204 761 ASN . 10016 1 205 762 GLU . 10016 1 206 763 ARG . 10016 1 207 764 ALA . 10016 1 208 765 ILE . 10016 1 209 766 GLN . 10016 1 210 767 ALA . 10016 1 211 768 SER . 10016 1 212 769 LEU . 10016 1 213 770 ALA . 10016 1 214 771 LYS . 10016 1 215 772 VAL . 10016 1 216 773 CYS . 10016 1 217 774 ALA . 10016 1 218 775 ASN . 10016 1 219 776 ARG . 10016 1 220 777 THR . 10016 1 221 778 THR . 10016 1 222 779 ILE . 10016 1 223 780 VAL . 10016 1 224 781 VAL . 10016 1 225 782 ALA . 10016 1 226 783 HIS . 10016 1 227 784 ARG . 10016 1 228 785 LEU . 10016 1 229 786 SER . 10016 1 230 787 THR . 10016 1 231 788 VAL . 10016 1 232 789 VAL . 10016 1 233 790 ASN . 10016 1 234 791 ALA . 10016 1 235 792 ASP . 10016 1 236 793 GLN . 10016 1 237 794 ILE . 10016 1 238 795 LEU . 10016 1 239 796 VAL . 10016 1 240 797 ILE . 10016 1 241 798 LYS . 10016 1 242 799 ASP . 10016 1 243 800 GLY . 10016 1 244 801 CYS . 10016 1 245 802 ILE . 10016 1 246 803 VAL . 10016 1 247 804 GLU . 10016 1 248 805 ARG . 10016 1 249 806 GLY . 10016 1 250 807 ARG . 10016 1 251 808 HIS . 10016 1 252 809 GLU . 10016 1 253 810 ALA . 10016 1 254 811 LEU . 10016 1 255 812 LEU . 10016 1 256 813 SER . 10016 1 257 814 ARG . 10016 1 258 815 GLY . 10016 1 259 816 GLY . 10016 1 260 817 VAL . 10016 1 261 818 TYR . 10016 1 262 819 ALA . 10016 1 263 820 ASP . 10016 1 264 821 MET . 10016 1 265 822 TRP . 10016 1 266 823 GLN . 10016 1 267 824 LEU . 10016 1 268 825 GLN . 10016 1 269 826 GLN . 10016 1 270 827 GLY . 10016 1 271 828 GLN . 10016 1 272 829 GLU . 10016 1 273 830 GLU . 10016 1 274 831 THR . 10016 1 275 832 SER . 10016 1 276 833 GLU . 10016 1 277 834 ASP . 10016 1 278 835 THR . 10016 1 279 836 LYS . 10016 1 280 837 PRO . 10016 1 281 838 GLN . 10016 1 282 839 THR . 10016 1 283 840 MET . 10016 1 284 841 GLU . 10016 1 285 842 ARG . 10016 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 . PHE 1 1 10016 1 . ILE 2 2 10016 1 . ASP 3 3 10016 1 . MET 4 4 10016 1 . GLU 5 5 10016 1 . ASN 6 6 10016 1 . MET 7 7 10016 1 . PHE 8 8 10016 1 . ASP 9 9 10016 1 . LEU 10 10 10016 1 . LEU 11 11 10016 1 . LYS 12 12 10016 1 . GLU 13 13 10016 1 . GLU 14 14 10016 1 . THR 15 15 10016 1 . GLU 16 16 10016 1 . VAL 17 17 10016 1 . LYS 18 18 10016 1 . ASP 19 19 10016 1 . LEU 20 20 10016 1 . PRO 21 21 10016 1 . GLY 22 22 10016 1 . ALA 23 23 10016 1 . GLY 24 24 10016 1 . PRO 25 25 10016 1 . LEU 26 26 10016 1 . ARG 27 27 10016 1 . PHE 28 28 10016 1 . GLN 29 29 10016 1 . LYS 30 30 10016 1 . GLY 31 31 10016 1 . ARG 32 32 10016 1 . ILE 33 33 10016 1 . GLU 34 34 10016 1 . PHE 35 35 10016 1 . GLU 36 36 10016 1 . ASN 37 37 10016 1 . VAL 38 38 10016 1 . HIS 39 39 10016 1 . PHE 40 40 10016 1 . SER 41 41 10016 1 . TYR 42 42 10016 1 . ALA 43 43 10016 1 . ASP 44 44 10016 1 . GLY 45 45 10016 1 . ARG 46 46 10016 1 . GLU 47 47 10016 1 . THR 48 48 10016 1 . LEU 49 49 10016 1 . GLN 50 50 10016 1 . ASP 51 51 10016 1 . VAL 52 52 10016 1 . SER 53 53 10016 1 . PHE 54 54 10016 1 . THR 55 55 10016 1 . VAL 56 56 10016 1 . MET 57 57 10016 1 . PRO 58 58 10016 1 . GLY 59 59 10016 1 . GLN 60 60 10016 1 . THR 61 61 10016 1 . LEU 62 62 10016 1 . ALA 63 63 10016 1 . LEU 64 64 10016 1 . VAL 65 65 10016 1 . GLY 66 66 10016 1 . PRO 67 67 10016 1 . SER 68 68 10016 1 . GLY 69 69 10016 1 . ALA 70 70 10016 1 . GLY 71 71 10016 1 . LYS 72 72 10016 1 . SER 73 73 10016 1 . THR 74 74 10016 1 . ILE 75 75 10016 1 . LEU 76 76 10016 1 . ARG 77 77 10016 1 . LEU 78 78 10016 1 . LEU 79 79 10016 1 . PHE 80 80 10016 1 . ARG 81 81 10016 1 . PHE 82 82 10016 1 . TYR 83 83 10016 1 . ASP 84 84 10016 1 . ILE 85 85 10016 1 . SER 86 86 10016 1 . SER 87 87 10016 1 . GLY 88 88 10016 1 . CYS 89 89 10016 1 . ILE 90 90 10016 1 . ARG 91 91 10016 1 . ILE 92 92 10016 1 . ASP 93 93 10016 1 . GLY 94 94 10016 1 . GLN 95 95 10016 1 . ASP 96 96 10016 1 . ILE 97 97 10016 1 . SER 98 98 10016 1 . GLN 99 99 10016 1 . VAL 100 100 10016 1 . THR 101 101 10016 1 . GLN 102 102 10016 1 . ALA 103 103 10016 1 . SER 104 104 10016 1 . LEU 105 105 10016 1 . ARG 106 106 10016 1 . SER 107 107 10016 1 . HIS 108 108 10016 1 . ILE 109 109 10016 1 . GLY 110 110 10016 1 . VAL 111 111 10016 1 . VAL 112 112 10016 1 . PRO 113 113 10016 1 . GLN 114 114 10016 1 . ASP 115 115 10016 1 . THR 116 116 10016 1 . VAL 117 117 10016 1 . LEU 118 118 10016 1 . PHE 119 119 10016 1 . ASN 120 120 10016 1 . ASP 121 121 10016 1 . THR 122 122 10016 1 . ILE 123 123 10016 1 . ALA 124 124 10016 1 . ASP 125 125 10016 1 . ASN 126 126 10016 1 . ILE 127 127 10016 1 . ARG 128 128 10016 1 . TYR 129 129 10016 1 . GLY 130 130 10016 1 . ARG 131 131 10016 1 . VAL 132 132 10016 1 . THR 133 133 10016 1 . ALA 134 134 10016 1 . GLY 135 135 10016 1 . ASN 136 136 10016 1 . ASP 137 137 10016 1 . GLU 138 138 10016 1 . VAL 139 139 10016 1 . GLU 140 140 10016 1 . ALA 141 141 10016 1 . ALA 142 142 10016 1 . ALA 143 143 10016 1 . GLN 144 144 10016 1 . ALA 145 145 10016 1 . ALA 146 146 10016 1 . GLY 147 147 10016 1 . ILE 148 148 10016 1 . HIS 149 149 10016 1 . ASP 150 150 10016 1 . ALA 151 151 10016 1 . ILE 152 152 10016 1 . MET 153 153 10016 1 . ALA 154 154 10016 1 . PHE 155 155 10016 1 . PRO 156 156 10016 1 . GLU 157 157 10016 1 . GLY 158 158 10016 1 . TYR 159 159 10016 1 . ARG 160 160 10016 1 . THR 161 161 10016 1 . GLN 162 162 10016 1 . VAL 163 163 10016 1 . GLY 164 164 10016 1 . GLU 165 165 10016 1 . ARG 166 166 10016 1 . GLY 167 167 10016 1 . LEU 168 168 10016 1 . LYS 169 169 10016 1 . LEU 170 170 10016 1 . SER 171 171 10016 1 . GLY 172 172 10016 1 . GLY 173 173 10016 1 . GLU 174 174 10016 1 . LYS 175 175 10016 1 . GLN 176 176 10016 1 . ARG 177 177 10016 1 . VAL 178 178 10016 1 . ALA 179 179 10016 1 . ILE 180 180 10016 1 . ALA 181 181 10016 1 . ARG 182 182 10016 1 . THR 183 183 10016 1 . ILE 184 184 10016 1 . LEU 185 185 10016 1 . LYS 186 186 10016 1 . ALA 187 187 10016 1 . PRO 188 188 10016 1 . GLY 189 189 10016 1 . ILE 190 190 10016 1 . ILE 191 191 10016 1 . LEU 192 192 10016 1 . LEU 193 193 10016 1 . ASP 194 194 10016 1 . GLU 195 195 10016 1 . ALA 196 196 10016 1 . THR 197 197 10016 1 . SER 198 198 10016 1 . ALA 199 199 10016 1 . LEU 200 200 10016 1 . ASP 201 201 10016 1 . THR 202 202 10016 1 . SER 203 203 10016 1 . ASN 204 204 10016 1 . GLU 205 205 10016 1 . ARG 206 206 10016 1 . ALA 207 207 10016 1 . ILE 208 208 10016 1 . GLN 209 209 10016 1 . ALA 210 210 10016 1 . SER 211 211 10016 1 . LEU 212 212 10016 1 . ALA 213 213 10016 1 . LYS 214 214 10016 1 . VAL 215 215 10016 1 . CYS 216 216 10016 1 . ALA 217 217 10016 1 . ASN 218 218 10016 1 . ARG 219 219 10016 1 . THR 220 220 10016 1 . THR 221 221 10016 1 . ILE 222 222 10016 1 . VAL 223 223 10016 1 . VAL 224 224 10016 1 . ALA 225 225 10016 1 . HIS 226 226 10016 1 . ARG 227 227 10016 1 . LEU 228 228 10016 1 . SER 229 229 10016 1 . THR 230 230 10016 1 . VAL 231 231 10016 1 . VAL 232 232 10016 1 . ASN 233 233 10016 1 . ALA 234 234 10016 1 . ASP 235 235 10016 1 . GLN 236 236 10016 1 . ILE 237 237 10016 1 . LEU 238 238 10016 1 . VAL 239 239 10016 1 . ILE 240 240 10016 1 . LYS 241 241 10016 1 . ASP 242 242 10016 1 . GLY 243 243 10016 1 . CYS 244 244 10016 1 . ILE 245 245 10016 1 . VAL 246 246 10016 1 . GLU 247 247 10016 1 . ARG 248 248 10016 1 . GLY 249 249 10016 1 . ARG 250 250 10016 1 . HIS 251 251 10016 1 . GLU 252 252 10016 1 . ALA 253 253 10016 1 . LEU 254 254 10016 1 . LEU 255 255 10016 1 . SER 256 256 10016 1 . ARG 257 257 10016 1 . GLY 258 258 10016 1 . GLY 259 259 10016 1 . VAL 260 260 10016 1 . TYR 261 261 10016 1 . ALA 262 262 10016 1 . ASP 263 263 10016 1 . MET 264 264 10016 1 . TRP 265 265 10016 1 . GLN 266 266 10016 1 . LEU 267 267 10016 1 . GLN 268 268 10016 1 . GLN 269 269 10016 1 . GLY 270 270 10016 1 . GLN 271 271 10016 1 . GLU 272 272 10016 1 . GLU 273 273 10016 1 . THR 274 274 10016 1 . SER 275 275 10016 1 . GLU 276 276 10016 1 . ASP 277 277 10016 1 . THR 278 278 10016 1 . LYS 279 279 10016 1 . PRO 280 280 10016 1 . GLN 281 281 10016 1 . THR 282 282 10016 1 . MET 283 283 10016 1 . GLU 284 284 10016 1 . ARG 285 285 10016 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 10016 _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 $ABCB6-C . 9606 . no . human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . no . . . . . . . . 10016 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 10016 _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 $ABCB6-C . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10016 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10016 _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 ABCB6-C in the nucleotide-free form' '[U-2H; U-13C; U-15N]' . . 1 $ABCB6-C . protein 0.2 . . mM . . . . 10016 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10016 _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 8.5 0.1 pH 10016 1 temperature 298 0.1 K 10016 1 stop_ save_ save_condition_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_2 _Sample_condition_list.Entry_ID 10016 _Sample_condition_list.ID 2 _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 7.5 0.1 pH 10016 2 temperature 278 0.1 K 10016 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10016 _Software.ID 1 _Software.Name XWIN-NMR _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10016 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10016 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10016 _Software.ID 2 _Software.Name AZARA _Software.Version 2.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Wayne Boucher & Dept. Biochemistry, Univ. Cambridge' . . 10016 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10016 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10016 _Software.ID 3 _Software.Name ANSIG-for-OpenGL _Software.Version 1.0.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Per Kraulis' . . 10016 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID assignment 10016 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 10016 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 10016 _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 '1H-15N TROSY-HSQC' no . . . . . . . . . . 1 $sample_1 . . . . . . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10016 1 2 TROSY-HNCA no . . . . . . . . . . 1 $sample_1 . . . . . . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10016 1 3 TROSY-HN(CO)CA no . . . . . . . . . . 1 $sample_1 . . . . . . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10016 1 4 TROSY-HN(CA)CB no . . . . . . . . . . 1 $sample_1 . . . . . . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10016 1 5 TROSY-HN(COCA)CB no . . . . . . . . . . 1 $sample_1 . . . . . . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10016 1 6 TROSY-HN(CA)CO no . . . . . . . . . . 1 $sample_1 . . . . . . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10016 1 7 TRSOY-HNCO no . . . . . . . . . . 1 $sample_1 . . . . . . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10016 1 stop_ save_ save_1H-15N_TROSY-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H-15N_TROSY-HSQC _NMR_spec_expt.Entry_ID 10016 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H-15N TROSY-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 $spectrometer_1 _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 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_TROSY-HNCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode TROSY-HNCA _NMR_spec_expt.Entry_ID 10016 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name TROSY-HNCA _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 $spectrometer_1 _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 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_TROSY-HN(CO)CA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode TROSY-HN(CO)CA _NMR_spec_expt.Entry_ID 10016 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name TROSY-HN(CO)CA _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 $spectrometer_1 _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 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_TROSY-HN(CA)CB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode TROSY-HN(CA)CB _NMR_spec_expt.Entry_ID 10016 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name TROSY-HN(CA)CB _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 $spectrometer_1 _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 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_TROSY-HN(COCA)CB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode TROSY-HN(COCA)CB _NMR_spec_expt.Entry_ID 10016 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name TROSY-HN(COCA)CB _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 $spectrometer_1 _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 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_TROSY-HN(CA)CO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode TROSY-HN(CA)CO _NMR_spec_expt.Entry_ID 10016 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name TROSY-HN(CA)CO _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 $spectrometer_1 _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 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_TRSOY-HNCO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode TRSOY-HNCO _NMR_spec_expt.Entry_ID 10016 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name TRSOY-HNCO _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 $spectrometer_1 _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 1 _NMR_spec_expt.Software_label $software_1 _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_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10016 _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 0.0 . indirect 0.251449530 . . . . . . . . . 10016 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 10016 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10016 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_ph85_298K _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode ph85_298K _Assigned_chem_shift_list.Entry_ID 10016 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _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 '1H-15N TROSY-HSQC' 1 $sample_1 isotropic 10016 1 2 TROSY-HNCA 1 $sample_1 isotropic 10016 1 3 TROSY-HN(CO)CA 1 $sample_1 isotropic 10016 1 4 TROSY-HN(CA)CB 1 $sample_1 isotropic 10016 1 5 TROSY-HN(COCA)CB 1 $sample_1 isotropic 10016 1 6 TROSY-HN(CA)CO 1 $sample_1 isotropic 10016 1 7 TRSOY-HNCO 1 $sample_1 isotropic 10016 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $software_3 . . 10016 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 15 15 THR C C 13 173.9 0.02 . 1 . . . . 572 THR C . 10016 1 2 . 1 1 15 15 THR CA C 13 60.73 0.02 . 1 . . . . 572 THR CA . 10016 1 3 . 1 1 15 15 THR CB C 13 68.89 0.02 . 1 . . . . 572 THR CB . 10016 1 4 . 1 1 16 16 GLU H H 1 8.4 0.02 . 1 . . . . 573 GLU H . 10016 1 5 . 1 1 16 16 GLU C C 13 176.09 0.02 . 1 . . . . 573 GLU C . 10016 1 6 . 1 1 16 16 GLU CA C 13 55.8 0.04 . 1 . . . . 573 GLU CA . 10016 1 7 . 1 1 16 16 GLU CB C 13 29.38 0.13 . 1 . . . . 573 GLU CB . 10016 1 8 . 1 1 16 16 GLU N N 15 125.71 0.17 . 1 . . . . 573 GLU N . 10016 1 9 . 1 1 17 17 VAL H H 1 8.05 0.02 . 1 . . . . 574 VAL H . 10016 1 10 . 1 1 17 17 VAL C C 13 175.69 0.16 . 1 . . . . 574 VAL C . 10016 1 11 . 1 1 17 17 VAL CA C 13 61.9 0.18 . 1 . . . . 574 VAL CA . 10016 1 12 . 1 1 17 17 VAL CB C 13 31.26 0.19 . 1 . . . . 574 VAL CB . 10016 1 13 . 1 1 17 17 VAL N N 15 125.25 0.13 . 1 . . . . 574 VAL N . 10016 1 14 . 1 1 18 18 LYS H H 1 8.64 0.02 . 1 . . . . 575 LYS H . 10016 1 15 . 1 1 18 18 LYS C C 13 176.81 0.02 . 1 . . . . 575 LYS C . 10016 1 16 . 1 1 18 18 LYS CA C 13 53.94 0.07 . 1 . . . . 575 LYS CA . 10016 1 17 . 1 1 18 18 LYS CB C 13 33.54 0.14 . 1 . . . . 575 LYS CB . 10016 1 18 . 1 1 18 18 LYS N N 15 128.01 0.12 . 1 . . . . 575 LYS N . 10016 1 19 . 1 1 19 19 ASP H H 1 8.45 0.03 . 1 . . . . 576 ASP H . 10016 1 20 . 1 1 19 19 ASP C C 13 176.88 0.02 . 1 . . . . 576 ASP C . 10016 1 21 . 1 1 19 19 ASP CA C 13 53.05 0.03 . 1 . . . . 576 ASP CA . 10016 1 22 . 1 1 19 19 ASP CB C 13 40.36 0.22 . 1 . . . . 576 ASP CB . 10016 1 23 . 1 1 19 19 ASP N N 15 124.74 0.19 . 1 . . . . 576 ASP N . 10016 1 24 . 1 1 20 20 LEU H H 1 8.82 0.02 . 1 . . . . 577 LEU H . 10016 1 25 . 1 1 20 20 LEU C C 13 175.85 0.02 . 1 . . . . 577 LEU C . 10016 1 26 . 1 1 20 20 LEU CA C 13 52.68 0.02 . 1 . . . . 577 LEU CA . 10016 1 27 . 1 1 20 20 LEU CB C 13 40.01 0.02 . 1 . . . . 577 LEU CB . 10016 1 28 . 1 1 20 20 LEU N N 15 127.74 0.1 . 1 . . . . 577 LEU N . 10016 1 29 . 1 1 21 21 PRO C C 13 178.19 0.02 . 1 . . . . 578 PRO C . 10016 1 30 . 1 1 21 21 PRO CA C 13 63.04 0.09 . 1 . . . . 578 PRO CA . 10016 1 31 . 1 1 21 21 PRO CB C 13 30.63 0.15 . 1 . . . . 578 PRO CB . 10016 1 32 . 1 1 22 22 GLY H H 1 8.37 0.02 . 1 . . . . 579 GLY H . 10016 1 33 . 1 1 22 22 GLY C C 13 174.3 0.02 . 1 . . . . 579 GLY C . 10016 1 34 . 1 1 22 22 GLY CA C 13 44.47 0.15 . 1 . . . . 579 GLY CA . 10016 1 35 . 1 1 22 22 GLY N N 15 113.96 0.16 . 1 . . . . 579 GLY N . 10016 1 36 . 1 1 23 23 ALA H H 1 7.52 0.02 . 1 . . . . 580 ALA H . 10016 1 37 . 1 1 23 23 ALA C C 13 177.16 0.02 . 1 . . . . 580 ALA C . 10016 1 38 . 1 1 23 23 ALA CA C 13 52.69 0.02 . 1 . . . . 580 ALA CA . 10016 1 39 . 1 1 23 23 ALA CB C 13 18.44 0.49 . 1 . . . . 580 ALA CB . 10016 1 40 . 1 1 23 23 ALA N N 15 124.98 0.05 . 1 . . . . 580 ALA N . 10016 1 41 . 1 1 24 24 GLY H H 1 8.34 0.02 . 1 . . . . 581 GLY H . 10016 1 42 . 1 1 24 24 GLY C C 13 171.11 0.02 . 1 . . . . 581 GLY C . 10016 1 43 . 1 1 24 24 GLY CA C 13 42.6 0.02 . 1 . . . . 581 GLY CA . 10016 1 44 . 1 1 24 24 GLY N N 15 112.49 0.15 . 1 . . . . 581 GLY N . 10016 1 45 . 1 1 25 25 PRO CA C 13 61.2 0.05 . 1 . . . . 582 PRO CA . 10016 1 46 . 1 1 25 25 PRO CB C 13 30.98 0.02 . 1 . . . . 582 PRO CB . 10016 1 47 . 1 1 26 26 LEU H H 1 8.67 0.02 . 1 . . . . 583 LEU H . 10016 1 48 . 1 1 26 26 LEU C C 13 175.57 0.02 . 1 . . . . 583 LEU C . 10016 1 49 . 1 1 26 26 LEU CA C 13 54.79 0.11 . 1 . . . . 583 LEU CA . 10016 1 50 . 1 1 26 26 LEU CB C 13 41.45 0.14 . 1 . . . . 583 LEU CB . 10016 1 51 . 1 1 26 26 LEU N N 15 123.66 0.13 . 1 . . . . 583 LEU N . 10016 1 52 . 1 1 27 27 ARG H H 1 9.41 0.02 . 1 . . . . 584 ARG H . 10016 1 53 . 1 1 27 27 ARG C C 13 175.13 0.05 . 1 . . . . 584 ARG C . 10016 1 54 . 1 1 27 27 ARG CA C 13 53.84 0.03 . 1 . . . . 584 ARG CA . 10016 1 55 . 1 1 27 27 ARG CB C 13 27.14 0.32 . 1 . . . . 584 ARG CB . 10016 1 56 . 1 1 27 27 ARG N N 15 132.53 0.12 . 1 . . . . 584 ARG N . 10016 1 57 . 1 1 28 28 PHE H H 1 8.28 0.02 . 1 . . . . 585 PHE H . 10016 1 58 . 1 1 28 28 PHE C C 13 175.02 0.03 . 1 . . . . 585 PHE C . 10016 1 59 . 1 1 28 28 PHE CA C 13 59.17 0.09 . 1 . . . . 585 PHE CA . 10016 1 60 . 1 1 28 28 PHE CB C 13 38.18 0.26 . 1 . . . . 585 PHE CB . 10016 1 61 . 1 1 28 28 PHE N N 15 129.91 0.23 . 1 . . . . 585 PHE N . 10016 1 62 . 1 1 29 29 GLN H H 1 8.46 0.02 . 1 . . . . 586 GLN H . 10016 1 63 . 1 1 29 29 GLN C C 13 173.67 0.07 . 1 . . . . 586 GLN C . 10016 1 64 . 1 1 29 29 GLN CA C 13 55.48 0.08 . 1 . . . . 586 GLN CA . 10016 1 65 . 1 1 29 29 GLN CB C 13 29.42 0.4 . 1 . . . . 586 GLN CB . 10016 1 66 . 1 1 29 29 GLN N N 15 130.99 0.18 . 1 . . . . 586 GLN N . 10016 1 67 . 1 1 30 30 LYS H H 1 7.83 0.02 . 1 . . . . 587 LYS H . 10016 1 68 . 1 1 30 30 LYS C C 13 175.54 0.02 . 1 . . . . 587 LYS C . 10016 1 69 . 1 1 30 30 LYS CA C 13 55.07 0.04 . 1 . . . . 587 LYS CA . 10016 1 70 . 1 1 30 30 LYS CB C 13 33.81 0.02 . 1 . . . . 587 LYS CB . 10016 1 71 . 1 1 30 30 LYS N N 15 119.21 0.09 . 1 . . . . 587 LYS N . 10016 1 72 . 1 1 31 31 GLY H H 1 9.47 0.02 . 1 . . . . 588 GLY H . 10016 1 73 . 1 1 31 31 GLY C C 13 173.57 0.05 . 1 . . . . 588 GLY C . 10016 1 74 . 1 1 31 31 GLY CA C 13 46.8 0.14 . 1 . . . . 588 GLY CA . 10016 1 75 . 1 1 31 31 GLY N N 15 115.39 0.16 . 1 . . . . 588 GLY N . 10016 1 76 . 1 1 32 32 ARG H H 1 8.8 0.02 . 1 . . . . 589 ARG H . 10016 1 77 . 1 1 32 32 ARG C C 13 176.09 0.02 . 1 . . . . 589 ARG C . 10016 1 78 . 1 1 32 32 ARG CA C 13 55.09 0.05 . 1 . . . . 589 ARG CA . 10016 1 79 . 1 1 32 32 ARG CB C 13 30.56 0.19 . 1 . . . . 589 ARG CB . 10016 1 80 . 1 1 32 32 ARG N N 15 126.39 0.12 . 1 . . . . 589 ARG N . 10016 1 81 . 1 1 33 33 ILE H H 1 8.83 0.02 . 1 . . . . 590 ILE H . 10016 1 82 . 1 1 33 33 ILE C C 13 174.53 0.02 . 1 . . . . 590 ILE C . 10016 1 83 . 1 1 33 33 ILE CA C 13 59.93 0.03 . 1 . . . . 590 ILE CA . 10016 1 84 . 1 1 33 33 ILE CB C 13 40.59 0.16 . 1 . . . . 590 ILE CB . 10016 1 85 . 1 1 33 33 ILE N N 15 130.58 0.21 . 1 . . . . 590 ILE N . 10016 1 86 . 1 1 34 34 GLU H H 1 9.2 0.02 . 1 . . . . 591 GLU H . 10016 1 87 . 1 1 34 34 GLU C C 13 174.08 0.2 . 1 . . . . 591 GLU C . 10016 1 88 . 1 1 34 34 GLU CA C 13 54.3 0.02 . 1 . . . . 591 GLU CA . 10016 1 89 . 1 1 34 34 GLU CB C 13 33.18 0.03 . 1 . . . . 591 GLU CB . 10016 1 90 . 1 1 34 34 GLU N N 15 127.56 0.1 . 1 . . . . 591 GLU N . 10016 1 91 . 1 1 35 35 PHE H H 1 9.03 0.02 . 1 . . . . 592 PHE H . 10016 1 92 . 1 1 35 35 PHE C C 13 175.02 0.04 . 1 . . . . 592 PHE C . 10016 1 93 . 1 1 35 35 PHE CA C 13 56 0.02 . 1 . . . . 592 PHE CA . 10016 1 94 . 1 1 35 35 PHE CB C 13 38.17 0.2 . 1 . . . . 592 PHE CB . 10016 1 95 . 1 1 35 35 PHE N N 15 128.94 0.1 . 1 . . . . 592 PHE N . 10016 1 96 . 1 1 36 36 GLU H H 1 9.25 0.02 . 1 . . . . 593 GLU H . 10016 1 97 . 1 1 36 36 GLU C C 13 172.71 0.03 . 1 . . . . 593 GLU C . 10016 1 98 . 1 1 36 36 GLU CA C 13 54.32 0.07 . 1 . . . . 593 GLU CA . 10016 1 99 . 1 1 36 36 GLU CB C 13 30.77 0.17 . 1 . . . . 593 GLU CB . 10016 1 100 . 1 1 36 36 GLU N N 15 129.03 0.15 . 1 . . . . 593 GLU N . 10016 1 101 . 1 1 37 37 ASN H H 1 8.93 0.02 . 1 . . . . 594 ASN H . 10016 1 102 . 1 1 37 37 ASN C C 13 174.13 0.07 . 1 . . . . 594 ASN C . 10016 1 103 . 1 1 37 37 ASN CA C 13 54.05 0.15 . 1 . . . . 594 ASN CA . 10016 1 104 . 1 1 37 37 ASN CB C 13 37.61 0.2 . 1 . . . . 594 ASN CB . 10016 1 105 . 1 1 37 37 ASN N N 15 125.71 0.14 . 1 . . . . 594 ASN N . 10016 1 106 . 1 1 38 38 VAL H H 1 8.6 0.02 . 1 . . . . 595 VAL H . 10016 1 107 . 1 1 38 38 VAL C C 13 176.74 0.03 . 1 . . . . 595 VAL C . 10016 1 108 . 1 1 38 38 VAL CA C 13 64.39 0.09 . 1 . . . . 595 VAL CA . 10016 1 109 . 1 1 38 38 VAL CB C 13 31.2 0.31 . 1 . . . . 595 VAL CB . 10016 1 110 . 1 1 38 38 VAL N N 15 121.7 0.17 . 1 . . . . 595 VAL N . 10016 1 111 . 1 1 39 39 HIS H H 1 8.24 0.02 . 1 . . . . 596 HIS H . 10016 1 112 . 1 1 39 39 HIS C C 13 174.36 0.06 . 1 . . . . 596 HIS C . 10016 1 113 . 1 1 39 39 HIS CA C 13 53.94 0.09 . 1 . . . . 596 HIS CA . 10016 1 114 . 1 1 39 39 HIS CB C 13 31.58 0.12 . 1 . . . . 596 HIS CB . 10016 1 115 . 1 1 39 39 HIS N N 15 126.38 0.08 . 1 . . . . 596 HIS N . 10016 1 116 . 1 1 40 40 PHE H H 1 8.7 0.02 . 1 . . . . 597 PHE H . 10016 1 117 . 1 1 40 40 PHE C C 13 172.5 0.19 . 1 . . . . 597 PHE C . 10016 1 118 . 1 1 40 40 PHE CA C 13 57.78 0.12 . 1 . . . . 597 PHE CA . 10016 1 119 . 1 1 40 40 PHE CB C 13 43.1 0.02 . 1 . . . . 597 PHE CB . 10016 1 120 . 1 1 40 40 PHE N N 15 123.5 0.2 . 1 . . . . 597 PHE N . 10016 1 121 . 1 1 41 41 SER H H 1 7.26 0.02 . 1 . . . . 598 SER H . 10016 1 122 . 1 1 41 41 SER C C 13 172.03 0.02 . 1 . . . . 598 SER C . 10016 1 123 . 1 1 41 41 SER CA C 13 56.45 0.06 . 1 . . . . 598 SER CA . 10016 1 124 . 1 1 41 41 SER N N 15 123.8 0.09 . 1 . . . . 598 SER N . 10016 1 125 . 1 1 42 42 TYR H H 1 7.88 0.02 . 1 . . . . 599 TYR H . 10016 1 126 . 1 1 42 42 TYR CA C 13 57.48 0.02 . 1 . . . . 599 TYR CA . 10016 1 127 . 1 1 42 42 TYR CB C 13 38.22 0.02 . 1 . . . . 599 TYR CB . 10016 1 128 . 1 1 42 42 TYR N N 15 124.62 0.1 . 1 . . . . 599 TYR N . 10016 1 129 . 1 1 49 49 LEU C C 13 176.6 0.02 . 1 . . . . 606 LEU C . 10016 1 130 . 1 1 49 49 LEU CA C 13 53.52 0.02 . 1 . . . . 606 LEU CA . 10016 1 131 . 1 1 49 49 LEU CB C 13 44.34 0.23 . 1 . . . . 606 LEU CB . 10016 1 132 . 1 1 50 50 GLN H H 1 8.8 0.02 . 1 . . . . 607 GLN H . 10016 1 133 . 1 1 50 50 GLN C C 13 172.41 0.02 . 1 . . . . 607 GLN C . 10016 1 134 . 1 1 50 50 GLN CA C 13 54.08 0.02 . 1 . . . . 607 GLN CA . 10016 1 135 . 1 1 50 50 GLN CB C 13 30.59 0.02 . 1 . . . . 607 GLN CB . 10016 1 136 . 1 1 50 50 GLN N N 15 124.74 0.16 . 1 . . . . 607 GLN N . 10016 1 137 . 1 1 51 51 ASP C C 13 173.8 0.02 . 1 . . . . 608 ASP C . 10016 1 138 . 1 1 51 51 ASP CA C 13 54.82 0.03 . 1 . . . . 608 ASP CA . 10016 1 139 . 1 1 51 51 ASP CB C 13 38.58 0.26 . 1 . . . . 608 ASP CB . 10016 1 140 . 1 1 52 52 VAL H H 1 8.96 0.02 . 1 . . . . 609 VAL H . 10016 1 141 . 1 1 52 52 VAL C C 13 175.69 0.02 . 1 . . . . 609 VAL C . 10016 1 142 . 1 1 52 52 VAL CA C 13 63.48 0.05 . 1 . . . . 609 VAL CA . 10016 1 143 . 1 1 52 52 VAL CB C 13 31.45 0.34 . 1 . . . . 609 VAL CB . 10016 1 144 . 1 1 52 52 VAL N N 15 123.39 0.21 . 1 . . . . 609 VAL N . 10016 1 145 . 1 1 53 53 SER H H 1 7.88 0.02 . 1 . . . . 610 SER H . 10016 1 146 . 1 1 53 53 SER C C 13 173.09 0.02 . 1 . . . . 610 SER C . 10016 1 147 . 1 1 53 53 SER CA C 13 55.97 0.12 . 1 . . . . 610 SER CA . 10016 1 148 . 1 1 53 53 SER CB C 13 65.3 0.04 . 1 . . . . 610 SER CB . 10016 1 149 . 1 1 53 53 SER N N 15 125.61 0.03 . 1 . . . . 610 SER N . 10016 1 150 . 1 1 54 54 PHE H H 1 8.43 0.02 . 1 . . . . 611 PHE H . 10016 1 151 . 1 1 54 54 PHE C C 13 172.66 0.02 . 1 . . . . 611 PHE C . 10016 1 152 . 1 1 54 54 PHE CA C 13 57.25 0.07 . 1 . . . . 611 PHE CA . 10016 1 153 . 1 1 54 54 PHE CB C 13 38.76 0.47 . 1 . . . . 611 PHE CB . 10016 1 154 . 1 1 54 54 PHE N N 15 119.46 0.13 . 1 . . . . 611 PHE N . 10016 1 155 . 1 1 55 55 THR H H 1 8.86 0.02 . 1 . . . . 612 THR H . 10016 1 156 . 1 1 55 55 THR C C 13 173.43 0.02 . 1 . . . . 612 THR C . 10016 1 157 . 1 1 55 55 THR CA C 13 60.91 0.13 . 1 . . . . 612 THR CA . 10016 1 158 . 1 1 55 55 THR CB C 13 71.51 0.31 . 1 . . . . 612 THR CB . 10016 1 159 . 1 1 55 55 THR N N 15 118.44 0.26 . 1 . . . . 612 THR N . 10016 1 160 . 1 1 56 56 VAL H H 1 9.65 0.02 . 1 . . . . 613 VAL H . 10016 1 161 . 1 1 56 56 VAL C C 13 174.85 0.06 . 1 . . . . 613 VAL C . 10016 1 162 . 1 1 56 56 VAL CA C 13 60.88 0.02 . 1 . . . . 613 VAL CA . 10016 1 163 . 1 1 56 56 VAL CB C 13 32.4 0.44 . 1 . . . . 613 VAL CB . 10016 1 164 . 1 1 56 56 VAL N N 15 129.76 0.11 . 1 . . . . 613 VAL N . 10016 1 165 . 1 1 57 57 MET H H 1 8.14 0.02 . 1 . . . . 614 MET H . 10016 1 166 . 1 1 57 57 MET C C 13 172.87 0.02 . 1 . . . . 614 MET C . 10016 1 167 . 1 1 57 57 MET CA C 13 52 0.02 . 1 . . . . 614 MET CA . 10016 1 168 . 1 1 57 57 MET CB C 13 28.71 0.02 . 1 . . . . 614 MET CB . 10016 1 169 . 1 1 57 57 MET N N 15 126.79 0.12 . 1 . . . . 614 MET N . 10016 1 170 . 1 1 59 59 GLY C C 13 173.82 0.02 . 1 . . . . 616 GLY C . 10016 1 171 . 1 1 59 59 GLY CA C 13 44.59 0.02 . 1 . . . . 616 GLY CA . 10016 1 172 . 1 1 60 60 GLN H H 1 7.93 0.02 . 1 . . . . 617 GLN H . 10016 1 173 . 1 1 60 60 GLN C C 13 174.58 0.1 . 1 . . . . 617 GLN C . 10016 1 174 . 1 1 60 60 GLN CA C 13 55.25 0.11 . 1 . . . . 617 GLN CA . 10016 1 175 . 1 1 60 60 GLN CB C 13 29.37 0.29 . 1 . . . . 617 GLN CB . 10016 1 176 . 1 1 60 60 GLN N N 15 121.72 0.12 . 1 . . . . 617 GLN N . 10016 1 177 . 1 1 61 61 THR H H 1 9.24 0.02 . 1 . . . . 618 THR H . 10016 1 178 . 1 1 61 61 THR C C 13 173.69 0.08 . 1 . . . . 618 THR C . 10016 1 179 . 1 1 61 61 THR CA C 13 61.3 0.02 . 1 . . . . 618 THR CA . 10016 1 180 . 1 1 61 61 THR CB C 13 70.33 0.38 . 1 . . . . 618 THR CB . 10016 1 181 . 1 1 61 61 THR N N 15 116.33 0.09 . 1 . . . . 618 THR N . 10016 1 182 . 1 1 62 62 LEU H H 1 9 0.02 . 1 . . . . 619 LEU H . 10016 1 183 . 1 1 62 62 LEU C C 13 173.59 0.03 . 1 . . . . 619 LEU C . 10016 1 184 . 1 1 62 62 LEU CA C 13 52.24 0.08 . 1 . . . . 619 LEU CA . 10016 1 185 . 1 1 62 62 LEU CB C 13 43.97 0.43 . 1 . . . . 619 LEU CB . 10016 1 186 . 1 1 62 62 LEU N N 15 132.79 0.17 . 1 . . . . 619 LEU N . 10016 1 187 . 1 1 63 63 ALA H H 1 8.91 0.02 . 1 . . . . 620 ALA H . 10016 1 188 . 1 1 63 63 ALA C C 13 174.51 0.04 . 1 . . . . 620 ALA C . 10016 1 189 . 1 1 63 63 ALA CA C 13 48.68 0.1 . 1 . . . . 620 ALA CA . 10016 1 190 . 1 1 63 63 ALA CB C 13 21.34 0.38 . 1 . . . . 620 ALA CB . 10016 1 191 . 1 1 63 63 ALA N N 15 130.28 0.17 . 1 . . . . 620 ALA N . 10016 1 192 . 1 1 64 64 LEU H H 1 9.02 0.02 . 1 . . . . 621 LEU H . 10016 1 193 . 1 1 64 64 LEU C C 13 174.66 0.8 . 1 . . . . 621 LEU C . 10016 1 194 . 1 1 64 64 LEU CA C 13 52.58 0.15 . 1 . . . . 621 LEU CA . 10016 1 195 . 1 1 64 64 LEU CB C 13 42.34 0.15 . 1 . . . . 621 LEU CB . 10016 1 196 . 1 1 64 64 LEU N N 15 124.47 0.14 . 1 . . . . 621 LEU N . 10016 1 197 . 1 1 65 65 VAL H H 1 8.56 0.02 . 1 . . . . 622 VAL H . 10016 1 198 . 1 1 65 65 VAL C C 13 174.08 0.02 . 1 . . . . 622 VAL C . 10016 1 199 . 1 1 65 65 VAL CA C 13 57.47 0.07 . 1 . . . . 622 VAL CA . 10016 1 200 . 1 1 65 65 VAL CB C 13 34.54 0.9 . 1 . . . . 622 VAL CB . 10016 1 201 . 1 1 65 65 VAL N N 15 116.58 0.17 . 1 . . . . 622 VAL N . 10016 1 202 . 1 1 66 66 GLY H H 1 8.64 0.02 . 1 . . . . 623 GLY H . 10016 1 203 . 1 1 66 66 GLY CA C 13 43.94 0.02 . 1 . . . . 623 GLY CA . 10016 1 204 . 1 1 66 66 GLY N N 15 109.45 0.32 . 1 . . . . 623 GLY N . 10016 1 205 . 1 1 77 77 ARG C C 13 175.88 0.02 . 1 . . . . 634 ARG C . 10016 1 206 . 1 1 77 77 ARG CA C 13 57.83 0.03 . 1 . . . . 634 ARG CA . 10016 1 207 . 1 1 77 77 ARG CB C 13 27.92 0.02 . 1 . . . . 634 ARG CB . 10016 1 208 . 1 1 78 78 LEU H H 1 7.6 0.02 . 1 . . . . 635 LEU H . 10016 1 209 . 1 1 78 78 LEU C C 13 175.5 0.02 . 1 . . . . 635 LEU C . 10016 1 210 . 1 1 78 78 LEU CA C 13 52.07 0.09 . 1 . . . . 635 LEU CA . 10016 1 211 . 1 1 78 78 LEU CB C 13 41.51 0.46 . 1 . . . . 635 LEU CB . 10016 1 212 . 1 1 78 78 LEU N N 15 118.47 0.1 . 1 . . . . 635 LEU N . 10016 1 213 . 1 1 79 79 LEU H H 1 8.87 0.02 . 1 . . . . 636 LEU H . 10016 1 214 . 1 1 79 79 LEU C C 13 177.29 0.02 . 1 . . . . 636 LEU C . 10016 1 215 . 1 1 79 79 LEU CA C 13 55.46 0.02 . 1 . . . . 636 LEU CA . 10016 1 216 . 1 1 79 79 LEU CB C 13 39.4 0.02 . 1 . . . . 636 LEU CB . 10016 1 217 . 1 1 79 79 LEU N N 15 125.28 0.17 . 1 . . . . 636 LEU N . 10016 1 218 . 1 1 80 80 PHE H H 1 7.95 0.02 . 1 . . . . 637 PHE H . 10016 1 219 . 1 1 80 80 PHE CA C 13 54.62 0.02 . 1 . . . . 637 PHE CA . 10016 1 220 . 1 1 80 80 PHE CB C 13 40.9 0.02 . 1 . . . . 637 PHE CB . 10016 1 221 . 1 1 80 80 PHE N N 15 122.27 0.11 . 1 . . . . 637 PHE N . 10016 1 222 . 1 1 82 82 PHE C C 13 174.72 0.02 . 1 . . . . 639 PHE C . 10016 1 223 . 1 1 82 82 PHE CA C 13 59.26 0.07 . 1 . . . . 639 PHE CA . 10016 1 224 . 1 1 83 83 TYR H H 1 6.67 0.03 . 1 . . . . 640 TYR H . 10016 1 225 . 1 1 83 83 TYR C C 13 174.6 0.02 . 1 . . . . 640 TYR C . 10016 1 226 . 1 1 83 83 TYR CA C 13 52.88 0.1 . 1 . . . . 640 TYR CA . 10016 1 227 . 1 1 83 83 TYR CB C 13 42.14 0.37 . 1 . . . . 640 TYR CB . 10016 1 228 . 1 1 83 83 TYR N N 15 110.69 0.14 . 1 . . . . 640 TYR N . 10016 1 229 . 1 1 84 84 ASP H H 1 8.61 0.02 . 1 . . . . 641 ASP H . 10016 1 230 . 1 1 84 84 ASP C C 13 176.42 0.02 . 1 . . . . 641 ASP C . 10016 1 231 . 1 1 84 84 ASP CA C 13 53.51 0.13 . 1 . . . . 641 ASP CA . 10016 1 232 . 1 1 84 84 ASP CB C 13 41.96 0.08 . 1 . . . . 641 ASP CB . 10016 1 233 . 1 1 84 84 ASP N N 15 121.87 0.05 . 1 . . . . 641 ASP N . 10016 1 234 . 1 1 85 85 ILE H H 1 8.04 0.02 . 1 . . . . 642 ILE H . 10016 1 235 . 1 1 85 85 ILE C C 13 175.89 0.03 . 1 . . . . 642 ILE C . 10016 1 236 . 1 1 85 85 ILE CA C 13 61.01 0.06 . 1 . . . . 642 ILE CA . 10016 1 237 . 1 1 85 85 ILE CB C 13 37.79 0.65 . 1 . . . . 642 ILE CB . 10016 1 238 . 1 1 85 85 ILE N N 15 115.18 0.16 . 1 . . . . 642 ILE N . 10016 1 239 . 1 1 86 86 SER H H 1 8.62 0.02 . 1 . . . . 643 SER H . 10016 1 240 . 1 1 86 86 SER C C 13 174.83 0.03 . 1 . . . . 643 SER C . 10016 1 241 . 1 1 86 86 SER CA C 13 59.54 0.05 . 1 . . . . 643 SER CA . 10016 1 242 . 1 1 86 86 SER CB C 13 63.05 0.71 . 1 . . . . 643 SER CB . 10016 1 243 . 1 1 86 86 SER N N 15 119.02 0.15 . 1 . . . . 643 SER N . 10016 1 244 . 1 1 87 87 SER H H 1 7.72 0.02 . 1 . . . . 644 SER H . 10016 1 245 . 1 1 87 87 SER C C 13 172.33 0.11 . 1 . . . . 644 SER C . 10016 1 246 . 1 1 87 87 SER CA C 13 57.87 0.03 . 1 . . . . 644 SER CA . 10016 1 247 . 1 1 87 87 SER CB C 13 63.46 0.65 . 1 . . . . 644 SER CB . 10016 1 248 . 1 1 87 87 SER N N 15 115.7 0.24 . 1 . . . . 644 SER N . 10016 1 249 . 1 1 88 88 GLY H H 1 8.34 0.02 . 1 . . . . 645 GLY H . 10016 1 250 . 1 1 88 88 GLY C C 13 173.79 0.07 . 1 . . . . 645 GLY C . 10016 1 251 . 1 1 88 88 GLY CA C 13 44.14 0.05 . 1 . . . . 645 GLY CA . 10016 1 252 . 1 1 88 88 GLY N N 15 111.56 0.11 . 1 . . . . 645 GLY N . 10016 1 253 . 1 1 89 89 CYS H H 1 8.27 0.02 . 1 . . . . 646 CYS H . 10016 1 254 . 1 1 89 89 CYS C C 13 171.34 0.09 . 1 . . . . 646 CYS C . 10016 1 255 . 1 1 89 89 CYS CA C 13 58.6 0.11 . 1 . . . . 646 CYS CA . 10016 1 256 . 1 1 89 89 CYS CB C 13 29.98 0.6 . 1 . . . . 646 CYS CB . 10016 1 257 . 1 1 89 89 CYS N N 15 121.3 0.13 . 1 . . . . 646 CYS N . 10016 1 258 . 1 1 90 90 ILE H H 1 8.8 0.02 . 1 . . . . 647 ILE H . 10016 1 259 . 1 1 90 90 ILE C C 13 174.3 0.09 . 1 . . . . 647 ILE C . 10016 1 260 . 1 1 90 90 ILE CA C 13 59.69 0.13 . 1 . . . . 647 ILE CA . 10016 1 261 . 1 1 90 90 ILE CB C 13 38.3 0.27 . 1 . . . . 647 ILE CB . 10016 1 262 . 1 1 90 90 ILE N N 15 131.29 0.32 . 1 . . . . 647 ILE N . 10016 1 263 . 1 1 91 91 ARG H H 1 9.09 0.02 . 1 . . . . 648 ARG H . 10016 1 264 . 1 1 91 91 ARG C C 13 176.54 0.04 . 1 . . . . 648 ARG C . 10016 1 265 . 1 1 91 91 ARG CA C 13 52.83 0.13 . 1 . . . . 648 ARG CA . 10016 1 266 . 1 1 91 91 ARG CB C 13 34.51 0.4 . 1 . . . . 648 ARG CB . 10016 1 267 . 1 1 91 91 ARG N N 15 125.36 0.14 . 1 . . . . 648 ARG N . 10016 1 268 . 1 1 92 92 ILE H H 1 8.17 0.02 . 1 . . . . 649 ILE H . 10016 1 269 . 1 1 92 92 ILE C C 13 175.36 0.07 . 1 . . . . 649 ILE C . 10016 1 270 . 1 1 92 92 ILE CA C 13 59.21 0.05 . 1 . . . . 649 ILE CA . 10016 1 271 . 1 1 92 92 ILE CB C 13 39.9 0.7 . 1 . . . . 649 ILE CB . 10016 1 272 . 1 1 92 92 ILE N N 15 122.77 0.04 . 1 . . . . 649 ILE N . 10016 1 273 . 1 1 93 93 ASP H H 1 9.55 0.02 . 1 . . . . 650 ASP H . 10016 1 274 . 1 1 93 93 ASP C C 13 176.97 0.03 . 1 . . . . 650 ASP C . 10016 1 275 . 1 1 93 93 ASP CA C 13 55.77 0.1 . 1 . . . . 650 ASP CA . 10016 1 276 . 1 1 93 93 ASP CB C 13 39.4 0.29 . 1 . . . . 650 ASP CB . 10016 1 277 . 1 1 93 93 ASP N N 15 130.09 0.09 . 1 . . . . 650 ASP N . 10016 1 278 . 1 1 94 94 GLY H H 1 9.21 0.02 . 1 . . . . 651 GLY H . 10016 1 279 . 1 1 94 94 GLY C C 13 173.76 0.02 . 1 . . . . 651 GLY C . 10016 1 280 . 1 1 94 94 GLY CA C 13 44.77 0.02 . 1 . . . . 651 GLY CA . 10016 1 281 . 1 1 94 94 GLY N N 15 105.59 0.08 . 1 . . . . 651 GLY N . 10016 1 282 . 1 1 95 95 GLN H H 1 7.91 0.02 . 1 . . . . 652 GLN H . 10016 1 283 . 1 1 95 95 GLN C C 13 174 0.04 . 1 . . . . 652 GLN C . 10016 1 284 . 1 1 95 95 GLN CA C 13 54.29 0.02 . 1 . . . . 652 GLN CA . 10016 1 285 . 1 1 95 95 GLN CB C 13 29.31 0.48 . 1 . . . . 652 GLN CB . 10016 1 286 . 1 1 95 95 GLN N N 15 125.19 0.1 . 1 . . . . 652 GLN N . 10016 1 287 . 1 1 96 96 ASP H H 1 8.34 0.02 . 1 . . . . 653 ASP H . 10016 1 288 . 1 1 96 96 ASP C C 13 179.25 0.02 . 1 . . . . 653 ASP C . 10016 1 289 . 1 1 96 96 ASP CA C 13 52.86 0.05 . 1 . . . . 653 ASP CA . 10016 1 290 . 1 1 96 96 ASP CB C 13 39.89 0.51 . 1 . . . . 653 ASP CB . 10016 1 291 . 1 1 96 96 ASP N N 15 126.76 0.07 . 1 . . . . 653 ASP N . 10016 1 292 . 1 1 97 97 ILE H H 1 8.71 0.02 . 1 . . . . 654 ILE H . 10016 1 293 . 1 1 97 97 ILE C C 13 176.5 0.08 . 1 . . . . 654 ILE C . 10016 1 294 . 1 1 97 97 ILE CA C 13 64.03 0.06 . 1 . . . . 654 ILE CA . 10016 1 295 . 1 1 97 97 ILE CB C 13 36.23 0.23 . 1 . . . . 654 ILE CB . 10016 1 296 . 1 1 97 97 ILE N N 15 125.96 0.09 . 1 . . . . 654 ILE N . 10016 1 297 . 1 1 98 98 SER H H 1 9.09 0.02 . 1 . . . . 655 SER H . 10016 1 298 . 1 1 98 98 SER C C 13 175.79 0.02 . 1 . . . . 655 SER C . 10016 1 299 . 1 1 98 98 SER CA C 13 59.94 0.09 . 1 . . . . 655 SER CA . 10016 1 300 . 1 1 98 98 SER CB C 13 63.4 0.85 . 1 . . . . 655 SER CB . 10016 1 301 . 1 1 98 98 SER N N 15 119.82 0.15 . 1 . . . . 655 SER N . 10016 1 302 . 1 1 99 99 GLN H H 1 7.77 0.02 . 1 . . . . 656 GLN H . 10016 1 303 . 1 1 99 99 GLN C C 13 174.77 0.02 . 1 . . . . 656 GLN C . 10016 1 304 . 1 1 99 99 GLN CA C 13 54.56 0.12 . 1 . . . . 656 GLN CA . 10016 1 305 . 1 1 99 99 GLN CB C 13 28.37 0.53 . 1 . . . . 656 GLN CB . 10016 1 306 . 1 1 99 99 GLN N N 15 121.9 0.21 . 1 . . . . 656 GLN N . 10016 1 307 . 1 1 100 100 VAL H H 1 6.68 0.02 . 1 . . . . 657 VAL H . 10016 1 308 . 1 1 100 100 VAL C C 13 177.5 0.02 . 1 . . . . 657 VAL C . 10016 1 309 . 1 1 100 100 VAL CA C 13 57.47 0.02 . 1 . . . . 657 VAL CA . 10016 1 310 . 1 1 100 100 VAL CB C 13 33.81 0.15 . 1 . . . . 657 VAL CB . 10016 1 311 . 1 1 100 100 VAL N N 15 111.84 0.15 . 1 . . . . 657 VAL N . 10016 1 312 . 1 1 101 101 THR H H 1 8.27 0.02 . 1 . . . . 658 THR H . 10016 1 313 . 1 1 101 101 THR C C 13 176.3 0.05 . 1 . . . . 658 THR C . 10016 1 314 . 1 1 101 101 THR CA C 13 60.27 0.02 . 1 . . . . 658 THR CA . 10016 1 315 . 1 1 101 101 THR CB C 13 67.97 0.24 . 1 . . . . 658 THR CB . 10016 1 316 . 1 1 101 101 THR N N 15 116.89 0.12 . 1 . . . . 658 THR N . 10016 1 317 . 1 1 102 102 GLN H H 1 10.41 0.02 . 1 . . . . 659 GLN H . 10016 1 318 . 1 1 102 102 GLN C C 13 178.26 0.11 . 1 . . . . 659 GLN C . 10016 1 319 . 1 1 102 102 GLN CA C 13 58.9 0.09 . 1 . . . . 659 GLN CA . 10016 1 320 . 1 1 102 102 GLN CB C 13 29.5 0.02 . 1 . . . . 659 GLN CB . 10016 1 321 . 1 1 102 102 GLN N N 15 130.93 0.09 . 1 . . . . 659 GLN N . 10016 1 322 . 1 1 103 103 ALA H H 1 9.21 0.02 . 1 . . . . 660 ALA H . 10016 1 323 . 1 1 103 103 ALA C C 13 180.72 0.04 . 1 . . . . 660 ALA C . 10016 1 324 . 1 1 103 103 ALA CA C 13 54.41 0.26 . 1 . . . . 660 ALA CA . 10016 1 325 . 1 1 103 103 ALA CB C 13 17.33 0.02 . 1 . . . . 660 ALA CB . 10016 1 326 . 1 1 103 103 ALA N N 15 122.16 0.17 . 1 . . . . 660 ALA N . 10016 1 327 . 1 1 104 104 SER H H 1 7.38 0.02 . 1 . . . . 661 SER H . 10016 1 328 . 1 1 104 104 SER C C 13 176.84 0.02 . 1 . . . . 661 SER C . 10016 1 329 . 1 1 104 104 SER CA C 13 60.24 0.02 . 1 . . . . 661 SER CA . 10016 1 330 . 1 1 104 104 SER CB C 13 62.23 0.45 . 1 . . . . 661 SER CB . 10016 1 331 . 1 1 104 104 SER N N 15 115.91 0.2 . 1 . . . . 661 SER N . 10016 1 332 . 1 1 105 105 LEU H H 1 7.61 0.02 . 1 . . . . 662 LEU H . 10016 1 333 . 1 1 105 105 LEU C C 13 177.49 0.02 . 1 . . . . 662 LEU C . 10016 1 334 . 1 1 105 105 LEU CA C 13 58.04 0.03 . 1 . . . . 662 LEU CA . 10016 1 335 . 1 1 105 105 LEU CB C 13 41.47 0.03 . 1 . . . . 662 LEU CB . 10016 1 336 . 1 1 105 105 LEU N N 15 128.03 0.19 . 1 . . . . 662 LEU N . 10016 1 337 . 1 1 106 106 ARG H H 1 7.8 0.02 . 1 . . . . 663 ARG H . 10016 1 338 . 1 1 106 106 ARG C C 13 177.72 0.09 . 1 . . . . 663 ARG C . 10016 1 339 . 1 1 106 106 ARG CA C 13 58.36 0.02 . 1 . . . . 663 ARG CA . 10016 1 340 . 1 1 106 106 ARG CB C 13 28.83 0.02 . 1 . . . . 663 ARG CB . 10016 1 341 . 1 1 106 106 ARG N N 15 114.74 0.13 . 1 . . . . 663 ARG N . 10016 1 342 . 1 1 107 107 SER H H 1 7.5 0.02 . 1 . . . . 664 SER H . 10016 1 343 . 1 1 107 107 SER C C 13 174.19 0.02 . 1 . . . . 664 SER C . 10016 1 344 . 1 1 107 107 SER CA C 13 60.38 0.16 . 1 . . . . 664 SER CA . 10016 1 345 . 1 1 107 107 SER CB C 13 61.98 0.69 . 1 . . . . 664 SER CB . 10016 1 346 . 1 1 107 107 SER N N 15 116.88 0.06 . 1 . . . . 664 SER N . 10016 1 347 . 1 1 108 108 HIS H H 1 6.93 0.02 . 1 . . . . 665 HIS H . 10016 1 348 . 1 1 108 108 HIS C C 13 172.82 0.04 . 1 . . . . 665 HIS C . 10016 1 349 . 1 1 108 108 HIS CA C 13 56.5 0.09 . 1 . . . . 665 HIS CA . 10016 1 350 . 1 1 108 108 HIS CB C 13 30.43 0.02 . 1 . . . . 665 HIS CB . 10016 1 351 . 1 1 108 108 HIS N N 15 119.86 0.13 . 1 . . . . 665 HIS N . 10016 1 352 . 1 1 109 109 ILE H H 1 7.12 0.02 . 1 . . . . 666 ILE H . 10016 1 353 . 1 1 109 109 ILE C C 13 174.89 0.04 . 1 . . . . 666 ILE C . 10016 1 354 . 1 1 109 109 ILE CA C 13 59.58 0.03 . 1 . . . . 666 ILE CA . 10016 1 355 . 1 1 109 109 ILE CB C 13 40.12 0.5 . 1 . . . . 666 ILE CB . 10016 1 356 . 1 1 109 109 ILE N N 15 120.26 0.13 . 1 . . . . 666 ILE N . 10016 1 357 . 1 1 110 110 GLY H H 1 9.16 0.02 . 1 . . . . 667 GLY H . 10016 1 358 . 1 1 110 110 GLY C C 13 170.98 0.02 . 1 . . . . 667 GLY C . 10016 1 359 . 1 1 110 110 GLY CA C 13 43.55 0.02 . 1 . . . . 667 GLY CA . 10016 1 360 . 1 1 110 110 GLY N N 15 116.85 0.16 . 1 . . . . 667 GLY N . 10016 1 361 . 1 1 113 113 PRO C C 13 177.73 0.02 . 1 . . . . 670 PRO C . 10016 1 362 . 1 1 113 113 PRO CA C 13 62.96 0.07 . 1 . . . . 670 PRO CA . 10016 1 363 . 1 1 113 113 PRO CB C 13 30.29 0.02 . 1 . . . . 670 PRO CB . 10016 1 364 . 1 1 114 114 GLN H H 1 8.34 0.03 . 1 . . . . 671 GLN H . 10016 1 365 . 1 1 114 114 GLN C C 13 178.55 0.05 . 1 . . . . 671 GLN C . 10016 1 366 . 1 1 114 114 GLN CA C 13 58.51 0.02 . 1 . . . . 671 GLN CA . 10016 1 367 . 1 1 114 114 GLN CB C 13 26.99 0.02 . 1 . . . . 671 GLN CB . 10016 1 368 . 1 1 114 114 GLN N N 15 122.61 0.09 . 1 . . . . 671 GLN N . 10016 1 369 . 1 1 115 115 ASP H H 1 8.09 0.02 . 1 . . . . 672 ASP H . 10016 1 370 . 1 1 115 115 ASP CA C 13 56.66 0.02 . 1 . . . . 672 ASP CA . 10016 1 371 . 1 1 115 115 ASP CB C 13 39.88 0.02 . 1 . . . . 672 ASP CB . 10016 1 372 . 1 1 115 115 ASP N N 15 120.42 0.07 . 1 . . . . 672 ASP N . 10016 1 373 . 1 1 117 117 VAL C C 13 174.86 0.02 . 1 . . . . 674 VAL C . 10016 1 374 . 1 1 117 117 VAL CA C 13 61.6 0.04 . 1 . . . . 674 VAL CA . 10016 1 375 . 1 1 117 117 VAL CB C 13 31.6 0.06 . 1 . . . . 674 VAL CB . 10016 1 376 . 1 1 118 118 LEU H H 1 8.27 0.02 . 1 . . . . 675 LEU H . 10016 1 377 . 1 1 118 118 LEU C C 13 175.55 0.02 . 1 . . . . 675 LEU C . 10016 1 378 . 1 1 118 118 LEU CA C 13 52.02 0.02 . 1 . . . . 675 LEU CA . 10016 1 379 . 1 1 118 118 LEU CB C 13 41.57 0.02 . 1 . . . . 675 LEU CB . 10016 1 380 . 1 1 118 118 LEU N N 15 129.49 0.11 . 1 . . . . 675 LEU N . 10016 1 381 . 1 1 120 120 ASN C C 13 172.47 0.02 . 1 . . . . 677 ASN C . 10016 1 382 . 1 1 120 120 ASN CA C 13 52.83 0.02 . 1 . . . . 677 ASN CA . 10016 1 383 . 1 1 120 120 ASN CB C 13 36.05 0.02 . 1 . . . . 677 ASN CB . 10016 1 384 . 1 1 121 121 ASP H H 1 8.02 0.02 . 1 . . . . 678 ASP H . 10016 1 385 . 1 1 121 121 ASP C C 13 176.25 0.06 . 1 . . . . 678 ASP C . 10016 1 386 . 1 1 121 121 ASP CA C 13 51.9 0.21 . 1 . . . . 678 ASP CA . 10016 1 387 . 1 1 121 121 ASP CB C 13 44.02 0.22 . 1 . . . . 678 ASP CB . 10016 1 388 . 1 1 121 121 ASP N N 15 129.16 0.14 . 1 . . . . 678 ASP N . 10016 1 389 . 1 1 122 122 THR H H 1 9.87 0.02 . 1 . . . . 679 THR H . 10016 1 390 . 1 1 122 122 THR C C 13 178.43 0.05 . 1 . . . . 679 THR C . 10016 1 391 . 1 1 122 122 THR CA C 13 61.74 0.13 . 1 . . . . 679 THR CA . 10016 1 392 . 1 1 122 122 THR CB C 13 70.99 0.25 . 1 . . . . 679 THR CB . 10016 1 393 . 1 1 122 122 THR N N 15 112.54 0.1 . 1 . . . . 679 THR N . 10016 1 394 . 1 1 123 123 ILE H H 1 8.81 0.02 . 1 . . . . 680 ILE H . 10016 1 395 . 1 1 123 123 ILE C C 13 176.41 0.02 . 1 . . . . 680 ILE C . 10016 1 396 . 1 1 123 123 ILE CA C 13 62.17 0.18 . 1 . . . . 680 ILE CA . 10016 1 397 . 1 1 123 123 ILE CB C 13 36.8 0.3 . 1 . . . . 680 ILE CB . 10016 1 398 . 1 1 123 123 ILE N N 15 124 0.11 . 1 . . . . 680 ILE N . 10016 1 399 . 1 1 124 124 ALA H H 1 7.94 0.02 . 1 . . . . 681 ALA H . 10016 1 400 . 1 1 124 124 ALA C C 13 179.21 0.08 . 1 . . . . 681 ALA C . 10016 1 401 . 1 1 124 124 ALA CA C 13 55.52 0.02 . 1 . . . . 681 ALA CA . 10016 1 402 . 1 1 124 124 ALA CB C 13 18.25 0.3 . 1 . . . . 681 ALA CB . 10016 1 403 . 1 1 124 124 ALA N N 15 125.45 0.09 . 1 . . . . 681 ALA N . 10016 1 404 . 1 1 125 125 ASP H H 1 8.26 0.02 . 1 . . . . 682 ASP H . 10016 1 405 . 1 1 125 125 ASP C C 13 178.56 0.02 . 1 . . . . 682 ASP C . 10016 1 406 . 1 1 125 125 ASP CA C 13 57.25 0.02 . 1 . . . . 682 ASP CA . 10016 1 407 . 1 1 125 125 ASP CB C 13 38.91 0.02 . 1 . . . . 682 ASP CB . 10016 1 408 . 1 1 125 125 ASP N N 15 119.63 0.06 . 1 . . . . 682 ASP N . 10016 1 409 . 1 1 126 126 ASN H H 1 8.23 0.02 . 1 . . . . 683 ASN H . 10016 1 410 . 1 1 126 126 ASN C C 13 178.34 0.02 . 1 . . . . 683 ASN C . 10016 1 411 . 1 1 126 126 ASN CA C 13 57.01 0.03 . 1 . . . . 683 ASN CA . 10016 1 412 . 1 1 126 126 ASN CB C 13 40.2 0.04 . 1 . . . . 683 ASN CB . 10016 1 413 . 1 1 126 126 ASN N N 15 121.08 0.12 . 1 . . . . 683 ASN N . 10016 1 414 . 1 1 127 127 ILE H H 1 7.86 0.02 . 1 . . . . 684 ILE H . 10016 1 415 . 1 1 127 127 ILE CA C 13 65.08 0.02 . 1 . . . . 684 ILE CA . 10016 1 416 . 1 1 127 127 ILE CB C 13 37.03 0.02 . 1 . . . . 684 ILE CB . 10016 1 417 . 1 1 127 127 ILE N N 15 124.37 0.19 . 1 . . . . 684 ILE N . 10016 1 418 . 1 1 130 130 GLY C C 13 174.01 0.02 . 1 . . . . 687 GLY C . 10016 1 419 . 1 1 130 130 GLY CA C 13 46.29 0.02 . 1 . . . . 687 GLY CA . 10016 1 420 . 1 1 131 131 ARG H H 1 7.74 0.02 . 1 . . . . 688 ARG H . 10016 1 421 . 1 1 131 131 ARG C C 13 174.85 0.04 . 1 . . . . 688 ARG C . 10016 1 422 . 1 1 131 131 ARG CA C 13 56.67 0.06 . 1 . . . . 688 ARG CA . 10016 1 423 . 1 1 131 131 ARG CB C 13 30.69 0.02 . 1 . . . . 688 ARG CB . 10016 1 424 . 1 1 131 131 ARG N N 15 121.92 0.08 . 1 . . . . 688 ARG N . 10016 1 425 . 1 1 132 132 VAL H H 1 8.14 0.02 . 1 . . . . 689 VAL H . 10016 1 426 . 1 1 132 132 VAL C C 13 175.72 0.02 . 1 . . . . 689 VAL C . 10016 1 427 . 1 1 132 132 VAL CA C 13 64.73 0.03 . 1 . . . . 689 VAL CA . 10016 1 428 . 1 1 132 132 VAL CB C 13 30.93 0.02 . 1 . . . . 689 VAL CB . 10016 1 429 . 1 1 132 132 VAL N N 15 124.61 0.18 . 1 . . . . 689 VAL N . 10016 1 430 . 1 1 133 133 THR H H 1 7.01 0.02 . 1 . . . . 690 THR H . 10016 1 431 . 1 1 133 133 THR C C 13 174.87 0.03 . 1 . . . . 690 THR C . 10016 1 432 . 1 1 133 133 THR CA C 13 60.63 0.02 . 1 . . . . 690 THR CA . 10016 1 433 . 1 1 133 133 THR CB C 13 68.25 1.48 . 1 . . . . 690 THR CB . 10016 1 434 . 1 1 133 133 THR N N 15 109.22 0.24 . 1 . . . . 690 THR N . 10016 1 435 . 1 1 134 134 ALA H H 1 8.15 0.02 . 1 . . . . 691 ALA H . 10016 1 436 . 1 1 134 134 ALA C C 13 178.27 0.03 . 1 . . . . 691 ALA C . 10016 1 437 . 1 1 134 134 ALA CA C 13 52.16 0.15 . 1 . . . . 691 ALA CA . 10016 1 438 . 1 1 134 134 ALA CB C 13 19.4 0.33 . 1 . . . . 691 ALA CB . 10016 1 439 . 1 1 134 134 ALA N N 15 127.77 0.06 . 1 . . . . 691 ALA N . 10016 1 440 . 1 1 135 135 GLY H H 1 8.88 0.02 . 1 . . . . 692 GLY H . 10016 1 441 . 1 1 135 135 GLY C C 13 174.67 0.02 . 1 . . . . 692 GLY C . 10016 1 442 . 1 1 135 135 GLY CA C 13 43.27 0.03 . 1 . . . . 692 GLY CA . 10016 1 443 . 1 1 135 135 GLY N N 15 112.39 0.11 . 1 . . . . 692 GLY N . 10016 1 444 . 1 1 137 137 ASP C C 13 178.73 0.02 . 1 . . . . 694 ASP C . 10016 1 445 . 1 1 137 137 ASP CA C 13 56.04 0.13 . 1 . . . . 694 ASP CA . 10016 1 446 . 1 1 138 138 GLU H H 1 7.41 0.02 . 1 . . . . 695 GLU H . 10016 1 447 . 1 1 138 138 GLU C C 13 179.17 0.07 . 1 . . . . 695 GLU C . 10016 1 448 . 1 1 138 138 GLU CA C 13 58.45 0.11 . 1 . . . . 695 GLU CA . 10016 1 449 . 1 1 138 138 GLU CB C 13 29.53 0.09 . 1 . . . . 695 GLU CB . 10016 1 450 . 1 1 138 138 GLU N N 15 124.56 0.18 . 1 . . . . 695 GLU N . 10016 1 451 . 1 1 139 139 VAL H H 1 7.83 0.02 . 1 . . . . 696 VAL H . 10016 1 452 . 1 1 139 139 VAL C C 13 176.75 0.02 . 1 . . . . 696 VAL C . 10016 1 453 . 1 1 139 139 VAL CA C 13 66.62 0.08 . 1 . . . . 696 VAL CA . 10016 1 454 . 1 1 139 139 VAL CB C 13 30.34 0.6 . 1 . . . . 696 VAL CB . 10016 1 455 . 1 1 139 139 VAL N N 15 124.14 0.21 . 1 . . . . 696 VAL N . 10016 1 456 . 1 1 140 140 GLU H H 1 7.84 0.02 . 1 . . . . 697 GLU H . 10016 1 457 . 1 1 140 140 GLU C C 13 178.73 0.02 . 1 . . . . 697 GLU C . 10016 1 458 . 1 1 140 140 GLU CA C 13 58.33 0.07 . 1 . . . . 697 GLU CA . 10016 1 459 . 1 1 140 140 GLU CB C 13 27.92 0.16 . 1 . . . . 697 GLU CB . 10016 1 460 . 1 1 140 140 GLU N N 15 121.25 0.09 . 1 . . . . 697 GLU N . 10016 1 461 . 1 1 141 141 ALA H H 1 7.74 0.02 . 1 . . . . 698 ALA H . 10016 1 462 . 1 1 141 141 ALA C C 13 181.2 0.05 . 1 . . . . 698 ALA C . 10016 1 463 . 1 1 141 141 ALA CA C 13 54.32 0.02 . 1 . . . . 698 ALA CA . 10016 1 464 . 1 1 141 141 ALA CB C 13 17.02 0.2 . 1 . . . . 698 ALA CB . 10016 1 465 . 1 1 141 141 ALA N N 15 122.83 0.1 . 1 . . . . 698 ALA N . 10016 1 466 . 1 1 142 142 ALA H H 1 8.04 0.02 . 1 . . . . 699 ALA H . 10016 1 467 . 1 1 142 142 ALA C C 13 179.05 0.02 . 1 . . . . 699 ALA C . 10016 1 468 . 1 1 142 142 ALA CA C 13 54.54 0.11 . 1 . . . . 699 ALA CA . 10016 1 469 . 1 1 142 142 ALA CB C 13 17.22 0.09 . 1 . . . . 699 ALA CB . 10016 1 470 . 1 1 142 142 ALA N N 15 125.61 0.07 . 1 . . . . 699 ALA N . 10016 1 471 . 1 1 143 143 ALA H H 1 8.52 0.02 . 1 . . . . 700 ALA H . 10016 1 472 . 1 1 143 143 ALA C C 13 180.93 0.06 . 1 . . . . 700 ALA C . 10016 1 473 . 1 1 143 143 ALA CA C 13 54.63 0.27 . 1 . . . . 700 ALA CA . 10016 1 474 . 1 1 143 143 ALA CB C 13 18.77 0.2 . 1 . . . . 700 ALA CB . 10016 1 475 . 1 1 143 143 ALA N N 15 122.58 0.2 . 1 . . . . 700 ALA N . 10016 1 476 . 1 1 144 144 GLN H H 1 8.77 0.02 . 1 . . . . 701 GLN H . 10016 1 477 . 1 1 144 144 GLN C C 13 179.73 0.05 . 1 . . . . 701 GLN C . 10016 1 478 . 1 1 144 144 GLN CA C 13 58.34 0.1 . 1 . . . . 701 GLN CA . 10016 1 479 . 1 1 144 144 GLN CB C 13 26.64 0.15 . 1 . . . . 701 GLN CB . 10016 1 480 . 1 1 144 144 GLN N N 15 122.37 0.19 . 1 . . . . 701 GLN N . 10016 1 481 . 1 1 145 145 ALA H H 1 8.02 0.02 . 1 . . . . 702 ALA H . 10016 1 482 . 1 1 145 145 ALA C C 13 179.14 0.03 . 1 . . . . 702 ALA C . 10016 1 483 . 1 1 145 145 ALA CA C 13 54.3 0.04 . 1 . . . . 702 ALA CA . 10016 1 484 . 1 1 145 145 ALA CB C 13 17.73 0.43 . 1 . . . . 702 ALA CB . 10016 1 485 . 1 1 145 145 ALA N N 15 126.61 0.13 . 1 . . . . 702 ALA N . 10016 1 486 . 1 1 146 146 ALA H H 1 8.05 0.02 . 1 . . . . 703 ALA H . 10016 1 487 . 1 1 146 146 ALA C C 13 176.75 0.02 . 1 . . . . 703 ALA C . 10016 1 488 . 1 1 146 146 ALA CA C 13 51.59 0.14 . 1 . . . . 703 ALA CA . 10016 1 489 . 1 1 146 146 ALA CB C 13 19.69 0.54 . 1 . . . . 703 ALA CB . 10016 1 490 . 1 1 146 146 ALA N N 15 119.91 0.14 . 1 . . . . 703 ALA N . 10016 1 491 . 1 1 147 147 GLY H H 1 7.65 0.02 . 1 . . . . 704 GLY H . 10016 1 492 . 1 1 147 147 GLY C C 13 174.75 0.07 . 1 . . . . 704 GLY C . 10016 1 493 . 1 1 147 147 GLY CA C 13 45.82 0.14 . 1 . . . . 704 GLY CA . 10016 1 494 . 1 1 147 147 GLY N N 15 107.47 0.12 . 1 . . . . 704 GLY N . 10016 1 495 . 1 1 148 148 ILE H H 1 8.27 0.02 . 1 . . . . 705 ILE H . 10016 1 496 . 1 1 148 148 ILE C C 13 173.6 0.09 . 1 . . . . 705 ILE C . 10016 1 497 . 1 1 148 148 ILE CA C 13 57.5 0.04 . 1 . . . . 705 ILE CA . 10016 1 498 . 1 1 148 148 ILE CB C 13 41.6 0.63 . 1 . . . . 705 ILE CB . 10016 1 499 . 1 1 148 148 ILE N N 15 117.53 0.17 . 1 . . . . 705 ILE N . 10016 1 500 . 1 1 149 149 HIS H H 1 7.05 0.02 . 1 . . . . 706 HIS H . 10016 1 501 . 1 1 149 149 HIS C C 13 175.3 0.21 . 1 . . . . 706 HIS C . 10016 1 502 . 1 1 149 149 HIS CA C 13 59.51 0.09 . 1 . . . . 706 HIS CA . 10016 1 503 . 1 1 149 149 HIS CB C 13 30.66 0.15 . 1 . . . . 706 HIS CB . 10016 1 504 . 1 1 149 149 HIS N N 15 126.78 0.15 . 1 . . . . 706 HIS N . 10016 1 505 . 1 1 150 150 ASP H H 1 8.3 0.02 . 1 . . . . 707 ASP H . 10016 1 506 . 1 1 150 150 ASP C C 13 178.64 0.05 . 1 . . . . 707 ASP C . 10016 1 507 . 1 1 150 150 ASP CA C 13 56.95 0.02 . 1 . . . . 707 ASP CA . 10016 1 508 . 1 1 150 150 ASP CB C 13 38.46 0.21 . 1 . . . . 707 ASP CB . 10016 1 509 . 1 1 150 150 ASP N N 15 118.69 0.11 . 1 . . . . 707 ASP N . 10016 1 510 . 1 1 151 151 ALA H H 1 7.52 0.02 . 1 . . . . 708 ALA H . 10016 1 511 . 1 1 151 151 ALA C C 13 179.27 0.03 . 1 . . . . 708 ALA C . 10016 1 512 . 1 1 151 151 ALA CA C 13 53.77 0.08 . 1 . . . . 708 ALA CA . 10016 1 513 . 1 1 151 151 ALA CB C 13 16.63 0.02 . 1 . . . . 708 ALA CB . 10016 1 514 . 1 1 151 151 ALA N N 15 124.85 0.16 . 1 . . . . 708 ALA N . 10016 1 515 . 1 1 152 152 ILE H H 1 7.21 0.02 . 1 . . . . 709 ILE H . 10016 1 516 . 1 1 152 152 ILE C C 13 178.26 0.02 . 1 . . . . 709 ILE C . 10016 1 517 . 1 1 152 152 ILE CA C 13 62.93 0.02 . 1 . . . . 709 ILE CA . 10016 1 518 . 1 1 152 152 ILE CB C 13 36.04 0.26 . 1 . . . . 709 ILE CB . 10016 1 519 . 1 1 152 152 ILE N N 15 120.41 0.21 . 1 . . . . 709 ILE N . 10016 1 520 . 1 1 153 153 MET H H 1 7.6 0.02 . 1 . . . . 710 MET H . 10016 1 521 . 1 1 153 153 MET C C 13 177.54 0.02 . 1 . . . . 710 MET C . 10016 1 522 . 1 1 153 153 MET CA C 13 54.39 0.06 . 1 . . . . 710 MET CA . 10016 1 523 . 1 1 153 153 MET CB C 13 29.07 0.66 . 1 . . . . 710 MET CB . 10016 1 524 . 1 1 153 153 MET N N 15 116.77 0.14 . 1 . . . . 710 MET N . 10016 1 525 . 1 1 154 154 ALA H H 1 6.92 0.02 . 1 . . . . 711 ALA H . 10016 1 526 . 1 1 154 154 ALA C C 13 178.6 0.02 . 1 . . . . 711 ALA C . 10016 1 527 . 1 1 154 154 ALA CA C 13 51.15 0.11 . 1 . . . . 711 ALA CA . 10016 1 528 . 1 1 154 154 ALA CB C 13 17.73 0.02 . 1 . . . . 711 ALA CB . 10016 1 529 . 1 1 154 154 ALA N N 15 122.36 0.15 . 1 . . . . 711 ALA N . 10016 1 530 . 1 1 155 155 PHE H H 1 7.66 0.02 . 1 . . . . 712 PHE H . 10016 1 531 . 1 1 155 155 PHE C C 13 176.84 0.02 . 1 . . . . 712 PHE C . 10016 1 532 . 1 1 155 155 PHE CA C 13 52.82 0.02 . 1 . . . . 712 PHE CA . 10016 1 533 . 1 1 155 155 PHE CB C 13 35.83 0.02 . 1 . . . . 712 PHE CB . 10016 1 534 . 1 1 155 155 PHE N N 15 124.41 0.15 . 1 . . . . 712 PHE N . 10016 1 535 . 1 1 156 156 PRO CA C 13 65.44 0.02 . 1 . . . . 713 PRO CA . 10016 1 536 . 1 1 156 156 PRO CB C 13 30.91 0.02 . 1 . . . . 713 PRO CB . 10016 1 537 . 1 1 157 157 GLU H H 1 7.61 0.02 . 1 . . . . 714 GLU H . 10016 1 538 . 1 1 157 157 GLU C C 13 177.61 0.02 . 1 . . . . 714 GLU C . 10016 1 539 . 1 1 157 157 GLU CA C 13 54.13 0.14 . 1 . . . . 714 GLU CA . 10016 1 540 . 1 1 157 157 GLU CB C 13 28.68 0.02 . 1 . . . . 714 GLU CB . 10016 1 541 . 1 1 157 157 GLU N N 15 114.39 0.16 . 1 . . . . 714 GLU N . 10016 1 542 . 1 1 158 158 GLY H H 1 7.59 0.02 . 1 . . . . 715 GLY H . 10016 1 543 . 1 1 158 158 GLY C C 13 178.07 0.02 . 1 . . . . 715 GLY C . 10016 1 544 . 1 1 158 158 GLY CA C 13 45.89 0.05 . 1 . . . . 715 GLY CA . 10016 1 545 . 1 1 158 158 GLY N N 15 111.14 0.11 . 1 . . . . 715 GLY N . 10016 1 546 . 1 1 159 159 TYR H H 1 9.39 0.02 . 1 . . . . 716 TYR H . 10016 1 547 . 1 1 159 159 TYR C C 13 175.63 0.07 . 1 . . . . 716 TYR C . 10016 1 548 . 1 1 159 159 TYR CA C 13 62.15 0.11 . 1 . . . . 716 TYR CA . 10016 1 549 . 1 1 159 159 TYR CB C 13 37.81 0.02 . 1 . . . . 716 TYR CB . 10016 1 550 . 1 1 159 159 TYR N N 15 128.88 0.15 . 1 . . . . 716 TYR N . 10016 1 551 . 1 1 160 160 ARG H H 1 7.88 0.02 . 1 . . . . 717 ARG H . 10016 1 552 . 1 1 160 160 ARG C C 13 175.15 0.02 . 1 . . . . 717 ARG C . 10016 1 553 . 1 1 160 160 ARG CA C 13 55.12 0.12 . 1 . . . . 717 ARG CA . 10016 1 554 . 1 1 160 160 ARG CB C 13 28.41 0.13 . 1 . . . . 717 ARG CB . 10016 1 555 . 1 1 160 160 ARG N N 15 118.25 0.07 . 1 . . . . 717 ARG N . 10016 1 556 . 1 1 161 161 THR H H 1 7.42 0.02 . 1 . . . . 718 THR H . 10016 1 557 . 1 1 161 161 THR C C 13 174.17 0.1 . 1 . . . . 718 THR C . 10016 1 558 . 1 1 161 161 THR CA C 13 64.38 0.09 . 1 . . . . 718 THR CA . 10016 1 559 . 1 1 161 161 THR CB C 13 69.21 0.18 . 1 . . . . 718 THR CB . 10016 1 560 . 1 1 161 161 THR N N 15 119.67 0.14 . 1 . . . . 718 THR N . 10016 1 561 . 1 1 162 162 GLN H H 1 8.84 0.02 . 1 . . . . 719 GLN H . 10016 1 562 . 1 1 162 162 GLN C C 13 176.17 0.08 . 1 . . . . 719 GLN C . 10016 1 563 . 1 1 162 162 GLN CA C 13 55.79 0.02 . 1 . . . . 719 GLN CA . 10016 1 564 . 1 1 162 162 GLN CB C 13 26.86 0.22 . 1 . . . . 719 GLN CB . 10016 1 565 . 1 1 162 162 GLN N N 15 129.7 0.2 . 1 . . . . 719 GLN N . 10016 1 566 . 1 1 163 163 VAL H H 1 8.15 0.02 . 1 . . . . 720 VAL H . 10016 1 567 . 1 1 163 163 VAL C C 13 174.38 0.03 . 1 . . . . 720 VAL C . 10016 1 568 . 1 1 163 163 VAL CA C 13 59.43 0.05 . 1 . . . . 720 VAL CA . 10016 1 569 . 1 1 163 163 VAL CB C 13 32.53 0.32 . 1 . . . . 720 VAL CB . 10016 1 570 . 1 1 163 163 VAL N N 15 121.24 0.1 . 1 . . . . 720 VAL N . 10016 1 571 . 1 1 164 164 GLY H H 1 7.96 0.02 . 1 . . . . 721 GLY H . 10016 1 572 . 1 1 164 164 GLY C C 13 175.27 0.02 . 1 . . . . 721 GLY C . 10016 1 573 . 1 1 164 164 GLY CA C 13 43.3 0.06 . 1 . . . . 721 GLY CA . 10016 1 574 . 1 1 164 164 GLY N N 15 108.26 0.17 . 1 . . . . 721 GLY N . 10016 1 575 . 1 1 165 165 GLU H H 1 8.28 0.02 . 1 . . . . 722 GLU H . 10016 1 576 . 1 1 165 165 GLU C C 13 177.95 0.02 . 1 . . . . 722 GLU C . 10016 1 577 . 1 1 165 165 GLU CA C 13 58.41 0.02 . 1 . . . . 722 GLU CA . 10016 1 578 . 1 1 165 165 GLU CB C 13 29.2 0.02 . 1 . . . . 722 GLU CB . 10016 1 579 . 1 1 165 165 GLU N N 15 123.61 0.09 . 1 . . . . 722 GLU N . 10016 1 580 . 1 1 166 166 ARG C C 13 175.84 0.02 . 1 . . . . 723 ARG C . 10016 1 581 . 1 1 166 166 ARG CA C 13 55.01 0.02 . 1 . . . . 723 ARG CA . 10016 1 582 . 1 1 166 166 ARG CB C 13 28.31 0.02 . 1 . . . . 723 ARG CB . 10016 1 583 . 1 1 167 167 GLY H H 1 7.27 0.02 . 1 . . . . 724 GLY H . 10016 1 584 . 1 1 167 167 GLY C C 13 172.41 0.04 . 1 . . . . 724 GLY C . 10016 1 585 . 1 1 167 167 GLY CA C 13 43.24 0.25 . 1 . . . . 724 GLY CA . 10016 1 586 . 1 1 167 167 GLY N N 15 111 0.14 . 1 . . . . 724 GLY N . 10016 1 587 . 1 1 168 168 LEU H H 1 8.14 0.02 . 1 . . . . 725 LEU H . 10016 1 588 . 1 1 168 168 LEU C C 13 176.02 0.03 . 1 . . . . 725 LEU C . 10016 1 589 . 1 1 168 168 LEU CA C 13 54.88 0.04 . 1 . . . . 725 LEU CA . 10016 1 590 . 1 1 168 168 LEU CB C 13 41.28 0.19 . 1 . . . . 725 LEU CB . 10016 1 591 . 1 1 168 168 LEU N N 15 127.96 0.04 . 1 . . . . 725 LEU N . 10016 1 592 . 1 1 169 169 LYS H H 1 8.17 0.02 . 1 . . . . 726 LYS H . 10016 1 593 . 1 1 169 169 LYS C C 13 175.84 0.09 . 1 . . . . 726 LYS C . 10016 1 594 . 1 1 169 169 LYS CA C 13 55.12 0.14 . 1 . . . . 726 LYS CA . 10016 1 595 . 1 1 169 169 LYS CB C 13 30.93 0.47 . 1 . . . . 726 LYS CB . 10016 1 596 . 1 1 169 169 LYS N N 15 127.55 0.11 . 1 . . . . 726 LYS N . 10016 1 597 . 1 1 170 170 LEU H H 1 7.94 0.02 . 1 . . . . 727 LEU H . 10016 1 598 . 1 1 170 170 LEU C C 13 176.97 0.02 . 1 . . . . 727 LEU C . 10016 1 599 . 1 1 170 170 LEU CA C 13 53.35 0.18 . 1 . . . . 727 LEU CA . 10016 1 600 . 1 1 170 170 LEU CB C 13 41.82 0.29 . 1 . . . . 727 LEU CB . 10016 1 601 . 1 1 170 170 LEU N N 15 128.33 0.23 . 1 . . . . 727 LEU N . 10016 1 602 . 1 1 171 171 SER H H 1 9.19 0.02 . 1 . . . . 728 SER H . 10016 1 603 . 1 1 171 171 SER C C 13 174.97 0.02 . 1 . . . . 728 SER C . 10016 1 604 . 1 1 171 171 SER CA C 13 56.82 0.02 . 1 . . . . 728 SER CA . 10016 1 605 . 1 1 171 171 SER CB C 13 64.84 0.02 . 1 . . . . 728 SER CB . 10016 1 606 . 1 1 171 171 SER N N 15 120.81 0.17 . 1 . . . . 728 SER N . 10016 1 607 . 1 1 173 173 GLY C C 13 176.19 0.02 . 1 . . . . 730 GLY C . 10016 1 608 . 1 1 173 173 GLY CA C 13 46.4 0.02 . 1 . . . . 730 GLY CA . 10016 1 609 . 1 1 174 174 GLU H H 1 7.6 0.02 . 1 . . . . 731 GLU H . 10016 1 610 . 1 1 174 174 GLU C C 13 178.72 0.15 . 1 . . . . 731 GLU C . 10016 1 611 . 1 1 174 174 GLU CA C 13 59.06 0.07 . 1 . . . . 731 GLU CA . 10016 1 612 . 1 1 174 174 GLU CB C 13 29.09 0.05 . 1 . . . . 731 GLU CB . 10016 1 613 . 1 1 174 174 GLU N N 15 124.02 0.1 . 1 . . . . 731 GLU N . 10016 1 614 . 1 1 175 175 LYS H H 1 8.6 0.02 . 1 . . . . 732 LYS H . 10016 1 615 . 1 1 175 175 LYS C C 13 178.78 0.08 . 1 . . . . 732 LYS C . 10016 1 616 . 1 1 175 175 LYS CA C 13 60.77 0.1 . 1 . . . . 732 LYS CA . 10016 1 617 . 1 1 175 175 LYS CB C 13 31.31 0.02 . 1 . . . . 732 LYS CB . 10016 1 618 . 1 1 175 175 LYS N N 15 120.46 0.1 . 1 . . . . 732 LYS N . 10016 1 619 . 1 1 176 176 GLN H H 1 8 0.02 . 1 . . . . 733 GLN H . 10016 1 620 . 1 1 176 176 GLN C C 13 178.9 0.04 . 1 . . . . 733 GLN C . 10016 1 621 . 1 1 176 176 GLN CA C 13 57.84 0.02 . 1 . . . . 733 GLN CA . 10016 1 622 . 1 1 176 176 GLN N N 15 119.67 0.12 . 1 . . . . 733 GLN N . 10016 1 623 . 1 1 177 177 ARG H H 1 7.76 0.02 . 1 . . . . 734 ARG H . 10016 1 624 . 1 1 177 177 ARG C C 13 178.81 0.04 . 1 . . . . 734 ARG C . 10016 1 625 . 1 1 177 177 ARG CA C 13 59.68 0.06 . 1 . . . . 734 ARG CA . 10016 1 626 . 1 1 177 177 ARG CB C 13 29.1 0.02 . 1 . . . . 734 ARG CB . 10016 1 627 . 1 1 177 177 ARG N N 15 120.1 0.22 . 1 . . . . 734 ARG N . 10016 1 628 . 1 1 178 178 VAL H H 1 8.09 0.02 . 1 . . . . 735 VAL H . 10016 1 629 . 1 1 178 178 VAL C C 13 177.34 0.03 . 1 . . . . 735 VAL C . 10016 1 630 . 1 1 178 178 VAL CA C 13 67.01 0.07 . 1 . . . . 735 VAL CA . 10016 1 631 . 1 1 178 178 VAL CB C 13 29.75 0.1 . 1 . . . . 735 VAL CB . 10016 1 632 . 1 1 178 178 VAL N N 15 123.84 0.11 . 1 . . . . 735 VAL N . 10016 1 633 . 1 1 179 179 ALA H H 1 7.78 0.02 . 1 . . . . 736 ALA H . 10016 1 634 . 1 1 179 179 ALA C C 13 181.66 0.13 . 1 . . . . 736 ALA C . 10016 1 635 . 1 1 179 179 ALA CA C 13 55.22 0.06 . 1 . . . . 736 ALA CA . 10016 1 636 . 1 1 179 179 ALA CB C 13 17.66 0.49 . 1 . . . . 736 ALA CB . 10016 1 637 . 1 1 179 179 ALA N N 15 124.22 0.16 . 1 . . . . 736 ALA N . 10016 1 638 . 1 1 180 180 ILE H H 1 8.15 0.03 . 1 . . . . 737 ILE H . 10016 1 639 . 1 1 180 180 ILE C C 13 176.9 0.02 . 1 . . . . 737 ILE C . 10016 1 640 . 1 1 180 180 ILE CA C 13 65.64 0.02 . 1 . . . . 737 ILE CA . 10016 1 641 . 1 1 180 180 ILE N N 15 122.71 0.13 . 1 . . . . 737 ILE N . 10016 1 642 . 1 1 181 181 ALA H H 1 8.57 0.02 . 1 . . . . 738 ALA H . 10016 1 643 . 1 1 181 181 ALA C C 13 178.67 0.04 . 1 . . . . 738 ALA C . 10016 1 644 . 1 1 181 181 ALA CA C 13 54.98 0.06 . 1 . . . . 738 ALA CA . 10016 1 645 . 1 1 181 181 ALA CB C 13 17.36 0.02 . 1 . . . . 738 ALA CB . 10016 1 646 . 1 1 181 181 ALA N N 15 125.73 0.17 . 1 . . . . 738 ALA N . 10016 1 647 . 1 1 182 182 ARG H H 1 8.59 0.02 . 1 . . . . 739 ARG H . 10016 1 648 . 1 1 182 182 ARG C C 13 178.53 0.02 . 1 . . . . 739 ARG C . 10016 1 649 . 1 1 182 182 ARG CA C 13 59.15 0.13 . 1 . . . . 739 ARG CA . 10016 1 650 . 1 1 182 182 ARG CB C 13 30.41 0.02 . 1 . . . . 739 ARG CB . 10016 1 651 . 1 1 182 182 ARG N N 15 117.94 0.17 . 1 . . . . 739 ARG N . 10016 1 652 . 1 1 183 183 THR H H 1 7.55 0.02 . 1 . . . . 740 THR H . 10016 1 653 . 1 1 183 183 THR C C 13 175.88 0.02 . 1 . . . . 740 THR C . 10016 1 654 . 1 1 183 183 THR CA C 13 66.77 0.02 . 1 . . . . 740 THR CA . 10016 1 655 . 1 1 183 183 THR N N 15 118.27 0.04 . 1 . . . . 740 THR N . 10016 1 656 . 1 1 184 184 ILE H H 1 8.49 0.02 . 1 . . . . 741 ILE H . 10016 1 657 . 1 1 184 184 ILE CA C 13 64.58 0.02 . 1 . . . . 741 ILE CA . 10016 1 658 . 1 1 184 184 ILE CB C 13 37.72 0.02 . 1 . . . . 741 ILE CB . 10016 1 659 . 1 1 184 184 ILE N N 15 125.23 0.02 . 1 . . . . 741 ILE N . 10016 1 660 . 1 1 185 185 LEU CA C 13 56.56 0.02 . 1 . . . . 742 LEU CA . 10016 1 661 . 1 1 185 185 LEU CB C 13 41.05 0.02 . 1 . . . . 742 LEU CB . 10016 1 662 . 1 1 186 186 LYS H H 1 7.71 0.02 . 1 . . . . 743 LYS H . 10016 1 663 . 1 1 186 186 LYS C C 13 175.44 0.02 . 1 . . . . 743 LYS C . 10016 1 664 . 1 1 186 186 LYS CA C 13 58.64 0.02 . 1 . . . . 743 LYS CA . 10016 1 665 . 1 1 186 186 LYS CB C 13 31.99 0.11 . 1 . . . . 743 LYS CB . 10016 1 666 . 1 1 186 186 LYS N N 15 121.98 0.04 . 1 . . . . 743 LYS N . 10016 1 667 . 1 1 187 187 ALA H H 1 8.1 0.02 . 1 . . . . 744 ALA H . 10016 1 668 . 1 1 187 187 ALA C C 13 173.75 0.02 . 1 . . . . 744 ALA C . 10016 1 669 . 1 1 187 187 ALA CA C 13 51.66 0.02 . 1 . . . . 744 ALA CA . 10016 1 670 . 1 1 187 187 ALA CB C 13 16.15 0.02 . 1 . . . . 744 ALA CB . 10016 1 671 . 1 1 187 187 ALA N N 15 120.45 0.25 . 1 . . . . 744 ALA N . 10016 1 672 . 1 1 189 189 GLY C C 13 173.27 0.02 . 1 . . . . 746 GLY C . 10016 1 673 . 1 1 189 189 GLY CA C 13 45.27 0.02 . 1 . . . . 746 GLY CA . 10016 1 674 . 1 1 190 190 ILE H H 1 7.82 0.02 . 1 . . . . 747 ILE H . 10016 1 675 . 1 1 190 190 ILE C C 13 173.82 0.02 . 1 . . . . 747 ILE C . 10016 1 676 . 1 1 190 190 ILE CA C 13 58.88 0.12 . 1 . . . . 747 ILE CA . 10016 1 677 . 1 1 190 190 ILE CB C 13 40.66 0.17 . 1 . . . . 747 ILE CB . 10016 1 678 . 1 1 190 190 ILE N N 15 122.51 0.12 . 1 . . . . 747 ILE N . 10016 1 679 . 1 1 191 191 ILE H H 1 9.1 0.02 . 1 . . . . 748 ILE H . 10016 1 680 . 1 1 191 191 ILE C C 13 173.2 0.02 . 1 . . . . 748 ILE C . 10016 1 681 . 1 1 191 191 ILE CA C 13 57.99 0.28 . 1 . . . . 748 ILE CA . 10016 1 682 . 1 1 191 191 ILE CB C 13 38.13 0.73 . 1 . . . . 748 ILE CB . 10016 1 683 . 1 1 191 191 ILE N N 15 129.47 0.17 . 1 . . . . 748 ILE N . 10016 1 684 . 1 1 192 192 LEU H H 1 8.75 0.02 . 1 . . . . 749 LEU H . 10016 1 685 . 1 1 192 192 LEU C C 13 174.78 0.02 . 1 . . . . 749 LEU C . 10016 1 686 . 1 1 192 192 LEU CA C 13 51.72 0.07 . 1 . . . . 749 LEU CA . 10016 1 687 . 1 1 192 192 LEU CB C 13 41.01 0.18 . 1 . . . . 749 LEU CB . 10016 1 688 . 1 1 192 192 LEU N N 15 126.84 0.18 . 1 . . . . 749 LEU N . 10016 1 689 . 1 1 193 193 LEU H H 1 8.99 0.02 . 1 . . . . 750 LEU H . 10016 1 690 . 1 1 193 193 LEU C C 13 174 0.02 . 1 . . . . 750 LEU C . 10016 1 691 . 1 1 193 193 LEU CA C 13 52.61 0.26 . 1 . . . . 750 LEU CA . 10016 1 692 . 1 1 193 193 LEU CB C 13 42.4 0.42 . 1 . . . . 750 LEU CB . 10016 1 693 . 1 1 193 193 LEU N N 15 126.22 0.11 . 1 . . . . 750 LEU N . 10016 1 694 . 1 1 194 194 ASP H H 1 8.07 0.02 . 1 . . . . 751 ASP H . 10016 1 695 . 1 1 194 194 ASP CA C 13 51.73 0.02 . 1 . . . . 751 ASP CA . 10016 1 696 . 1 1 194 194 ASP CB C 13 41.17 0.02 . 1 . . . . 751 ASP CB . 10016 1 697 . 1 1 194 194 ASP N N 15 126.31 0.2 . 1 . . . . 751 ASP N . 10016 1 698 . 1 1 200 200 LEU C C 13 176.56 0.02 . 1 . . . . 757 LEU C . 10016 1 699 . 1 1 200 200 LEU CA C 13 53.45 0.02 . 1 . . . . 757 LEU CA . 10016 1 700 . 1 1 200 200 LEU CB C 13 41.76 0.02 . 1 . . . . 757 LEU CB . 10016 1 701 . 1 1 201 201 ASP H H 1 8.12 0.02 . 1 . . . . 758 ASP H . 10016 1 702 . 1 1 201 201 ASP C C 13 175.97 0.02 . 1 . . . . 758 ASP C . 10016 1 703 . 1 1 201 201 ASP CA C 13 52.72 0.02 . 1 . . . . 758 ASP CA . 10016 1 704 . 1 1 201 201 ASP CB C 13 40.46 0.02 . 1 . . . . 758 ASP CB . 10016 1 705 . 1 1 201 201 ASP N N 15 121.84 0.18 . 1 . . . . 758 ASP N . 10016 1 706 . 1 1 209 209 GLN C C 13 178.56 0.02 . 1 . . . . 766 GLN C . 10016 1 707 . 1 1 209 209 GLN CA C 13 54.49 0.02 . 1 . . . . 766 GLN CA . 10016 1 708 . 1 1 210 210 ALA H H 1 7.85 0.02 . 1 . . . . 767 ALA H . 10016 1 709 . 1 1 210 210 ALA C C 13 180.33 0.23 . 1 . . . . 767 ALA C . 10016 1 710 . 1 1 210 210 ALA CA C 13 54.31 0.02 . 1 . . . . 767 ALA CA . 10016 1 711 . 1 1 210 210 ALA N N 15 123.78 0.13 . 1 . . . . 767 ALA N . 10016 1 712 . 1 1 211 211 SER H H 1 7.76 0.02 . 1 . . . . 768 SER H . 10016 1 713 . 1 1 211 211 SER CA C 13 61.78 0.15 . 1 . . . . 768 SER CA . 10016 1 714 . 1 1 211 211 SER N N 15 117.87 0.11 . 1 . . . . 768 SER N . 10016 1 715 . 1 1 212 212 LEU H H 1 8.46 0.02 . 1 . . . . 769 LEU H . 10016 1 716 . 1 1 212 212 LEU C C 13 178.22 0.06 . 1 . . . . 769 LEU C . 10016 1 717 . 1 1 212 212 LEU CA C 13 56.68 0.09 . 1 . . . . 769 LEU CA . 10016 1 718 . 1 1 212 212 LEU CB C 13 40.66 1.08 . 1 . . . . 769 LEU CB . 10016 1 719 . 1 1 212 212 LEU N N 15 124.56 0.05 . 1 . . . . 769 LEU N . 10016 1 720 . 1 1 213 213 ALA H H 1 8.06 0.02 . 1 . . . . 770 ALA H . 10016 1 721 . 1 1 213 213 ALA C C 13 180.3 0.03 . 1 . . . . 770 ALA C . 10016 1 722 . 1 1 213 213 ALA CA C 13 54.26 0.07 . 1 . . . . 770 ALA CA . 10016 1 723 . 1 1 213 213 ALA CB C 13 16.92 0.02 . 1 . . . . 770 ALA CB . 10016 1 724 . 1 1 213 213 ALA N N 15 123.52 0.22 . 1 . . . . 770 ALA N . 10016 1 725 . 1 1 214 214 LYS H H 1 7.19 0.03 . 1 . . . . 771 LYS H . 10016 1 726 . 1 1 214 214 LYS C C 13 178.9 0.15 . 1 . . . . 771 LYS C . 10016 1 727 . 1 1 214 214 LYS CA C 13 58.02 0.07 . 1 . . . . 771 LYS CA . 10016 1 728 . 1 1 214 214 LYS CB C 13 30.73 0.02 . 1 . . . . 771 LYS CB . 10016 1 729 . 1 1 214 214 LYS N N 15 117.96 0.24 . 1 . . . . 771 LYS N . 10016 1 730 . 1 1 215 215 VAL H H 1 7.57 0.02 . 1 . . . . 772 VAL H . 10016 1 731 . 1 1 215 215 VAL CA C 13 63.82 0.02 . 1 . . . . 772 VAL CA . 10016 1 732 . 1 1 215 215 VAL CB C 13 31.26 0.02 . 1 . . . . 772 VAL CB . 10016 1 733 . 1 1 215 215 VAL N N 15 120.6 0.09 . 1 . . . . 772 VAL N . 10016 1 734 . 1 1 217 217 ALA C C 13 177.74 0.1 . 1 . . . . 774 ALA C . 10016 1 735 . 1 1 217 217 ALA CA C 13 53.21 0.02 . 1 . . . . 774 ALA CA . 10016 1 736 . 1 1 217 217 ALA CB C 13 17.53 0.02 . 1 . . . . 774 ALA CB . 10016 1 737 . 1 1 218 218 ASN H H 1 8.86 0.03 . 1 . . . . 775 ASN H . 10016 1 738 . 1 1 218 218 ASN C C 13 173.76 0.14 . 1 . . . . 775 ASN C . 10016 1 739 . 1 1 218 218 ASN CA C 13 54.05 0.12 . 1 . . . . 775 ASN CA . 10016 1 740 . 1 1 218 218 ASN CB C 13 37.17 0.04 . 1 . . . . 775 ASN CB . 10016 1 741 . 1 1 218 218 ASN N N 15 117.09 0.14 . 1 . . . . 775 ASN N . 10016 1 742 . 1 1 219 219 ARG H H 1 7.86 0.02 . 1 . . . . 776 ARG H . 10016 1 743 . 1 1 219 219 ARG C C 13 175.62 0.04 . 1 . . . . 776 ARG C . 10016 1 744 . 1 1 219 219 ARG CA C 13 54.22 0.05 . 1 . . . . 776 ARG CA . 10016 1 745 . 1 1 219 219 ARG CB C 13 31.55 0.46 . 1 . . . . 776 ARG CB . 10016 1 746 . 1 1 219 219 ARG N N 15 120.82 0.09 . 1 . . . . 776 ARG N . 10016 1 747 . 1 1 220 220 THR H H 1 8.12 0.02 . 1 . . . . 777 THR H . 10016 1 748 . 1 1 220 220 THR C C 13 172.88 0.02 . 1 . . . . 777 THR C . 10016 1 749 . 1 1 220 220 THR CA C 13 63.41 0.13 . 1 . . . . 777 THR CA . 10016 1 750 . 1 1 220 220 THR CB C 13 68.96 0.02 . 1 . . . . 777 THR CB . 10016 1 751 . 1 1 220 220 THR N N 15 123.42 0.12 . 1 . . . . 777 THR N . 10016 1 752 . 1 1 221 221 THR H H 1 8.87 0.02 . 1 . . . . 778 THR H . 10016 1 753 . 1 1 221 221 THR C C 13 173.41 0.07 . 1 . . . . 778 THR C . 10016 1 754 . 1 1 221 221 THR CA C 13 61.45 0.16 . 1 . . . . 778 THR CA . 10016 1 755 . 1 1 221 221 THR CB C 13 70.97 0.53 . 1 . . . . 778 THR CB . 10016 1 756 . 1 1 221 221 THR N N 15 127.96 0.09 . 1 . . . . 778 THR N . 10016 1 757 . 1 1 222 222 ILE H H 1 8.66 0.02 . 1 . . . . 779 ILE H . 10016 1 758 . 1 1 222 222 ILE C C 13 173.65 0.1 . 1 . . . . 779 ILE C . 10016 1 759 . 1 1 222 222 ILE CA C 13 59.3 0.21 . 1 . . . . 779 ILE CA . 10016 1 760 . 1 1 222 222 ILE CB C 13 38.31 0.33 . 1 . . . . 779 ILE CB . 10016 1 761 . 1 1 222 222 ILE N N 15 126.71 0.18 . 1 . . . . 779 ILE N . 10016 1 762 . 1 1 223 223 VAL H H 1 9.12 0.02 . 1 . . . . 780 VAL H . 10016 1 763 . 1 1 223 223 VAL C C 13 173.99 0.08 . 1 . . . . 780 VAL C . 10016 1 764 . 1 1 223 223 VAL CA C 13 58.2 0.1 . 1 . . . . 780 VAL CA . 10016 1 765 . 1 1 223 223 VAL CB C 13 34.12 0.02 . 1 . . . . 780 VAL CB . 10016 1 766 . 1 1 223 223 VAL N N 15 127.91 0.14 . 1 . . . . 780 VAL N . 10016 1 767 . 1 1 224 224 VAL H H 1 8.79 0.02 . 1 . . . . 781 VAL H . 10016 1 768 . 1 1 224 224 VAL C C 13 174.85 0.02 . 1 . . . . 781 VAL C . 10016 1 769 . 1 1 224 224 VAL CA C 13 61.21 0.05 . 1 . . . . 781 VAL CA . 10016 1 770 . 1 1 224 224 VAL CB C 13 31.41 0.42 . 1 . . . . 781 VAL CB . 10016 1 771 . 1 1 224 224 VAL N N 15 129.77 0.02 . 1 . . . . 781 VAL N . 10016 1 772 . 1 1 225 225 ALA H H 1 7.87 0.02 . 1 . . . . 782 ALA H . 10016 1 773 . 1 1 225 225 ALA C C 13 175.68 0.02 . 1 . . . . 782 ALA C . 10016 1 774 . 1 1 225 225 ALA CA C 13 50.48 0.02 . 1 . . . . 782 ALA CA . 10016 1 775 . 1 1 225 225 ALA CB C 13 21.97 0.02 . 1 . . . . 782 ALA CB . 10016 1 776 . 1 1 225 225 ALA N N 15 130.54 0.11 . 1 . . . . 782 ALA N . 10016 1 777 . 1 1 230 230 THR C C 13 176.26 0.02 . 1 . . . . 787 THR C . 10016 1 778 . 1 1 230 230 THR CA C 13 63.55 0.02 . 1 . . . . 787 THR CA . 10016 1 779 . 1 1 230 230 THR CB C 13 68.59 0.02 . 1 . . . . 787 THR CB . 10016 1 780 . 1 1 231 231 VAL H H 1 7.65 0.03 . 1 . . . . 788 VAL H . 10016 1 781 . 1 1 231 231 VAL C C 13 175.82 0.04 . 1 . . . . 788 VAL C . 10016 1 782 . 1 1 231 231 VAL CA C 13 60.48 0.02 . 1 . . . . 788 VAL CA . 10016 1 783 . 1 1 231 231 VAL CB C 13 30.9 0.3 . 1 . . . . 788 VAL CB . 10016 1 784 . 1 1 231 231 VAL N N 15 114.83 0.15 . 1 . . . . 788 VAL N . 10016 1 785 . 1 1 232 232 VAL H H 1 6.52 0.04 . 1 . . . . 789 VAL H . 10016 1 786 . 1 1 232 232 VAL C C 13 176.98 0.17 . 1 . . . . 789 VAL C . 10016 1 787 . 1 1 232 232 VAL CA C 13 64.29 0.09 . 1 . . . . 789 VAL CA . 10016 1 788 . 1 1 232 232 VAL CB C 13 30.64 0.02 . 1 . . . . 789 VAL CB . 10016 1 789 . 1 1 232 232 VAL N N 15 116.68 0.25 . 1 . . . . 789 VAL N . 10016 1 790 . 1 1 233 233 ASN H H 1 8.3 0.03 . 1 . . . . 790 ASN H . 10016 1 791 . 1 1 233 233 ASN C C 13 175.29 0.09 . 1 . . . . 790 ASN C . 10016 1 792 . 1 1 233 233 ASN CA C 13 51.91 0.02 . 1 . . . . 790 ASN CA . 10016 1 793 . 1 1 233 233 ASN CB C 13 38 0.27 . 1 . . . . 790 ASN CB . 10016 1 794 . 1 1 233 233 ASN N N 15 118.72 0.11 . 1 . . . . 790 ASN N . 10016 1 795 . 1 1 234 234 ALA H H 1 7.82 0.02 . 1 . . . . 791 ALA H . 10016 1 796 . 1 1 234 234 ALA C C 13 177.07 0.1 . 1 . . . . 791 ALA C . 10016 1 797 . 1 1 234 234 ALA CA C 13 52.87 0.02 . 1 . . . . 791 ALA CA . 10016 1 798 . 1 1 234 234 ALA CB C 13 18.09 0.02 . 1 . . . . 791 ALA CB . 10016 1 799 . 1 1 234 234 ALA N N 15 126.53 0.08 . 1 . . . . 791 ALA N . 10016 1 800 . 1 1 235 235 ASP H H 1 8.16 0.02 . 1 . . . . 792 ASP H . 10016 1 801 . 1 1 235 235 ASP C C 13 175.7 0.02 . 1 . . . . 792 ASP C . 10016 1 802 . 1 1 235 235 ASP CA C 13 57.12 0.02 . 1 . . . . 792 ASP CA . 10016 1 803 . 1 1 235 235 ASP CB C 13 40.97 0.55 . 1 . . . . 792 ASP CB . 10016 1 804 . 1 1 235 235 ASP N N 15 122.78 0.02 . 1 . . . . 792 ASP N . 10016 1 805 . 1 1 236 236 GLN H H 1 7.46 0.02 . 1 . . . . 793 GLN H . 10016 1 806 . 1 1 236 236 GLN C C 13 171.54 0.06 . 1 . . . . 793 GLN C . 10016 1 807 . 1 1 236 236 GLN CA C 13 55.24 0.1 . 1 . . . . 793 GLN CA . 10016 1 808 . 1 1 236 236 GLN CB C 13 32.19 0.23 . 1 . . . . 793 GLN CB . 10016 1 809 . 1 1 236 236 GLN N N 15 115.94 0.15 . 1 . . . . 793 GLN N . 10016 1 810 . 1 1 237 237 ILE H H 1 8.55 0.02 . 1 . . . . 794 ILE H . 10016 1 811 . 1 1 237 237 ILE C C 13 174.41 0.1 . 1 . . . . 794 ILE C . 10016 1 812 . 1 1 237 237 ILE CA C 13 59.97 0.12 . 1 . . . . 794 ILE CA . 10016 1 813 . 1 1 237 237 ILE CB C 13 38.47 0.04 . 1 . . . . 794 ILE CB . 10016 1 814 . 1 1 237 237 ILE N N 15 128.87 0.17 . 1 . . . . 794 ILE N . 10016 1 815 . 1 1 238 238 LEU H H 1 8.91 0.02 . 1 . . . . 795 LEU H . 10016 1 816 . 1 1 238 238 LEU C C 13 174.39 0.1 . 1 . . . . 795 LEU C . 10016 1 817 . 1 1 238 238 LEU CA C 13 52.43 0.04 . 1 . . . . 795 LEU CA . 10016 1 818 . 1 1 238 238 LEU CB C 13 42.1 0.12 . 1 . . . . 795 LEU CB . 10016 1 819 . 1 1 238 238 LEU N N 15 126.78 0.09 . 1 . . . . 795 LEU N . 10016 1 820 . 1 1 239 239 VAL H H 1 8.36 0.02 . 1 . . . . 796 VAL H . 10016 1 821 . 1 1 239 239 VAL C C 13 174.69 0.16 . 1 . . . . 796 VAL C . 10016 1 822 . 1 1 239 239 VAL CA C 13 59.88 0.1 . 1 . . . . 796 VAL CA . 10016 1 823 . 1 1 239 239 VAL CB C 13 30.41 0.08 . 1 . . . . 796 VAL CB . 10016 1 824 . 1 1 239 239 VAL N N 15 124.88 0.16 . 1 . . . . 796 VAL N . 10016 1 825 . 1 1 240 240 ILE H H 1 9.22 0.02 . 1 . . . . 797 ILE H . 10016 1 826 . 1 1 240 240 ILE C C 13 174.15 0.08 . 1 . . . . 797 ILE C . 10016 1 827 . 1 1 240 240 ILE CA C 13 57.58 0.17 . 1 . . . . 797 ILE CA . 10016 1 828 . 1 1 240 240 ILE CB C 13 37.23 0.02 . 1 . . . . 797 ILE CB . 10016 1 829 . 1 1 240 240 ILE N N 15 131.67 0.12 . 1 . . . . 797 ILE N . 10016 1 830 . 1 1 241 241 LYS H H 1 8.78 0.02 . 1 . . . . 798 LYS H . 10016 1 831 . 1 1 241 241 LYS C C 13 176.02 0.02 . 1 . . . . 798 LYS C . 10016 1 832 . 1 1 241 241 LYS CA C 13 55.4 0.02 . 1 . . . . 798 LYS CA . 10016 1 833 . 1 1 241 241 LYS CB C 13 35.48 0.02 . 1 . . . . 798 LYS CB . 10016 1 834 . 1 1 241 241 LYS N N 15 126.63 0.13 . 1 . . . . 798 LYS N . 10016 1 835 . 1 1 242 242 ASP H H 1 9.35 0.02 . 1 . . . . 799 ASP H . 10016 1 836 . 1 1 242 242 ASP C C 13 175.46 0.02 . 1 . . . . 799 ASP C . 10016 1 837 . 1 1 242 242 ASP CA C 13 55.18 0.14 . 1 . . . . 799 ASP CA . 10016 1 838 . 1 1 242 242 ASP N N 15 129.53 0.03 . 1 . . . . 799 ASP N . 10016 1 839 . 1 1 243 243 GLY H H 1 8.09 0.02 . 1 . . . . 800 GLY H . 10016 1 840 . 1 1 243 243 GLY C C 13 172.34 0.07 . 1 . . . . 800 GLY C . 10016 1 841 . 1 1 243 243 GLY CA C 13 46.02 0.02 . 1 . . . . 800 GLY CA . 10016 1 842 . 1 1 243 243 GLY N N 15 105.46 0.15 . 1 . . . . 800 GLY N . 10016 1 843 . 1 1 244 244 CYS H H 1 7.53 0.02 . 1 . . . . 801 CYS H . 10016 1 844 . 1 1 244 244 CYS C C 13 173.86 0.06 . 1 . . . . 801 CYS C . 10016 1 845 . 1 1 244 244 CYS CA C 13 55.61 0.14 . 1 . . . . 801 CYS CA . 10016 1 846 . 1 1 244 244 CYS CB C 13 30.58 0.66 . 1 . . . . 801 CYS CB . 10016 1 847 . 1 1 244 244 CYS N N 15 116.92 0.1 . 1 . . . . 801 CYS N . 10016 1 848 . 1 1 245 245 ILE H H 1 9 0.02 . 1 . . . . 802 ILE H . 10016 1 849 . 1 1 245 245 ILE C C 13 177.09 0.09 . 1 . . . . 802 ILE C . 10016 1 850 . 1 1 245 245 ILE CA C 13 60.63 0.03 . 1 . . . . 802 ILE CA . 10016 1 851 . 1 1 245 245 ILE CB C 13 35.82 0.66 . 1 . . . . 802 ILE CB . 10016 1 852 . 1 1 245 245 ILE N N 15 124.2 0.15 . 1 . . . . 802 ILE N . 10016 1 853 . 1 1 246 246 VAL H H 1 8.99 0.02 . 1 . . . . 803 VAL H . 10016 1 854 . 1 1 246 246 VAL C C 13 176.06 0.05 . 1 . . . . 803 VAL C . 10016 1 855 . 1 1 246 246 VAL CA C 13 61.73 0.04 . 1 . . . . 803 VAL CA . 10016 1 856 . 1 1 246 246 VAL CB C 13 31.64 0.59 . 1 . . . . 803 VAL CB . 10016 1 857 . 1 1 246 246 VAL N N 15 126.24 0.18 . 1 . . . . 803 VAL N . 10016 1 858 . 1 1 247 247 GLU H H 1 7.5 0.02 . 1 . . . . 804 GLU H . 10016 1 859 . 1 1 247 247 GLU C C 13 173.35 0.02 . 1 . . . . 804 GLU C . 10016 1 860 . 1 1 247 247 GLU CA C 13 54.84 0.02 . 1 . . . . 804 GLU CA . 10016 1 861 . 1 1 247 247 GLU CB C 13 33.54 0.02 . 1 . . . . 804 GLU CB . 10016 1 862 . 1 1 247 247 GLU N N 15 120.72 0.14 . 1 . . . . 804 GLU N . 10016 1 863 . 1 1 248 248 ARG H H 1 8.27 0.02 . 1 . . . . 805 ARG H . 10016 1 864 . 1 1 248 248 ARG C C 13 174.44 0.04 . 1 . . . . 805 ARG C . 10016 1 865 . 1 1 248 248 ARG CA C 13 53.77 0.22 . 1 . . . . 805 ARG CA . 10016 1 866 . 1 1 248 248 ARG CB C 13 33.34 0.35 . 1 . . . . 805 ARG CB . 10016 1 867 . 1 1 248 248 ARG N N 15 118.72 0.09 . 1 . . . . 805 ARG N . 10016 1 868 . 1 1 249 249 GLY H H 1 8.57 0.02 . 1 . . . . 806 GLY H . 10016 1 869 . 1 1 249 249 GLY C C 13 171.31 0.09 . 1 . . . . 806 GLY C . 10016 1 870 . 1 1 249 249 GLY CA C 13 44.51 0.06 . 1 . . . . 806 GLY CA . 10016 1 871 . 1 1 249 249 GLY N N 15 111.43 0.19 . 1 . . . . 806 GLY N . 10016 1 872 . 1 1 250 250 ARG H H 1 7.82 0.02 . 1 . . . . 807 ARG H . 10016 1 873 . 1 1 250 250 ARG C C 13 176.03 0.03 . 1 . . . . 807 ARG C . 10016 1 874 . 1 1 250 250 ARG CA C 13 55.13 0.08 . 1 . . . . 807 ARG CA . 10016 1 875 . 1 1 250 250 ARG CB C 13 30.83 0.02 . 1 . . . . 807 ARG CB . 10016 1 876 . 1 1 250 250 ARG N N 15 120.67 0.09 . 1 . . . . 807 ARG N . 10016 1 877 . 1 1 251 251 HIS H H 1 8.7 0.02 . 1 . . . . 808 HIS H . 10016 1 878 . 1 1 251 251 HIS C C 13 175.56 0.11 . 1 . . . . 808 HIS C . 10016 1 879 . 1 1 251 251 HIS CA C 13 60.12 0.02 . 1 . . . . 808 HIS CA . 10016 1 880 . 1 1 251 251 HIS CB C 13 31.27 0.59 . 1 . . . . 808 HIS CB . 10016 1 881 . 1 1 251 251 HIS N N 15 123.49 0.16 . 1 . . . . 808 HIS N . 10016 1 882 . 1 1 252 252 GLU H H 1 8.92 0.02 . 1 . . . . 809 GLU H . 10016 1 883 . 1 1 252 252 GLU C C 13 179 0.04 . 1 . . . . 809 GLU C . 10016 1 884 . 1 1 252 252 GLU CA C 13 59.45 0.08 . 1 . . . . 809 GLU CA . 10016 1 885 . 1 1 252 252 GLU CB C 13 27.09 0.65 . 1 . . . . 809 GLU CB . 10016 1 886 . 1 1 252 252 GLU N N 15 117.24 0.15 . 1 . . . . 809 GLU N . 10016 1 887 . 1 1 253 253 ALA H H 1 6.91 0.02 . 1 . . . . 810 ALA H . 10016 1 888 . 1 1 253 253 ALA C C 13 180.65 0.02 . 1 . . . . 810 ALA C . 10016 1 889 . 1 1 253 253 ALA CA C 13 53.58 0.1 . 1 . . . . 810 ALA CA . 10016 1 890 . 1 1 253 253 ALA CB C 13 18.09 0.69 . 1 . . . . 810 ALA CB . 10016 1 891 . 1 1 253 253 ALA N N 15 124.24 0.16 . 1 . . . . 810 ALA N . 10016 1 892 . 1 1 254 254 LEU H H 1 8.09 0.02 . 1 . . . . 811 LEU H . 10016 1 893 . 1 1 254 254 LEU C C 13 180.65 0.08 . 1 . . . . 811 LEU C . 10016 1 894 . 1 1 254 254 LEU CA C 13 56.69 0.06 . 1 . . . . 811 LEU CA . 10016 1 895 . 1 1 254 254 LEU CB C 13 40.82 0.02 . 1 . . . . 811 LEU CB . 10016 1 896 . 1 1 254 254 LEU N N 15 122.13 0.14 . 1 . . . . 811 LEU N . 10016 1 897 . 1 1 255 255 LEU H H 1 8.17 0.02 . 1 . . . . 812 LEU H . 10016 1 898 . 1 1 255 255 LEU C C 13 179.92 0.02 . 1 . . . . 812 LEU C . 10016 1 899 . 1 1 255 255 LEU CA C 13 57.25 0.11 . 1 . . . . 812 LEU CA . 10016 1 900 . 1 1 255 255 LEU CB C 13 40.08 0.15 . 1 . . . . 812 LEU CB . 10016 1 901 . 1 1 255 255 LEU N N 15 122.63 0.08 . 1 . . . . 812 LEU N . 10016 1 902 . 1 1 256 256 SER H H 1 7.44 0.02 . 1 . . . . 813 SER H . 10016 1 903 . 1 1 256 256 SER C C 13 175.28 0.02 . 1 . . . . 813 SER C . 10016 1 904 . 1 1 256 256 SER CA C 13 60.14 0.13 . 1 . . . . 813 SER CA . 10016 1 905 . 1 1 256 256 SER CB C 13 62.9 0.29 . 1 . . . . 813 SER CB . 10016 1 906 . 1 1 256 256 SER N N 15 116.3 0.1 . 1 . . . . 813 SER N . 10016 1 907 . 1 1 257 257 ARG H H 1 7.34 0.02 . 1 . . . . 814 ARG H . 10016 1 908 . 1 1 257 257 ARG C C 13 178.41 0.06 . 1 . . . . 814 ARG C . 10016 1 909 . 1 1 257 257 ARG CA C 13 56.73 0.19 . 1 . . . . 814 ARG CA . 10016 1 910 . 1 1 257 257 ARG CB C 13 29.52 0.26 . 1 . . . . 814 ARG CB . 10016 1 911 . 1 1 257 257 ARG N N 15 121.56 0.15 . 1 . . . . 814 ARG N . 10016 1 912 . 1 1 258 258 GLY H H 1 7.25 0.02 . 1 . . . . 815 GLY H . 10016 1 913 . 1 1 258 258 GLY C C 13 173.94 0.12 . 1 . . . . 815 GLY C . 10016 1 914 . 1 1 258 258 GLY CA C 13 46.32 0.05 . 1 . . . . 815 GLY CA . 10016 1 915 . 1 1 258 258 GLY N N 15 106.23 0.14 . 1 . . . . 815 GLY N . 10016 1 916 . 1 1 259 259 GLY H H 1 8.35 0.02 . 1 . . . . 816 GLY H . 10016 1 917 . 1 1 259 259 GLY C C 13 173.87 0.02 . 1 . . . . 816 GLY C . 10016 1 918 . 1 1 259 259 GLY CA C 13 43.62 0.06 . 1 . . . . 816 GLY CA . 10016 1 919 . 1 1 259 259 GLY N N 15 113.43 0.2 . 1 . . . . 816 GLY N . 10016 1 920 . 1 1 260 260 VAL H H 1 9.58 0.02 . 1 . . . . 817 VAL H . 10016 1 921 . 1 1 260 260 VAL C C 13 179.07 0.02 . 1 . . . . 817 VAL C . 10016 1 922 . 1 1 260 260 VAL CA C 13 65.39 0.02 . 1 . . . . 817 VAL CA . 10016 1 923 . 1 1 260 260 VAL CB C 13 31.37 0.16 . 1 . . . . 817 VAL CB . 10016 1 924 . 1 1 260 260 VAL N N 15 129.68 0.16 . 1 . . . . 817 VAL N . 10016 1 925 . 1 1 261 261 TYR H H 1 9.27 0.02 . 1 . . . . 818 TYR H . 10016 1 926 . 1 1 261 261 TYR C C 13 176.83 0.02 . 1 . . . . 818 TYR C . 10016 1 927 . 1 1 261 261 TYR CA C 13 61.78 0.02 . 1 . . . . 818 TYR CA . 10016 1 928 . 1 1 261 261 TYR CB C 13 38 0.02 . 1 . . . . 818 TYR CB . 10016 1 929 . 1 1 261 261 TYR N N 15 124.5 0.2 . 1 . . . . 818 TYR N . 10016 1 930 . 1 1 262 262 ALA H H 1 8.13 0.02 . 1 . . . . 819 ALA H . 10016 1 931 . 1 1 262 262 ALA C C 13 179.84 0.02 . 1 . . . . 819 ALA C . 10016 1 932 . 1 1 262 262 ALA CA C 13 54.46 0.31 . 1 . . . . 819 ALA CA . 10016 1 933 . 1 1 262 262 ALA CB C 13 17.73 0.02 . 1 . . . . 819 ALA CB . 10016 1 934 . 1 1 262 262 ALA N N 15 122.2 0.11 . 1 . . . . 819 ALA N . 10016 1 935 . 1 1 263 263 ASP H H 1 8.16 0.02 . 1 . . . . 820 ASP H . 10016 1 936 . 1 1 263 263 ASP C C 13 178.89 0.02 . 1 . . . . 820 ASP C . 10016 1 937 . 1 1 263 263 ASP CA C 13 56.8 0.03 . 1 . . . . 820 ASP CA . 10016 1 938 . 1 1 263 263 ASP CB C 13 39.74 0.09 . 1 . . . . 820 ASP CB . 10016 1 939 . 1 1 263 263 ASP N N 15 121.65 0.16 . 1 . . . . 820 ASP N . 10016 1 940 . 1 1 264 264 MET H H 1 8.09 0.02 . 1 . . . . 821 MET H . 10016 1 941 . 1 1 264 264 MET C C 13 178 0.02 . 1 . . . . 821 MET C . 10016 1 942 . 1 1 264 264 MET CA C 13 58.91 0.06 . 1 . . . . 821 MET CA . 10016 1 943 . 1 1 264 264 MET CB C 13 32.97 0.02 . 1 . . . . 821 MET CB . 10016 1 944 . 1 1 264 264 MET N N 15 122.63 0.11 . 1 . . . . 821 MET N . 10016 1 945 . 1 1 265 265 TRP H H 1 8.8 0.02 . 1 . . . . 822 TRP H . 10016 1 946 . 1 1 265 265 TRP C C 13 178.18 0.02 . 1 . . . . 822 TRP C . 10016 1 947 . 1 1 265 265 TRP CA C 13 59.93 0.17 . 1 . . . . 822 TRP CA . 10016 1 948 . 1 1 265 265 TRP CB C 13 28.83 0.02 . 1 . . . . 822 TRP CB . 10016 1 949 . 1 1 265 265 TRP N N 15 122.66 0.05 . 1 . . . . 822 TRP N . 10016 1 950 . 1 1 266 266 GLN H H 1 8.09 0.02 . 1 . . . . 823 GLN H . 10016 1 951 . 1 1 266 266 GLN C C 13 178.87 0.03 . 1 . . . . 823 GLN C . 10016 1 952 . 1 1 266 266 GLN CA C 13 57.91 0.07 . 1 . . . . 823 GLN CA . 10016 1 953 . 1 1 266 266 GLN CB C 13 27.34 0.76 . 1 . . . . 823 GLN CB . 10016 1 954 . 1 1 266 266 GLN N N 15 119.66 0.12 . 1 . . . . 823 GLN N . 10016 1 955 . 1 1 267 267 LEU H H 1 7.64 0.02 . 1 . . . . 824 LEU H . 10016 1 956 . 1 1 267 267 LEU C C 13 179.2 0.02 . 1 . . . . 824 LEU C . 10016 1 957 . 1 1 267 267 LEU CA C 13 56.81 0.02 . 1 . . . . 824 LEU CA . 10016 1 958 . 1 1 267 267 LEU CB C 13 40.81 0.32 . 1 . . . . 824 LEU CB . 10016 1 959 . 1 1 267 267 LEU N N 15 122.05 0.13 . 1 . . . . 824 LEU N . 10016 1 960 . 1 1 268 268 GLN H H 1 7.67 0.02 . 1 . . . . 825 GLN H . 10016 1 961 . 1 1 268 268 GLN C C 13 177.46 0.03 . 1 . . . . 825 GLN C . 10016 1 962 . 1 1 268 268 GLN CA C 13 57.08 0.05 . 1 . . . . 825 GLN CA . 10016 1 963 . 1 1 268 268 GLN CB C 13 27.05 0.06 . 1 . . . . 825 GLN CB . 10016 1 964 . 1 1 268 268 GLN N N 15 118.88 0.1 . 1 . . . . 825 GLN N . 10016 1 965 . 1 1 269 269 GLN H H 1 7.79 0.02 . 1 . . . . 826 GLN H . 10016 1 966 . 1 1 269 269 GLN C C 13 177.2 0.07 . 1 . . . . 826 GLN C . 10016 1 967 . 1 1 269 269 GLN CA C 13 55.72 0.13 . 1 . . . . 826 GLN CA . 10016 1 968 . 1 1 269 269 GLN CB C 13 27.79 0.57 . 1 . . . . 826 GLN CB . 10016 1 969 . 1 1 269 269 GLN N N 15 120.3 0.11 . 1 . . . . 826 GLN N . 10016 1 970 . 1 1 270 270 GLY H H 1 7.74 0.02 . 1 . . . . 827 GLY H . 10016 1 971 . 1 1 270 270 GLY C C 13 174.22 0.08 . 1 . . . . 827 GLY C . 10016 1 972 . 1 1 270 270 GLY CA C 13 44.94 0.21 . 1 . . . . 827 GLY CA . 10016 1 973 . 1 1 270 270 GLY N N 15 109.78 0.12 . 1 . . . . 827 GLY N . 10016 1 974 . 1 1 271 271 GLN H H 1 7.81 0.02 . 1 . . . . 828 GLN H . 10016 1 975 . 1 1 271 271 GLN C C 13 175.97 0.02 . 1 . . . . 828 GLN C . 10016 1 976 . 1 1 271 271 GLN CA C 13 55.17 0.12 . 1 . . . . 828 GLN CA . 10016 1 977 . 1 1 271 271 GLN CB C 13 28.21 0.05 . 1 . . . . 828 GLN CB . 10016 1 978 . 1 1 271 271 GLN N N 15 121.46 0.1 . 1 . . . . 828 GLN N . 10016 1 979 . 1 1 272 272 GLU H H 1 8.18 0.02 . 1 . . . . 829 GLU H . 10016 1 980 . 1 1 272 272 GLU C C 13 176.45 0.03 . 1 . . . . 829 GLU C . 10016 1 981 . 1 1 272 272 GLU CA C 13 56.06 0.02 . 1 . . . . 829 GLU CA . 10016 1 982 . 1 1 272 272 GLU CB C 13 29.19 0.19 . 1 . . . . 829 GLU CB . 10016 1 983 . 1 1 272 272 GLU N N 15 123.91 0.12 . 1 . . . . 829 GLU N . 10016 1 984 . 1 1 273 273 GLU H H 1 8.35 0.02 . 1 . . . . 830 GLU H . 10016 1 985 . 1 1 273 273 GLU C C 13 176.3 0.08 . 1 . . . . 830 GLU C . 10016 1 986 . 1 1 273 273 GLU CA C 13 55.99 0.1 . 1 . . . . 830 GLU CA . 10016 1 987 . 1 1 273 273 GLU CB C 13 29.27 0.21 . 1 . . . . 830 GLU CB . 10016 1 988 . 1 1 273 273 GLU N N 15 124.42 0.11 . 1 . . . . 830 GLU N . 10016 1 989 . 1 1 274 274 THR H H 1 8.04 0.02 . 1 . . . . 831 THR H . 10016 1 990 . 1 1 274 274 THR CA C 13 60.76 0.02 . 1 . . . . 831 THR CA . 10016 1 991 . 1 1 274 274 THR CB C 13 69.32 0.02 . 1 . . . . 831 THR CB . 10016 1 992 . 1 1 274 274 THR N N 15 117.3 0.15 . 1 . . . . 831 THR N . 10016 1 993 . 1 1 275 275 SER H H 1 8.3 0.02 . 1 . . . . 832 SER H . 10016 1 994 . 1 1 275 275 SER CA C 13 57.9 0.02 . 1 . . . . 832 SER CA . 10016 1 995 . 1 1 275 275 SER N N 15 120.77 0.02 . 1 . . . . 832 SER N . 10016 1 996 . 1 1 276 276 GLU H H 1 8.44 0.02 . 1 . . . . 833 GLU H . 10016 1 997 . 1 1 276 276 GLU CA C 13 56.06 0.08 . 1 . . . . 833 GLU CA . 10016 1 998 . 1 1 276 276 GLU N N 15 125.43 0.02 . 1 . . . . 833 GLU N . 10016 1 999 . 1 1 277 277 ASP H H 1 8.28 0.02 . 1 . . . . 834 ASP H . 10016 1 1000 . 1 1 277 277 ASP C C 13 176.21 0.06 . 1 . . . . 834 ASP C . 10016 1 1001 . 1 1 277 277 ASP CA C 13 53.89 0.02 . 1 . . . . 834 ASP CA . 10016 1 1002 . 1 1 277 277 ASP CB C 13 40.32 0.02 . 1 . . . . 834 ASP CB . 10016 1 1003 . 1 1 277 277 ASP N N 15 123.26 0.19 . 1 . . . . 834 ASP N . 10016 1 1004 . 1 1 278 278 THR H H 1 7.93 0.02 . 1 . . . . 835 THR H . 10016 1 1005 . 1 1 278 278 THR C C 13 174.25 0.02 . 1 . . . . 835 THR C . 10016 1 1006 . 1 1 278 278 THR CA C 13 61.11 0.17 . 1 . . . . 835 THR CA . 10016 1 1007 . 1 1 278 278 THR CB C 13 68.91 0.09 . 1 . . . . 835 THR CB . 10016 1 1008 . 1 1 278 278 THR N N 15 116.64 0.18 . 1 . . . . 835 THR N . 10016 1 1009 . 1 1 279 279 LYS H H 1 8.15 0.02 . 1 . . . . 836 LYS H . 10016 1 1010 . 1 1 279 279 LYS C C 13 174.24 0.02 . 1 . . . . 836 LYS C . 10016 1 1011 . 1 1 279 279 LYS CA C 13 53.8 0.02 . 1 . . . . 836 LYS CA . 10016 1 1012 . 1 1 279 279 LYS CB C 13 31.32 0.02 . 1 . . . . 836 LYS CB . 10016 1 1013 . 1 1 279 279 LYS N N 15 127.56 0.13 . 1 . . . . 836 LYS N . 10016 1 1014 . 1 1 281 281 GLN H H 1 8.49 0.02 . 1 . . . . 838 GLN H . 10016 1 1015 . 1 1 281 281 GLN C C 13 176.49 0.02 . 1 . . . . 838 GLN C . 10016 1 1016 . 1 1 281 281 GLN CA C 13 55.89 0.06 . 1 . . . . 838 GLN CA . 10016 1 1017 . 1 1 281 281 GLN CB C 13 28.98 0.02 . 1 . . . . 838 GLN CB . 10016 1 1018 . 1 1 281 281 GLN N N 15 123.35 0.02 . 1 . . . . 838 GLN N . 10016 1 1019 . 1 1 282 282 THR H H 1 8.16 0.02 . 1 . . . . 839 THR H . 10016 1 1020 . 1 1 282 282 THR CA C 13 60.88 0.02 . 1 . . . . 839 THR CA . 10016 1 1021 . 1 1 282 282 THR CB C 13 69.14 0.02 . 1 . . . . 839 THR CB . 10016 1 1022 . 1 1 282 282 THR N N 15 117.72 0.21 . 1 . . . . 839 THR N . 10016 1 1023 . 1 1 283 283 MET H H 1 8.32 0.02 . 1 . . . . 840 MET H . 10016 1 1024 . 1 1 283 283 MET C C 13 175.72 0.02 . 1 . . . . 840 MET C . 10016 1 1025 . 1 1 283 283 MET CA C 13 54.52 0.28 . 1 . . . . 840 MET CA . 10016 1 1026 . 1 1 283 283 MET N N 15 125.07 0.04 . 1 . . . . 840 MET N . 10016 1 1027 . 1 1 284 284 GLU H H 1 8.33 0.02 . 1 . . . . 841 GLU H . 10016 1 1028 . 1 1 284 284 GLU C C 13 175.26 0.02 . 1 . . . . 841 GLU C . 10016 1 1029 . 1 1 284 284 GLU CA C 13 56.06 0.04 . 1 . . . . 841 GLU CA . 10016 1 1030 . 1 1 284 284 GLU N N 15 125.28 0.17 . 1 . . . . 841 GLU N . 10016 1 1031 . 1 1 285 285 ARG H H 1 7.88 0.02 . 1 . . . . 842 ARG H . 10016 1 1032 . 1 1 285 285 ARG C C 13 180.74 0.02 . 1 . . . . 842 ARG C . 10016 1 1033 . 1 1 285 285 ARG CA C 13 56.69 0.02 . 1 . . . . 842 ARG CA . 10016 1 1034 . 1 1 285 285 ARG CB C 13 30.18 0.02 . 1 . . . . 842 ARG CB . 10016 1 1035 . 1 1 285 285 ARG N N 15 129.44 0.1 . 1 . . . . 842 ARG N . 10016 1 stop_ save_ save_ph75_278K _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode ph75_278K _Assigned_chem_shift_list.Entry_ID 10016 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $condition_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _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 '1H-15N TROSY-HSQC' 1 $sample_1 isotropic 10016 2 2 TROSY-HNCA 1 $sample_1 isotropic 10016 2 3 TROSY-HN(CO)CA 1 $sample_1 isotropic 10016 2 4 TROSY-HN(CA)CB 1 $sample_1 isotropic 10016 2 5 TROSY-HN(COCA)CB 1 $sample_1 isotropic 10016 2 6 TROSY-HN(CA)CO 1 $sample_1 isotropic 10016 2 7 TRSOY-HNCO 1 $sample_1 isotropic 10016 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $software_3 . . 10016 2 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 17 17 VAL C C 13 175.44 0.02 . 1 . . . . 574 VAL C . 10016 2 2 . 1 1 17 17 VAL CA C 13 61.33 0.02 . 1 . . . . 574 VAL CA . 10016 2 3 . 1 1 18 18 LYS H H 1 8.95 0.02 . 1 . . . . 575 LYS H . 10016 2 4 . 1 1 18 18 LYS C C 13 176.79 0.02 . 1 . . . . 575 LYS C . 10016 2 5 . 1 1 18 18 LYS CA C 13 53.5 0.14 . 1 . . . . 575 LYS CA . 10016 2 6 . 1 1 18 18 LYS N N 15 128.25 0.02 . 1 . . . . 575 LYS N . 10016 2 7 . 1 1 19 19 ASP H H 1 8.76 0.02 . 1 . . . . 576 ASP H . 10016 2 8 . 1 1 19 19 ASP C C 13 176.73 0.02 . 1 . . . . 576 ASP C . 10016 2 9 . 1 1 19 19 ASP CA C 13 52.86 0.02 . 1 . . . . 576 ASP CA . 10016 2 10 . 1 1 19 19 ASP CB C 13 39.39 0.02 . 1 . . . . 576 ASP CB . 10016 2 11 . 1 1 19 19 ASP N N 15 125.02 0.12 . 1 . . . . 576 ASP N . 10016 2 12 . 1 1 20 20 LEU H H 1 9.03 0.02 . 1 . . . . 577 LEU H . 10016 2 13 . 1 1 20 20 LEU CA C 13 52.47 0.02 . 1 . . . . 577 LEU CA . 10016 2 14 . 1 1 20 20 LEU CB C 13 39.74 0.02 . 1 . . . . 577 LEU CB . 10016 2 15 . 1 1 20 20 LEU N N 15 127.96 0.05 . 1 . . . . 577 LEU N . 10016 2 16 . 1 1 21 21 PRO CA C 13 63.16 0.07 . 1 . . . . 578 PRO CA . 10016 2 17 . 1 1 22 22 GLY H H 1 8.86 0.02 . 1 . . . . 579 GLY H . 10016 2 18 . 1 1 22 22 GLY C C 13 174.03 0.02 . 1 . . . . 579 GLY C . 10016 2 19 . 1 1 22 22 GLY CA C 13 44.37 0.03 . 1 . . . . 579 GLY CA . 10016 2 20 . 1 1 22 22 GLY N N 15 114.03 0.08 . 1 . . . . 579 GLY N . 10016 2 21 . 1 1 23 23 ALA H H 1 7.66 0.02 . 1 . . . . 580 ALA H . 10016 2 22 . 1 1 23 23 ALA C C 13 176.96 0.02 . 1 . . . . 580 ALA C . 10016 2 23 . 1 1 23 23 ALA CA C 13 52.45 0.17 . 1 . . . . 580 ALA CA . 10016 2 24 . 1 1 23 23 ALA CB C 13 18.4 0.13 . 1 . . . . 580 ALA CB . 10016 2 25 . 1 1 23 23 ALA N N 15 124.67 0.04 . 1 . . . . 580 ALA N . 10016 2 26 . 1 1 24 24 GLY H H 1 8.67 0.02 . 1 . . . . 581 GLY H . 10016 2 27 . 1 1 24 24 GLY C C 13 170.88 0.02 . 1 . . . . 581 GLY C . 10016 2 28 . 1 1 24 24 GLY CA C 13 42.4 0.02 . 1 . . . . 581 GLY CA . 10016 2 29 . 1 1 24 24 GLY N N 15 112.63 0.06 . 1 . . . . 581 GLY N . 10016 2 30 . 1 1 25 25 PRO C C 13 177.63 0.02 . 1 . . . . 582 PRO C . 10016 2 31 . 1 1 26 26 LEU H H 1 8.79 0.02 . 1 . . . . 583 LEU H . 10016 2 32 . 1 1 26 26 LEU C C 13 175.35 0.02 . 1 . . . . 583 LEU C . 10016 2 33 . 1 1 26 26 LEU CA C 13 54.62 0.08 . 1 . . . . 583 LEU CA . 10016 2 34 . 1 1 26 26 LEU CB C 13 41.25 0.02 . 1 . . . . 583 LEU CB . 10016 2 35 . 1 1 26 26 LEU N N 15 123.52 0.02 . 1 . . . . 583 LEU N . 10016 2 36 . 1 1 27 27 ARG H H 1 9.6 0.02 . 1 . . . . 584 ARG H . 10016 2 37 . 1 1 27 27 ARG C C 13 174.88 0.05 . 1 . . . . 584 ARG C . 10016 2 38 . 1 1 27 27 ARG CA C 13 53.74 0.05 . 1 . . . . 584 ARG CA . 10016 2 39 . 1 1 27 27 ARG CB C 13 26.64 0.02 . 1 . . . . 584 ARG CB . 10016 2 40 . 1 1 27 27 ARG N N 15 132.47 0.02 . 1 . . . . 584 ARG N . 10016 2 41 . 1 1 28 28 PHE H H 1 8.54 0.02 . 1 . . . . 585 PHE H . 10016 2 42 . 1 1 28 28 PHE C C 13 174.81 0.06 . 1 . . . . 585 PHE C . 10016 2 43 . 1 1 28 28 PHE CA C 13 58.88 0.1 . 1 . . . . 585 PHE CA . 10016 2 44 . 1 1 28 28 PHE CB C 13 38.09 0.02 . 1 . . . . 585 PHE CB . 10016 2 45 . 1 1 28 28 PHE N N 15 129.86 0.1 . 1 . . . . 585 PHE N . 10016 2 46 . 1 1 29 29 GLN H H 1 8.59 0.03 . 1 . . . . 586 GLN H . 10016 2 47 . 1 1 29 29 GLN C C 13 173.05 0.02 . 1 . . . . 586 GLN C . 10016 2 48 . 1 1 29 29 GLN CA C 13 55.18 0.02 . 1 . . . . 586 GLN CA . 10016 2 49 . 1 1 29 29 GLN N N 15 131.22 0.25 . 1 . . . . 586 GLN N . 10016 2 50 . 1 1 30 30 LYS H H 1 7.91 0.02 . 1 . . . . 587 LYS H . 10016 2 51 . 1 1 30 30 LYS CA C 13 54.69 0.02 . 1 . . . . 587 LYS CA . 10016 2 52 . 1 1 30 30 LYS N N 15 118.92 0.02 . 1 . . . . 587 LYS N . 10016 2 53 . 1 1 31 31 GLY H H 1 9.56 0.02 . 1 . . . . 588 GLY H . 10016 2 54 . 1 1 31 31 GLY C C 13 173.37 0.02 . 1 . . . . 588 GLY C . 10016 2 55 . 1 1 31 31 GLY CA C 13 46.77 0.02 . 1 . . . . 588 GLY CA . 10016 2 56 . 1 1 31 31 GLY N N 15 115.58 0.02 . 1 . . . . 588 GLY N . 10016 2 57 . 1 1 32 32 ARG H H 1 8.96 0.02 . 1 . . . . 589 ARG H . 10016 2 58 . 1 1 32 32 ARG C C 13 175.88 0.05 . 1 . . . . 589 ARG C . 10016 2 59 . 1 1 32 32 ARG CA C 13 54.88 0.18 . 1 . . . . 589 ARG CA . 10016 2 60 . 1 1 32 32 ARG CB C 13 29.89 0.02 . 1 . . . . 589 ARG CB . 10016 2 61 . 1 1 32 32 ARG N N 15 126.23 0.18 . 1 . . . . 589 ARG N . 10016 2 62 . 1 1 33 33 ILE H H 1 8.98 0.02 . 1 . . . . 590 ILE H . 10016 2 63 . 1 1 33 33 ILE C C 13 174.21 0.02 . 1 . . . . 590 ILE C . 10016 2 64 . 1 1 33 33 ILE CA C 13 59.66 0.08 . 1 . . . . 590 ILE CA . 10016 2 65 . 1 1 33 33 ILE CB C 13 40.3 0.02 . 1 . . . . 590 ILE CB . 10016 2 66 . 1 1 33 33 ILE N N 15 130.41 0.08 . 1 . . . . 590 ILE N . 10016 2 67 . 1 1 34 34 GLU H H 1 9.36 0.02 . 1 . . . . 591 GLU H . 10016 2 68 . 1 1 34 34 GLU C C 13 173.78 0.02 . 1 . . . . 591 GLU C . 10016 2 69 . 1 1 34 34 GLU CA C 13 54.01 0.02 . 1 . . . . 591 GLU CA . 10016 2 70 . 1 1 34 34 GLU CB C 13 32.76 0.02 . 1 . . . . 591 GLU CB . 10016 2 71 . 1 1 34 34 GLU N N 15 127.44 0.04 . 1 . . . . 591 GLU N . 10016 2 72 . 1 1 35 35 PHE H H 1 9.18 0.02 . 1 . . . . 592 PHE H . 10016 2 73 . 1 1 35 35 PHE C C 13 174.82 0.02 . 1 . . . . 592 PHE C . 10016 2 74 . 1 1 35 35 PHE CA C 13 55.7 0.21 . 1 . . . . 592 PHE CA . 10016 2 75 . 1 1 35 35 PHE CB C 13 37.89 0.02 . 1 . . . . 592 PHE CB . 10016 2 76 . 1 1 35 35 PHE N N 15 129.1 0.15 . 1 . . . . 592 PHE N . 10016 2 77 . 1 1 36 36 GLU H H 1 9.43 0.02 . 1 . . . . 593 GLU H . 10016 2 78 . 1 1 36 36 GLU C C 13 172.39 0.02 . 1 . . . . 593 GLU C . 10016 2 79 . 1 1 36 36 GLU CA C 13 54 0.02 . 1 . . . . 593 GLU CA . 10016 2 80 . 1 1 36 36 GLU N N 15 129.05 0.11 . 1 . . . . 593 GLU N . 10016 2 81 . 1 1 37 37 ASN H H 1 9.1 0.02 . 1 . . . . 594 ASN H . 10016 2 82 . 1 1 37 37 ASN CA C 13 53.76 0.02 . 1 . . . . 594 ASN CA . 10016 2 83 . 1 1 37 37 ASN CB C 13 37.29 0.02 . 1 . . . . 594 ASN CB . 10016 2 84 . 1 1 37 37 ASN N N 15 125.41 0.18 . 1 . . . . 594 ASN N . 10016 2 85 . 1 1 38 38 VAL H H 1 8.76 0.02 . 1 . . . . 595 VAL H . 10016 2 86 . 1 1 38 38 VAL C C 13 173.81 0.02 . 1 . . . . 595 VAL C . 10016 2 87 . 1 1 38 38 VAL CA C 13 64.16 0.24 . 1 . . . . 595 VAL CA . 10016 2 88 . 1 1 38 38 VAL N N 15 121.55 0.02 . 1 . . . . 595 VAL N . 10016 2 89 . 1 1 39 39 HIS H H 1 8.34 0.02 . 1 . . . . 596 HIS H . 10016 2 90 . 1 1 39 39 HIS CA C 13 53.47 0.02 . 1 . . . . 596 HIS CA . 10016 2 91 . 1 1 39 39 HIS N N 15 126.27 0.08 . 1 . . . . 596 HIS N . 10016 2 92 . 1 1 50 50 GLN H H 1 8.94 0.02 . 1 . . . . 607 GLN H . 10016 2 93 . 1 1 50 50 GLN CA C 13 53.92 0.02 . 1 . . . . 607 GLN CA . 10016 2 94 . 1 1 50 50 GLN N N 15 124.5 0.02 . 1 . . . . 607 GLN N . 10016 2 95 . 1 1 51 51 ASP C C 13 173.41 0.02 . 1 . . . . 608 ASP C . 10016 2 96 . 1 1 52 52 VAL H H 1 9.08 0.02 . 1 . . . . 609 VAL H . 10016 2 97 . 1 1 52 52 VAL CA C 13 63.27 0.02 . 1 . . . . 609 VAL CA . 10016 2 98 . 1 1 52 52 VAL N N 15 123.25 0.02 . 1 . . . . 609 VAL N . 10016 2 99 . 1 1 53 53 SER H H 1 8.1 0.02 . 1 . . . . 610 SER H . 10016 2 100 . 1 1 53 53 SER C C 13 172.73 0.02 . 1 . . . . 610 SER C . 10016 2 101 . 1 1 53 53 SER CA C 13 55.72 0.02 . 1 . . . . 610 SER CA . 10016 2 102 . 1 1 53 53 SER N N 15 125.48 0.02 . 1 . . . . 610 SER N . 10016 2 103 . 1 1 54 54 PHE H H 1 8.52 0.02 . 1 . . . . 611 PHE H . 10016 2 104 . 1 1 54 54 PHE C C 13 172.48 0.1 . 1 . . . . 611 PHE C . 10016 2 105 . 1 1 54 54 PHE CA C 13 57.02 0.11 . 1 . . . . 611 PHE CA . 10016 2 106 . 1 1 54 54 PHE CB C 13 38.71 0.02 . 1 . . . . 611 PHE CB . 10016 2 107 . 1 1 54 54 PHE N N 15 118.95 0.18 . 1 . . . . 611 PHE N . 10016 2 108 . 1 1 55 55 THR H H 1 9.11 0.02 . 1 . . . . 612 THR H . 10016 2 109 . 1 1 55 55 THR C C 13 173.3 0.02 . 1 . . . . 612 THR C . 10016 2 110 . 1 1 55 55 THR CA C 13 60.71 0.02 . 1 . . . . 612 THR CA . 10016 2 111 . 1 1 55 55 THR CB C 13 71.23 0.02 . 1 . . . . 612 THR CB . 10016 2 112 . 1 1 55 55 THR N N 15 118.32 0.16 . 1 . . . . 612 THR N . 10016 2 113 . 1 1 56 56 VAL H H 1 9.85 0.02 . 1 . . . . 613 VAL H . 10016 2 114 . 1 1 56 56 VAL C C 13 174.7 0.02 . 1 . . . . 613 VAL C . 10016 2 115 . 1 1 56 56 VAL CA C 13 60.69 0.19 . 1 . . . . 613 VAL CA . 10016 2 116 . 1 1 56 56 VAL CB C 13 32.08 0.02 . 1 . . . . 613 VAL CB . 10016 2 117 . 1 1 56 56 VAL N N 15 130.02 0.05 . 1 . . . . 613 VAL N . 10016 2 118 . 1 1 57 57 MET H H 1 8.37 0.02 . 1 . . . . 614 MET H . 10016 2 119 . 1 1 57 57 MET C C 13 172.71 0.02 . 1 . . . . 614 MET C . 10016 2 120 . 1 1 57 57 MET CA C 13 51.73 0.02 . 1 . . . . 614 MET CA . 10016 2 121 . 1 1 57 57 MET N N 15 126.58 0.16 . 1 . . . . 614 MET N . 10016 2 122 . 1 1 58 58 PRO C C 13 176.65 0.02 . 1 . . . . 615 PRO C . 10016 2 123 . 1 1 59 59 GLY H H 1 8.49 0.02 . 1 . . . . 616 GLY H . 10016 2 124 . 1 1 59 59 GLY C C 13 173.61 0.15 . 1 . . . . 616 GLY C . 10016 2 125 . 1 1 59 59 GLY CA C 13 44.37 0.03 . 1 . . . . 616 GLY CA . 10016 2 126 . 1 1 59 59 GLY N N 15 111.41 0.08 . 1 . . . . 616 GLY N . 10016 2 127 . 1 1 60 60 GLN H H 1 8.06 0.02 . 1 . . . . 617 GLN H . 10016 2 128 . 1 1 60 60 GLN C C 13 174.24 0.04 . 1 . . . . 617 GLN C . 10016 2 129 . 1 1 60 60 GLN CA C 13 55.14 0.04 . 1 . . . . 617 GLN CA . 10016 2 130 . 1 1 60 60 GLN CB C 13 28.93 0.02 . 1 . . . . 617 GLN CB . 10016 2 131 . 1 1 60 60 GLN N N 15 121.71 0.04 . 1 . . . . 617 GLN N . 10016 2 132 . 1 1 61 61 THR H H 1 9.38 0.02 . 1 . . . . 618 THR H . 10016 2 133 . 1 1 61 61 THR C C 13 173.46 0.02 . 1 . . . . 618 THR C . 10016 2 134 . 1 1 61 61 THR CA C 13 60.96 0.05 . 1 . . . . 618 THR CA . 10016 2 135 . 1 1 61 61 THR CB C 13 70.07 0.02 . 1 . . . . 618 THR CB . 10016 2 136 . 1 1 61 61 THR N N 15 115.76 0.2 . 1 . . . . 618 THR N . 10016 2 137 . 1 1 62 62 LEU H H 1 9.15 0.03 . 1 . . . . 619 LEU H . 10016 2 138 . 1 1 62 62 LEU C C 13 173.25 0.02 . 1 . . . . 619 LEU C . 10016 2 139 . 1 1 62 62 LEU CA C 13 51.89 0.17 . 1 . . . . 619 LEU CA . 10016 2 140 . 1 1 62 62 LEU CB C 13 43.86 0.02 . 1 . . . . 619 LEU CB . 10016 2 141 . 1 1 62 62 LEU N N 15 132.65 0.21 . 1 . . . . 619 LEU N . 10016 2 142 . 1 1 63 63 ALA H H 1 9.03 0.02 . 1 . . . . 620 ALA H . 10016 2 143 . 1 1 63 63 ALA C C 13 174.24 0.07 . 1 . . . . 620 ALA C . 10016 2 144 . 1 1 63 63 ALA CA C 13 48.39 0.19 . 1 . . . . 620 ALA CA . 10016 2 145 . 1 1 63 63 ALA CB C 13 21.28 0.02 . 1 . . . . 620 ALA CB . 10016 2 146 . 1 1 63 63 ALA N N 15 130.06 0.2 . 1 . . . . 620 ALA N . 10016 2 147 . 1 1 64 64 LEU H H 1 9.12 0.02 . 1 . . . . 621 LEU H . 10016 2 148 . 1 1 64 64 LEU C C 13 174.68 0.02 . 1 . . . . 621 LEU C . 10016 2 149 . 1 1 64 64 LEU CA C 13 52.27 0.1 . 1 . . . . 621 LEU CA . 10016 2 150 . 1 1 64 64 LEU CB C 13 41.93 0.02 . 1 . . . . 621 LEU CB . 10016 2 151 . 1 1 64 64 LEU N N 15 123.89 0.14 . 1 . . . . 621 LEU N . 10016 2 152 . 1 1 65 65 VAL H H 1 8.7 0.02 . 1 . . . . 622 VAL H . 10016 2 153 . 1 1 65 65 VAL CA C 13 57.21 0.02 . 1 . . . . 622 VAL CA . 10016 2 154 . 1 1 65 65 VAL N N 15 116.69 0.02 . 1 . . . . 622 VAL N . 10016 2 155 . 1 1 83 83 TYR C C 13 174.44 0.02 . 1 . . . . 640 TYR C . 10016 2 156 . 1 1 84 84 ASP H H 1 8.79 0.02 . 1 . . . . 641 ASP H . 10016 2 157 . 1 1 84 84 ASP C C 13 176.32 0.02 . 1 . . . . 641 ASP C . 10016 2 158 . 1 1 84 84 ASP CA C 13 53.49 0.09 . 1 . . . . 641 ASP CA . 10016 2 159 . 1 1 84 84 ASP N N 15 121.41 0.16 . 1 . . . . 641 ASP N . 10016 2 160 . 1 1 85 85 ILE H H 1 8.26 0.02 . 1 . . . . 642 ILE H . 10016 2 161 . 1 1 85 85 ILE C C 13 175.73 0.15 . 1 . . . . 642 ILE C . 10016 2 162 . 1 1 85 85 ILE CA C 13 60.86 0.02 . 1 . . . . 642 ILE CA . 10016 2 163 . 1 1 85 85 ILE N N 15 114.89 0.19 . 1 . . . . 642 ILE N . 10016 2 164 . 1 1 86 86 SER H H 1 8.75 0.03 . 1 . . . . 643 SER H . 10016 2 165 . 1 1 86 86 SER C C 13 174.63 0.02 . 1 . . . . 643 SER C . 10016 2 166 . 1 1 86 86 SER CA C 13 59.18 0.02 . 1 . . . . 643 SER CA . 10016 2 167 . 1 1 86 86 SER N N 15 118.99 0.11 . 1 . . . . 643 SER N . 10016 2 168 . 1 1 87 87 SER H H 1 7.84 0.02 . 1 . . . . 644 SER H . 10016 2 169 . 1 1 87 87 SER C C 13 171.98 0.02 . 1 . . . . 644 SER C . 10016 2 170 . 1 1 87 87 SER CA C 13 57.61 0.21 . 1 . . . . 644 SER CA . 10016 2 171 . 1 1 87 87 SER CB C 13 63.37 0.02 . 1 . . . . 644 SER CB . 10016 2 172 . 1 1 87 87 SER N N 15 115.58 0.12 . 1 . . . . 644 SER N . 10016 2 173 . 1 1 88 88 GLY H H 1 8.57 0.02 . 1 . . . . 645 GLY H . 10016 2 174 . 1 1 88 88 GLY C C 13 173.64 0.04 . 1 . . . . 645 GLY C . 10016 2 175 . 1 1 88 88 GLY CA C 13 43.96 0.2 . 1 . . . . 645 GLY CA . 10016 2 176 . 1 1 88 88 GLY N N 15 111.24 0.06 . 1 . . . . 645 GLY N . 10016 2 177 . 1 1 89 89 CYS H H 1 8.44 0.04 . 1 . . . . 646 CYS H . 10016 2 178 . 1 1 89 89 CYS C C 13 171.04 0.04 . 1 . . . . 646 CYS C . 10016 2 179 . 1 1 89 89 CYS CA C 13 58.61 0.02 . 1 . . . . 646 CYS CA . 10016 2 180 . 1 1 89 89 CYS CB C 13 29.1 0.02 . 1 . . . . 646 CYS CB . 10016 2 181 . 1 1 89 89 CYS N N 15 121.63 0.21 . 1 . . . . 646 CYS N . 10016 2 182 . 1 1 90 90 ILE H H 1 8.99 0.02 . 1 . . . . 647 ILE H . 10016 2 183 . 1 1 90 90 ILE C C 13 173.88 0.11 . 1 . . . . 647 ILE C . 10016 2 184 . 1 1 90 90 ILE CA C 13 59.37 0.07 . 1 . . . . 647 ILE CA . 10016 2 185 . 1 1 90 90 ILE N N 15 131.56 0.13 . 1 . . . . 647 ILE N . 10016 2 186 . 1 1 91 91 ARG H H 1 9.25 0.02 . 1 . . . . 648 ARG H . 10016 2 187 . 1 1 91 91 ARG C C 13 176.34 0.04 . 1 . . . . 648 ARG C . 10016 2 188 . 1 1 91 91 ARG CA C 13 52.61 0.11 . 1 . . . . 648 ARG CA . 10016 2 189 . 1 1 91 91 ARG CB C 13 34.5 0.02 . 1 . . . . 648 ARG CB . 10016 2 190 . 1 1 91 91 ARG N N 15 125.16 0.06 . 1 . . . . 648 ARG N . 10016 2 191 . 1 1 92 92 ILE H H 1 8.3 0.02 . 1 . . . . 649 ILE H . 10016 2 192 . 1 1 92 92 ILE C C 13 175.14 0.1 . 1 . . . . 649 ILE C . 10016 2 193 . 1 1 92 92 ILE CA C 13 58.9 0.06 . 1 . . . . 649 ILE CA . 10016 2 194 . 1 1 92 92 ILE CB C 13 39.87 0.02 . 1 . . . . 649 ILE CB . 10016 2 195 . 1 1 92 92 ILE N N 15 122.42 0.13 . 1 . . . . 649 ILE N . 10016 2 196 . 1 1 93 93 ASP H H 1 9.67 0.02 . 1 . . . . 650 ASP H . 10016 2 197 . 1 1 93 93 ASP C C 13 176.79 0.02 . 1 . . . . 650 ASP C . 10016 2 198 . 1 1 93 93 ASP CA C 13 55.42 0.17 . 1 . . . . 650 ASP CA . 10016 2 199 . 1 1 93 93 ASP CB C 13 38.85 0.02 . 1 . . . . 650 ASP CB . 10016 2 200 . 1 1 93 93 ASP N N 15 129.87 0.07 . 1 . . . . 650 ASP N . 10016 2 201 . 1 1 94 94 GLY H H 1 9.39 0.02 . 1 . . . . 651 GLY H . 10016 2 202 . 1 1 94 94 GLY C C 13 173.58 0.02 . 1 . . . . 651 GLY C . 10016 2 203 . 1 1 94 94 GLY CA C 13 44.44 0.09 . 1 . . . . 651 GLY CA . 10016 2 204 . 1 1 94 94 GLY N N 15 105.39 0.17 . 1 . . . . 651 GLY N . 10016 2 205 . 1 1 95 95 GLN H H 1 8.04 0.02 . 1 . . . . 652 GLN H . 10016 2 206 . 1 1 95 95 GLN C C 13 173.8 0.06 . 1 . . . . 652 GLN C . 10016 2 207 . 1 1 95 95 GLN CA C 13 54.07 0.14 . 1 . . . . 652 GLN CA . 10016 2 208 . 1 1 95 95 GLN CB C 13 29.19 0.02 . 1 . . . . 652 GLN CB . 10016 2 209 . 1 1 95 95 GLN N N 15 125.13 0.07 . 1 . . . . 652 GLN N . 10016 2 210 . 1 1 96 96 ASP H H 1 8.55 0.02 . 1 . . . . 653 ASP H . 10016 2 211 . 1 1 96 96 ASP C C 13 179.1 0.06 . 1 . . . . 653 ASP C . 10016 2 212 . 1 1 96 96 ASP CA C 13 52.44 0.05 . 1 . . . . 653 ASP CA . 10016 2 213 . 1 1 96 96 ASP N N 15 126.25 0.08 . 1 . . . . 653 ASP N . 10016 2 214 . 1 1 97 97 ILE H H 1 8.89 0.02 . 1 . . . . 654 ILE H . 10016 2 215 . 1 1 97 97 ILE CA C 13 63.84 0.02 . 1 . . . . 654 ILE CA . 10016 2 216 . 1 1 97 97 ILE CB C 13 35.87 0.02 . 1 . . . . 654 ILE CB . 10016 2 217 . 1 1 97 97 ILE N N 15 125.96 0.21 . 1 . . . . 654 ILE N . 10016 2 218 . 1 1 99 99 GLN H H 1 7.88 0.02 . 1 . . . . 656 GLN H . 10016 2 219 . 1 1 99 99 GLN C C 13 174.52 0.02 . 1 . . . . 656 GLN C . 10016 2 220 . 1 1 99 99 GLN CA C 13 54.42 0.02 . 1 . . . . 656 GLN CA . 10016 2 221 . 1 1 99 99 GLN N N 15 121.74 0.02 . 1 . . . . 656 GLN N . 10016 2 222 . 1 1 100 100 VAL H H 1 6.73 0.03 . 1 . . . . 657 VAL H . 10016 2 223 . 1 1 100 100 VAL C C 13 177.48 0.05 . 1 . . . . 657 VAL C . 10016 2 224 . 1 1 100 100 VAL CA C 13 57.08 0.02 . 1 . . . . 657 VAL CA . 10016 2 225 . 1 1 100 100 VAL CB C 13 33.69 0.02 . 1 . . . . 657 VAL CB . 10016 2 226 . 1 1 100 100 VAL N N 15 111.14 0.19 . 1 . . . . 657 VAL N . 10016 2 227 . 1 1 101 101 THR H H 1 8.43 0.02 . 1 . . . . 658 THR H . 10016 2 228 . 1 1 101 101 THR CA C 13 60.01 0.15 . 1 . . . . 658 THR CA . 10016 2 229 . 1 1 101 101 THR N N 15 117.02 0.06 . 1 . . . . 658 THR N . 10016 2 230 . 1 1 102 102 GLN H H 1 10.58 0.02 . 1 . . . . 659 GLN H . 10016 2 231 . 1 1 102 102 GLN C C 13 177.95 0.02 . 1 . . . . 659 GLN C . 10016 2 232 . 1 1 102 102 GLN CA C 13 58.58 0.02 . 1 . . . . 659 GLN CA . 10016 2 233 . 1 1 102 102 GLN N N 15 130.9 0.02 . 1 . . . . 659 GLN N . 10016 2 234 . 1 1 103 103 ALA H H 1 9.39 0.02 . 1 . . . . 660 ALA H . 10016 2 235 . 1 1 103 103 ALA C C 13 180.61 0.02 . 1 . . . . 660 ALA C . 10016 2 236 . 1 1 103 103 ALA CA C 13 53.92 0.02 . 1 . . . . 660 ALA CA . 10016 2 237 . 1 1 103 103 ALA N N 15 122.11 0.08 . 1 . . . . 660 ALA N . 10016 2 238 . 1 1 104 104 SER H H 1 7.46 0.02 . 1 . . . . 661 SER H . 10016 2 239 . 1 1 104 104 SER CA C 13 60.22 0.02 . 1 . . . . 661 SER CA . 10016 2 240 . 1 1 104 104 SER N N 15 116 0.02 . 1 . . . . 661 SER N . 10016 2 241 . 1 1 105 105 LEU H H 1 7.72 0.02 . 1 . . . . 662 LEU H . 10016 2 242 . 1 1 105 105 LEU CA C 13 57.8 0.02 . 1 . . . . 662 LEU CA . 10016 2 243 . 1 1 105 105 LEU N N 15 128.5 0.02 . 1 . . . . 662 LEU N . 10016 2 244 . 1 1 106 106 ARG H H 1 7.95 0.02 . 1 . . . . 663 ARG H . 10016 2 245 . 1 1 106 106 ARG CA C 13 58.41 0.02 . 1 . . . . 663 ARG CA . 10016 2 246 . 1 1 106 106 ARG N N 15 114.58 0.02 . 1 . . . . 663 ARG N . 10016 2 247 . 1 1 107 107 SER C C 13 173.91 0.02 . 1 . . . . 664 SER C . 10016 2 248 . 1 1 108 108 HIS H H 1 7.02 0.02 . 1 . . . . 665 HIS H . 10016 2 249 . 1 1 108 108 HIS C C 13 172.36 0.02 . 1 . . . . 665 HIS C . 10016 2 250 . 1 1 108 108 HIS CA C 13 55.87 0.02 . 1 . . . . 665 HIS CA . 10016 2 251 . 1 1 108 108 HIS N N 15 119.71 0.06 . 1 . . . . 665 HIS N . 10016 2 252 . 1 1 109 109 ILE H H 1 7.26 0.02 . 1 . . . . 666 ILE H . 10016 2 253 . 1 1 109 109 ILE N N 15 120.12 0.02 . 1 . . . . 666 ILE N . 10016 2 254 . 1 1 114 114 GLN CA C 13 58.52 0.02 . 1 . . . . 671 GLN CA . 10016 2 255 . 1 1 115 115 ASP H H 1 8.26 0.02 . 1 . . . . 672 ASP H . 10016 2 256 . 1 1 115 115 ASP CA C 13 51.37 0.02 . 1 . . . . 672 ASP CA . 10016 2 257 . 1 1 115 115 ASP N N 15 120.36 0.12 . 1 . . . . 672 ASP N . 10016 2 258 . 1 1 120 120 ASN CA C 13 52.67 0.02 . 1 . . . . 677 ASN CA . 10016 2 259 . 1 1 121 121 ASP H H 1 8.08 0.02 . 1 . . . . 678 ASP H . 10016 2 260 . 1 1 121 121 ASP CA C 13 51.65 0.06 . 1 . . . . 678 ASP CA . 10016 2 261 . 1 1 121 121 ASP CB C 13 44.27 0.02 . 1 . . . . 678 ASP CB . 10016 2 262 . 1 1 121 121 ASP N N 15 129.28 0.02 . 1 . . . . 678 ASP N . 10016 2 263 . 1 1 122 122 THR H H 1 10 0.02 . 1 . . . . 679 THR H . 10016 2 264 . 1 1 122 122 THR C C 13 178.21 0.02 . 1 . . . . 679 THR C . 10016 2 265 . 1 1 122 122 THR CA C 13 61.32 0.1 . 1 . . . . 679 THR CA . 10016 2 266 . 1 1 122 122 THR N N 15 112.43 0.02 . 1 . . . . 679 THR N . 10016 2 267 . 1 1 123 123 ILE H H 1 8.97 0.02 . 1 . . . . 680 ILE H . 10016 2 268 . 1 1 123 123 ILE CA C 13 62.07 0.02 . 1 . . . . 680 ILE CA . 10016 2 269 . 1 1 123 123 ILE N N 15 123.78 0.1 . 1 . . . . 680 ILE N . 10016 2 270 . 1 1 125 125 ASP H H 1 8.41 0.02 . 1 . . . . 682 ASP H . 10016 2 271 . 1 1 125 125 ASP CA C 13 57.04 0.02 . 1 . . . . 682 ASP CA . 10016 2 272 . 1 1 125 125 ASP N N 15 119.21 0.02 . 1 . . . . 682 ASP N . 10016 2 273 . 1 1 131 131 ARG C C 13 174.52 0.02 . 1 . . . . 688 ARG C . 10016 2 274 . 1 1 132 132 VAL H H 1 8.33 0.02 . 1 . . . . 689 VAL H . 10016 2 275 . 1 1 132 132 VAL CA C 13 64.36 0.02 . 1 . . . . 689 VAL CA . 10016 2 276 . 1 1 132 132 VAL N N 15 124.61 0.02 . 1 . . . . 689 VAL N . 10016 2 277 . 1 1 133 133 THR H H 1 7.13 0.02 . 1 . . . . 690 THR H . 10016 2 278 . 1 1 133 133 THR CA C 13 60.94 0.02 . 1 . . . . 690 THR CA . 10016 2 279 . 1 1 133 133 THR N N 15 108.91 0.02 . 1 . . . . 690 THR N . 10016 2 280 . 1 1 134 134 ALA H H 1 8.35 0.02 . 1 . . . . 691 ALA H . 10016 2 281 . 1 1 134 134 ALA CA C 13 51.93 0.02 . 1 . . . . 691 ALA CA . 10016 2 282 . 1 1 134 134 ALA CB C 13 18.68 1.2 . 1 . . . . 691 ALA CB . 10016 2 283 . 1 1 134 134 ALA N N 15 127.62 0.02 . 1 . . . . 691 ALA N . 10016 2 284 . 1 1 135 135 GLY H H 1 9.04 0.02 . 1 . . . . 692 GLY H . 10016 2 285 . 1 1 135 135 GLY CA C 13 43.04 0.02 . 1 . . . . 692 GLY CA . 10016 2 286 . 1 1 135 135 GLY N N 15 112.36 0.02 . 1 . . . . 692 GLY N . 10016 2 287 . 1 1 137 137 ASP C C 13 178.57 0.02 . 1 . . . . 694 ASP C . 10016 2 288 . 1 1 137 137 ASP CA C 13 55.91 0.02 . 1 . . . . 694 ASP CA . 10016 2 289 . 1 1 138 138 GLU H H 1 7.56 0.02 . 1 . . . . 695 GLU H . 10016 2 290 . 1 1 138 138 GLU C C 13 179.13 0.08 . 1 . . . . 695 GLU C . 10016 2 291 . 1 1 138 138 GLU CA C 13 58.2 0.02 . 1 . . . . 695 GLU CA . 10016 2 292 . 1 1 138 138 GLU N N 15 124.65 0.12 . 1 . . . . 695 GLU N . 10016 2 293 . 1 1 139 139 VAL H H 1 8 0.02 . 1 . . . . 696 VAL H . 10016 2 294 . 1 1 139 139 VAL C C 13 176.43 0.02 . 1 . . . . 696 VAL C . 10016 2 295 . 1 1 139 139 VAL CA C 13 66.28 0.02 . 1 . . . . 696 VAL CA . 10016 2 296 . 1 1 139 139 VAL N N 15 124.28 0.02 . 1 . . . . 696 VAL N . 10016 2 297 . 1 1 140 140 GLU H H 1 8 0.02 . 1 . . . . 697 GLU H . 10016 2 298 . 1 1 140 140 GLU C C 13 178.51 0.02 . 1 . . . . 697 GLU C . 10016 2 299 . 1 1 140 140 GLU CA C 13 54.1 0.02 . 1 . . . . 697 GLU CA . 10016 2 300 . 1 1 140 140 GLU CB C 13 27.48 0.02 . 1 . . . . 697 GLU CB . 10016 2 301 . 1 1 140 140 GLU N N 15 120.99 0.17 . 1 . . . . 697 GLU N . 10016 2 302 . 1 1 141 141 ALA H H 1 7.89 0.03 . 1 . . . . 698 ALA H . 10016 2 303 . 1 1 141 141 ALA C C 13 180.94 0.26 . 1 . . . . 698 ALA C . 10016 2 304 . 1 1 141 141 ALA CA C 13 54.1 0.02 . 1 . . . . 698 ALA CA . 10016 2 305 . 1 1 141 141 ALA CB C 13 16.31 0.02 . 1 . . . . 698 ALA CB . 10016 2 306 . 1 1 141 141 ALA N N 15 122.55 0.07 . 1 . . . . 698 ALA N . 10016 2 307 . 1 1 142 142 ALA H H 1 8.17 0.02 . 1 . . . . 699 ALA H . 10016 2 308 . 1 1 142 142 ALA C C 13 178.77 0.09 . 1 . . . . 699 ALA C . 10016 2 309 . 1 1 142 142 ALA CA C 13 54.23 0.02 . 1 . . . . 699 ALA CA . 10016 2 310 . 1 1 142 142 ALA CB C 13 16.36 0.02 . 1 . . . . 699 ALA CB . 10016 2 311 . 1 1 142 142 ALA N N 15 125.53 0.12 . 1 . . . . 699 ALA N . 10016 2 312 . 1 1 143 143 ALA H H 1 8.66 0.03 . 1 . . . . 700 ALA H . 10016 2 313 . 1 1 143 143 ALA C C 13 180.65 0.15 . 1 . . . . 700 ALA C . 10016 2 314 . 1 1 143 143 ALA CA C 13 54.39 0.02 . 1 . . . . 700 ALA CA . 10016 2 315 . 1 1 143 143 ALA CB C 13 18.65 0.02 . 1 . . . . 700 ALA CB . 10016 2 316 . 1 1 143 143 ALA N N 15 122.5 0.14 . 1 . . . . 700 ALA N . 10016 2 317 . 1 1 144 144 GLN H H 1 8.9 0.03 . 1 . . . . 701 GLN H . 10016 2 318 . 1 1 144 144 GLN C C 13 179.53 0.02 . 1 . . . . 701 GLN C . 10016 2 319 . 1 1 144 144 GLN CA C 13 58.03 0.07 . 1 . . . . 701 GLN CA . 10016 2 320 . 1 1 144 144 GLN N N 15 122.17 0.23 . 1 . . . . 701 GLN N . 10016 2 321 . 1 1 145 145 ALA H H 1 8.15 0.02 . 1 . . . . 702 ALA H . 10016 2 322 . 1 1 145 145 ALA C C 13 179.12 0.15 . 1 . . . . 702 ALA C . 10016 2 323 . 1 1 145 145 ALA CA C 13 53.99 0.02 . 1 . . . . 702 ALA CA . 10016 2 324 . 1 1 145 145 ALA CB C 13 17.19 0.02 . 1 . . . . 702 ALA CB . 10016 2 325 . 1 1 145 145 ALA N N 15 126.54 0.09 . 1 . . . . 702 ALA N . 10016 2 326 . 1 1 146 146 ALA H H 1 8.24 0.02 . 1 . . . . 703 ALA H . 10016 2 327 . 1 1 146 146 ALA C C 13 176.44 0.02 . 1 . . . . 703 ALA C . 10016 2 328 . 1 1 146 146 ALA CA C 13 51.45 0.02 . 1 . . . . 703 ALA CA . 10016 2 329 . 1 1 146 146 ALA N N 15 120.36 0.02 . 1 . . . . 703 ALA N . 10016 2 330 . 1 1 147 147 GLY H H 1 7.77 0.02 . 1 . . . . 704 GLY H . 10016 2 331 . 1 1 147 147 GLY C C 13 174.6 0.11 . 1 . . . . 704 GLY C . 10016 2 332 . 1 1 147 147 GLY CA C 13 45.59 0.02 . 1 . . . . 704 GLY CA . 10016 2 333 . 1 1 147 147 GLY N N 15 107.46 0.05 . 1 . . . . 704 GLY N . 10016 2 334 . 1 1 148 148 ILE H H 1 8.44 0.04 . 1 . . . . 705 ILE H . 10016 2 335 . 1 1 148 148 ILE C C 13 173.22 0.02 . 1 . . . . 705 ILE C . 10016 2 336 . 1 1 148 148 ILE CA C 13 56.96 0.1 . 1 . . . . 705 ILE CA . 10016 2 337 . 1 1 148 148 ILE N N 15 118.05 0.02 . 1 . . . . 705 ILE N . 10016 2 338 . 1 1 149 149 HIS H H 1 7.12 0.02 . 1 . . . . 706 HIS H . 10016 2 339 . 1 1 149 149 HIS CA C 13 59.31 0.07 . 1 . . . . 706 HIS CA . 10016 2 340 . 1 1 149 149 HIS N N 15 126.7 0.18 . 1 . . . . 706 HIS N . 10016 2 341 . 1 1 150 150 ASP H H 1 8.53 0.02 . 1 . . . . 707 ASP H . 10016 2 342 . 1 1 150 150 ASP C C 13 178.49 0.02 . 1 . . . . 707 ASP C . 10016 2 343 . 1 1 150 150 ASP CA C 13 56.8 0.18 . 1 . . . . 707 ASP CA . 10016 2 344 . 1 1 150 150 ASP N N 15 119.16 0.02 . 1 . . . . 707 ASP N . 10016 2 345 . 1 1 151 151 ALA H H 1 7.79 0.02 . 1 . . . . 708 ALA H . 10016 2 346 . 1 1 151 151 ALA C C 13 179.14 0.04 . 1 . . . . 708 ALA C . 10016 2 347 . 1 1 151 151 ALA CA C 13 53.56 0.09 . 1 . . . . 708 ALA CA . 10016 2 348 . 1 1 151 151 ALA CB C 13 16.36 0.02 . 1 . . . . 708 ALA CB . 10016 2 349 . 1 1 151 151 ALA N N 15 124.96 0.23 . 1 . . . . 708 ALA N . 10016 2 350 . 1 1 152 152 ILE H H 1 7.33 0.02 . 1 . . . . 709 ILE H . 10016 2 351 . 1 1 152 152 ILE C C 13 178.14 0.04 . 1 . . . . 709 ILE C . 10016 2 352 . 1 1 152 152 ILE CA C 13 62.56 0.04 . 1 . . . . 709 ILE CA . 10016 2 353 . 1 1 152 152 ILE N N 15 120.25 0.23 . 1 . . . . 709 ILE N . 10016 2 354 . 1 1 153 153 MET H H 1 7.76 0.02 . 1 . . . . 710 MET H . 10016 2 355 . 1 1 153 153 MET C C 13 177.51 0.02 . 1 . . . . 710 MET C . 10016 2 356 . 1 1 153 153 MET CA C 13 54.23 0.22 . 1 . . . . 710 MET CA . 10016 2 357 . 1 1 153 153 MET N N 15 116.56 0.04 . 1 . . . . 710 MET N . 10016 2 358 . 1 1 154 154 ALA H H 1 7.02 0.02 . 1 . . . . 711 ALA H . 10016 2 359 . 1 1 154 154 ALA C C 13 178.41 0.1 . 1 . . . . 711 ALA C . 10016 2 360 . 1 1 154 154 ALA CA C 13 50.92 0.02 . 1 . . . . 711 ALA CA . 10016 2 361 . 1 1 154 154 ALA CB C 13 17.56 0.02 . 1 . . . . 711 ALA CB . 10016 2 362 . 1 1 154 154 ALA N N 15 122 0.16 . 1 . . . . 711 ALA N . 10016 2 363 . 1 1 155 155 PHE H H 1 7.78 0.02 . 1 . . . . 712 PHE H . 10016 2 364 . 1 1 155 155 PHE C C 13 176.64 0.02 . 1 . . . . 712 PHE C . 10016 2 365 . 1 1 155 155 PHE CA C 13 52.46 0.02 . 1 . . . . 712 PHE CA . 10016 2 366 . 1 1 155 155 PHE CB C 13 35.09 0.02 . 1 . . . . 712 PHE CB . 10016 2 367 . 1 1 155 155 PHE N N 15 124.63 0.17 . 1 . . . . 712 PHE N . 10016 2 368 . 1 1 156 156 PRO C C 13 177.55 0.02 . 1 . . . . 713 PRO C . 10016 2 369 . 1 1 157 157 GLU H H 1 7.75 0.02 . 1 . . . . 714 GLU H . 10016 2 370 . 1 1 157 157 GLU C C 13 177.35 0.07 . 1 . . . . 714 GLU C . 10016 2 371 . 1 1 157 157 GLU CA C 13 53.68 0.02 . 1 . . . . 714 GLU CA . 10016 2 372 . 1 1 157 157 GLU N N 15 114.16 0.04 . 1 . . . . 714 GLU N . 10016 2 373 . 1 1 158 158 GLY H H 1 7.71 0.02 . 1 . . . . 715 GLY H . 10016 2 374 . 1 1 158 158 GLY C C 13 177.94 0.11 . 1 . . . . 715 GLY C . 10016 2 375 . 1 1 158 158 GLY CA C 13 45.59 0.14 . 1 . . . . 715 GLY CA . 10016 2 376 . 1 1 158 158 GLY N N 15 110.86 0.02 . 1 . . . . 715 GLY N . 10016 2 377 . 1 1 159 159 TYR H H 1 9.59 0.02 . 1 . . . . 716 TYR H . 10016 2 378 . 1 1 159 159 TYR C C 13 175.46 0.02 . 1 . . . . 716 TYR C . 10016 2 379 . 1 1 159 159 TYR CA C 13 61.97 0.09 . 1 . . . . 716 TYR CA . 10016 2 380 . 1 1 159 159 TYR N N 15 128.71 0.03 . 1 . . . . 716 TYR N . 10016 2 381 . 1 1 160 160 ARG H H 1 7.99 0.02 . 1 . . . . 717 ARG H . 10016 2 382 . 1 1 160 160 ARG C C 13 174.93 0.02 . 1 . . . . 717 ARG C . 10016 2 383 . 1 1 160 160 ARG CA C 13 54.88 0.02 . 1 . . . . 717 ARG CA . 10016 2 384 . 1 1 160 160 ARG N N 15 117.99 0.03 . 1 . . . . 717 ARG N . 10016 2 385 . 1 1 161 161 THR H H 1 7.56 0.02 . 1 . . . . 718 THR H . 10016 2 386 . 1 1 161 161 THR C C 13 174.13 0.02 . 1 . . . . 718 THR C . 10016 2 387 . 1 1 161 161 THR CA C 13 64.17 0.1 . 1 . . . . 718 THR CA . 10016 2 388 . 1 1 161 161 THR N N 15 119.38 0.02 . 1 . . . . 718 THR N . 10016 2 389 . 1 1 162 162 GLN H H 1 9.04 0.02 . 1 . . . . 719 GLN H . 10016 2 390 . 1 1 162 162 GLN C C 13 176.16 0.02 . 1 . . . . 719 GLN C . 10016 2 391 . 1 1 162 162 GLN CA C 13 55.39 0.18 . 1 . . . . 719 GLN CA . 10016 2 392 . 1 1 162 162 GLN CB C 13 26.36 0.02 . 1 . . . . 719 GLN CB . 10016 2 393 . 1 1 162 162 GLN N N 15 129.44 0.06 . 1 . . . . 719 GLN N . 10016 2 394 . 1 1 163 163 VAL H H 1 8.31 0.02 . 1 . . . . 720 VAL H . 10016 2 395 . 1 1 163 163 VAL C C 13 174.06 0.02 . 1 . . . . 720 VAL C . 10016 2 396 . 1 1 163 163 VAL CA C 13 59.06 0.2 . 1 . . . . 720 VAL CA . 10016 2 397 . 1 1 163 163 VAL CB C 13 32.04 0.02 . 1 . . . . 720 VAL CB . 10016 2 398 . 1 1 163 163 VAL N N 15 120.99 0.15 . 1 . . . . 720 VAL N . 10016 2 399 . 1 1 164 164 GLY H H 1 8.11 0.02 . 1 . . . . 721 GLY H . 10016 2 400 . 1 1 164 164 GLY C C 13 173.91 0.02 . 1 . . . . 721 GLY C . 10016 2 401 . 1 1 164 164 GLY CA C 13 43.09 0.11 . 1 . . . . 721 GLY CA . 10016 2 402 . 1 1 164 164 GLY N N 15 107.78 0.25 . 1 . . . . 721 GLY N . 10016 2 403 . 1 1 165 165 GLU H H 1 8.45 0.02 . 1 . . . . 722 GLU H . 10016 2 404 . 1 1 165 165 GLU CA C 13 58.23 0.02 . 1 . . . . 722 GLU CA . 10016 2 405 . 1 1 165 165 GLU N N 15 123.26 0.03 . 1 . . . . 722 GLU N . 10016 2 406 . 1 1 166 166 ARG C C 13 175.68 0.02 . 1 . . . . 723 ARG C . 10016 2 407 . 1 1 166 166 ARG CA C 13 54.86 0.02 . 1 . . . . 723 ARG CA . 10016 2 408 . 1 1 167 167 GLY H H 1 7.4 0.02 . 1 . . . . 724 GLY H . 10016 2 409 . 1 1 167 167 GLY C C 13 172.11 0.1 . 1 . . . . 724 GLY C . 10016 2 410 . 1 1 167 167 GLY CA C 13 42.77 0.27 . 1 . . . . 724 GLY CA . 10016 2 411 . 1 1 167 167 GLY N N 15 111.1 0.09 . 1 . . . . 724 GLY N . 10016 2 412 . 1 1 168 168 LEU H H 1 8.31 0.02 . 1 . . . . 725 LEU H . 10016 2 413 . 1 1 168 168 LEU C C 13 175.79 0.07 . 1 . . . . 725 LEU C . 10016 2 414 . 1 1 168 168 LEU CA C 13 54.74 0.02 . 1 . . . . 725 LEU CA . 10016 2 415 . 1 1 168 168 LEU CB C 13 40.81 0.02 . 1 . . . . 725 LEU CB . 10016 2 416 . 1 1 168 168 LEU N N 15 128.03 0.15 . 1 . . . . 725 LEU N . 10016 2 417 . 1 1 169 169 LYS H H 1 8.4 0.02 . 1 . . . . 726 LYS H . 10016 2 418 . 1 1 169 169 LYS C C 13 175.68 0.02 . 1 . . . . 726 LYS C . 10016 2 419 . 1 1 169 169 LYS CA C 13 54.83 0.02 . 1 . . . . 726 LYS CA . 10016 2 420 . 1 1 169 169 LYS N N 15 127.97 0.17 . 1 . . . . 726 LYS N . 10016 2 421 . 1 1 170 170 LEU H H 1 8.14 0.02 . 1 . . . . 727 LEU H . 10016 2 422 . 1 1 170 170 LEU C C 13 176.81 0.02 . 1 . . . . 727 LEU C . 10016 2 423 . 1 1 170 170 LEU CA C 13 53.22 0.22 . 1 . . . . 727 LEU CA . 10016 2 424 . 1 1 170 170 LEU N N 15 129.43 0.02 . 1 . . . . 727 LEU N . 10016 2 425 . 1 1 171 171 SER H H 1 9.39 0.02 . 1 . . . . 728 SER H . 10016 2 426 . 1 1 171 171 SER CA C 13 56.51 0.02 . 1 . . . . 728 SER CA . 10016 2 427 . 1 1 171 171 SER N N 15 120.89 0.07 . 1 . . . . 728 SER N . 10016 2 428 . 1 1 174 174 GLU C C 13 178.63 0.02 . 1 . . . . 731 GLU C . 10016 2 429 . 1 1 175 175 LYS H H 1 8.76 0.03 . 1 . . . . 732 LYS H . 10016 2 430 . 1 1 175 175 LYS C C 13 178.61 0.02 . 1 . . . . 732 LYS C . 10016 2 431 . 1 1 175 175 LYS CA C 13 60.63 0.02 . 1 . . . . 732 LYS CA . 10016 2 432 . 1 1 175 175 LYS N N 15 120.26 0.16 . 1 . . . . 732 LYS N . 10016 2 433 . 1 1 176 176 GLN C C 13 178.83 0.02 . 1 . . . . 733 GLN C . 10016 2 434 . 1 1 177 177 ARG H H 1 7.91 0.02 . 1 . . . . 734 ARG H . 10016 2 435 . 1 1 177 177 ARG CA C 13 59.29 0.02 . 1 . . . . 734 ARG CA . 10016 2 436 . 1 1 177 177 ARG N N 15 120.07 0.02 . 1 . . . . 734 ARG N . 10016 2 437 . 1 1 178 178 VAL H H 1 8.3 0.02 . 1 . . . . 735 VAL H . 10016 2 438 . 1 1 178 178 VAL C C 13 177.18 0.02 . 1 . . . . 735 VAL C . 10016 2 439 . 1 1 178 178 VAL CA C 13 66.71 0.02 . 1 . . . . 735 VAL CA . 10016 2 440 . 1 1 178 178 VAL N N 15 123.76 0.02 . 1 . . . . 735 VAL N . 10016 2 441 . 1 1 179 179 ALA H H 1 7.91 0.02 . 1 . . . . 736 ALA H . 10016 2 442 . 1 1 179 179 ALA CA C 13 55 0.02 . 1 . . . . 736 ALA CA . 10016 2 443 . 1 1 179 179 ALA N N 15 124.1 0.03 . 1 . . . . 736 ALA N . 10016 2 444 . 1 1 180 180 ILE C C 13 176.59 0.02 . 1 . . . . 737 ILE C . 10016 2 445 . 1 1 181 181 ALA H H 1 8.73 0.02 . 1 . . . . 738 ALA H . 10016 2 446 . 1 1 181 181 ALA C C 13 178.47 0.02 . 1 . . . . 738 ALA C . 10016 2 447 . 1 1 181 181 ALA CA C 13 54.82 0.02 . 1 . . . . 738 ALA CA . 10016 2 448 . 1 1 181 181 ALA N N 15 125.43 0.06 . 1 . . . . 738 ALA N . 10016 2 449 . 1 1 182 182 ARG H H 1 8.74 0.03 . 1 . . . . 739 ARG H . 10016 2 450 . 1 1 182 182 ARG CA C 13 58.89 0.02 . 1 . . . . 739 ARG CA . 10016 2 451 . 1 1 182 182 ARG N N 15 117.87 0.13 . 1 . . . . 739 ARG N . 10016 2 452 . 1 1 186 186 LYS C C 13 175.36 0.02 . 1 . . . . 743 LYS C . 10016 2 453 . 1 1 187 187 ALA H H 1 8.27 0.02 . 1 . . . . 744 ALA H . 10016 2 454 . 1 1 187 187 ALA C C 13 173.5 0.02 . 1 . . . . 744 ALA C . 10016 2 455 . 1 1 187 187 ALA CA C 13 51.38 0.02 . 1 . . . . 744 ALA CA . 10016 2 456 . 1 1 187 187 ALA N N 15 120.06 0.02 . 1 . . . . 744 ALA N . 10016 2 457 . 1 1 189 189 GLY C C 13 173.28 0.02 . 1 . . . . 746 GLY C . 10016 2 458 . 1 1 189 189 GLY CA C 13 44.9 0.02 . 1 . . . . 746 GLY CA . 10016 2 459 . 1 1 190 190 ILE H H 1 7.97 0.02 . 1 . . . . 747 ILE H . 10016 2 460 . 1 1 190 190 ILE CA C 13 58.64 0.02 . 1 . . . . 747 ILE CA . 10016 2 461 . 1 1 190 190 ILE N N 15 122.57 0.13 . 1 . . . . 747 ILE N . 10016 2 462 . 1 1 191 191 ILE H H 1 9.27 0.02 . 1 . . . . 748 ILE H . 10016 2 463 . 1 1 191 191 ILE C C 13 172.95 0.02 . 1 . . . . 748 ILE C . 10016 2 464 . 1 1 191 191 ILE CA C 13 57.68 0.02 . 1 . . . . 748 ILE CA . 10016 2 465 . 1 1 191 191 ILE N N 15 129.57 0.02 . 1 . . . . 748 ILE N . 10016 2 466 . 1 1 192 192 LEU H H 1 8.87 0.02 . 1 . . . . 749 LEU H . 10016 2 467 . 1 1 192 192 LEU C C 13 174.39 0.02 . 1 . . . . 749 LEU C . 10016 2 468 . 1 1 192 192 LEU CA C 13 51.41 0.02 . 1 . . . . 749 LEU CA . 10016 2 469 . 1 1 192 192 LEU N N 15 126.56 0.02 . 1 . . . . 749 LEU N . 10016 2 470 . 1 1 193 193 LEU H H 1 9.12 0.02 . 1 . . . . 750 LEU H . 10016 2 471 . 1 1 193 193 LEU CA C 13 52.46 0.02 . 1 . . . . 750 LEU CA . 10016 2 472 . 1 1 193 193 LEU N N 15 126.26 0.02 . 1 . . . . 750 LEU N . 10016 2 473 . 1 1 209 209 GLN C C 13 178.48 0.02 . 1 . . . . 766 GLN C . 10016 2 474 . 1 1 210 210 ALA H H 1 8.05 0.02 . 1 . . . . 767 ALA H . 10016 2 475 . 1 1 210 210 ALA CA C 13 54.15 0.02 . 1 . . . . 767 ALA CA . 10016 2 476 . 1 1 210 210 ALA N N 15 124.01 0.02 . 1 . . . . 767 ALA N . 10016 2 477 . 1 1 211 211 SER H H 1 7.97 0.02 . 1 . . . . 768 SER H . 10016 2 478 . 1 1 211 211 SER CA C 13 61.32 0.02 . 1 . . . . 768 SER CA . 10016 2 479 . 1 1 211 211 SER N N 15 118.4 0.02 . 1 . . . . 768 SER N . 10016 2 480 . 1 1 214 214 LYS C C 13 177.24 0.02 . 1 . . . . 771 LYS C . 10016 2 481 . 1 1 214 214 LYS CA C 13 56.8 0.02 . 1 . . . . 771 LYS CA . 10016 2 482 . 1 1 215 215 VAL H H 1 8.16 0.02 . 1 . . . . 772 VAL H . 10016 2 483 . 1 1 215 215 VAL C C 13 177.11 0.02 . 1 . . . . 772 VAL C . 10016 2 484 . 1 1 215 215 VAL CA C 13 62.92 0.02 . 1 . . . . 772 VAL CA . 10016 2 485 . 1 1 215 215 VAL CB C 13 31.02 0.02 . 1 . . . . 772 VAL CB . 10016 2 486 . 1 1 215 215 VAL N N 15 123.88 0.14 . 1 . . . . 772 VAL N . 10016 2 487 . 1 1 217 217 ALA C C 13 177.58 0.02 . 1 . . . . 774 ALA C . 10016 2 488 . 1 1 218 218 ASN H H 1 9.08 0.02 . 1 . . . . 775 ASN H . 10016 2 489 . 1 1 218 218 ASN CA C 13 53.89 0.02 . 1 . . . . 775 ASN CA . 10016 2 490 . 1 1 218 218 ASN N N 15 116.76 0.02 . 1 . . . . 775 ASN N . 10016 2 491 . 1 1 220 220 THR C C 13 172.68 0.02 . 1 . . . . 777 THR C . 10016 2 492 . 1 1 220 220 THR CA C 13 63.14 0.02 . 1 . . . . 777 THR CA . 10016 2 493 . 1 1 221 221 THR H H 1 9.04 0.02 . 1 . . . . 778 THR H . 10016 2 494 . 1 1 221 221 THR C C 13 173.23 0.02 . 1 . . . . 778 THR C . 10016 2 495 . 1 1 221 221 THR CA C 13 61.13 0.02 . 1 . . . . 778 THR CA . 10016 2 496 . 1 1 221 221 THR N N 15 127.81 0.04 . 1 . . . . 778 THR N . 10016 2 497 . 1 1 222 222 ILE H H 1 8.75 0.02 . 1 . . . . 779 ILE H . 10016 2 498 . 1 1 222 222 ILE CA C 13 59.13 0.02 . 1 . . . . 779 ILE CA . 10016 2 499 . 1 1 222 222 ILE N N 15 126.17 0.17 . 1 . . . . 779 ILE N . 10016 2 500 . 1 1 223 223 VAL H H 1 9.22 0.02 . 1 . . . . 780 VAL H . 10016 2 501 . 1 1 223 223 VAL CA C 13 57.62 0.02 . 1 . . . . 780 VAL CA . 10016 2 502 . 1 1 223 223 VAL N N 15 127.55 0.02 . 1 . . . . 780 VAL N . 10016 2 503 . 1 1 224 224 VAL CA C 13 60.83 0.02 . 1 . . . . 781 VAL CA . 10016 2 504 . 1 1 225 225 ALA H H 1 8 0.02 . 1 . . . . 782 ALA H . 10016 2 505 . 1 1 225 225 ALA CA C 13 49.94 0.02 . 1 . . . . 782 ALA CA . 10016 2 506 . 1 1 225 225 ALA N N 15 130.42 0.02 . 1 . . . . 782 ALA N . 10016 2 507 . 1 1 233 233 ASN C C 13 175.09 0.02 . 1 . . . . 790 ASN C . 10016 2 508 . 1 1 233 233 ASN CA C 13 51.67 0.02 . 1 . . . . 790 ASN CA . 10016 2 509 . 1 1 234 234 ALA H H 1 7.93 0.02 . 1 . . . . 791 ALA H . 10016 2 510 . 1 1 234 234 ALA CA C 13 52.59 0.02 . 1 . . . . 791 ALA CA . 10016 2 511 . 1 1 234 234 ALA N N 15 126.77 0.06 . 1 . . . . 791 ALA N . 10016 2 512 . 1 1 235 235 ASP C C 13 175.39 0.02 . 1 . . . . 792 ASP C . 10016 2 513 . 1 1 235 235 ASP CA C 13 56.79 0.02 . 1 . . . . 792 ASP CA . 10016 2 514 . 1 1 236 236 GLN H H 1 7.59 0.02 . 1 . . . . 793 GLN H . 10016 2 515 . 1 1 236 236 GLN C C 13 171.14 0.02 . 1 . . . . 793 GLN C . 10016 2 516 . 1 1 236 236 GLN CA C 13 55.05 0.08 . 1 . . . . 793 GLN CA . 10016 2 517 . 1 1 236 236 GLN CB C 13 31.72 0.02 . 1 . . . . 793 GLN CB . 10016 2 518 . 1 1 236 236 GLN N N 15 116 0.06 . 1 . . . . 793 GLN N . 10016 2 519 . 1 1 237 237 ILE H H 1 8.67 0.02 . 1 . . . . 794 ILE H . 10016 2 520 . 1 1 237 237 ILE CA C 13 59.66 0.08 . 1 . . . . 794 ILE CA . 10016 2 521 . 1 1 237 237 ILE CB C 13 37.7 0.02 . 1 . . . . 794 ILE CB . 10016 2 522 . 1 1 237 237 ILE N N 15 128.86 0.22 . 1 . . . . 794 ILE N . 10016 2 523 . 1 1 238 238 LEU H H 1 9 0.02 . 1 . . . . 795 LEU H . 10016 2 524 . 1 1 238 238 LEU CA C 13 52.05 0.15 . 1 . . . . 795 LEU CA . 10016 2 525 . 1 1 238 238 LEU N N 15 126.26 0.02 . 1 . . . . 795 LEU N . 10016 2 526 . 1 1 239 239 VAL H H 1 8.51 0.02 . 1 . . . . 796 VAL H . 10016 2 527 . 1 1 239 239 VAL C C 13 174.46 0.1 . 1 . . . . 796 VAL C . 10016 2 528 . 1 1 239 239 VAL CA C 13 59.51 0.04 . 1 . . . . 796 VAL CA . 10016 2 529 . 1 1 239 239 VAL CB C 13 29.17 0.02 . 1 . . . . 796 VAL CB . 10016 2 530 . 1 1 239 239 VAL N N 15 124.68 0.02 . 1 . . . . 796 VAL N . 10016 2 531 . 1 1 240 240 ILE H H 1 9.38 0.02 . 1 . . . . 797 ILE H . 10016 2 532 . 1 1 240 240 ILE CA C 13 57.23 0.02 . 1 . . . . 797 ILE CA . 10016 2 533 . 1 1 240 240 ILE CB C 13 37.13 0.02 . 1 . . . . 797 ILE CB . 10016 2 534 . 1 1 240 240 ILE N N 15 131.57 0.06 . 1 . . . . 797 ILE N . 10016 2 535 . 1 1 242 242 ASP H H 1 9.65 0.02 . 1 . . . . 799 ASP H . 10016 2 536 . 1 1 242 242 ASP CA C 13 54.96 0.02 . 1 . . . . 799 ASP CA . 10016 2 537 . 1 1 242 242 ASP N N 15 129.62 0.02 . 1 . . . . 799 ASP N . 10016 2 538 . 1 1 243 243 GLY C C 13 172.04 0.02 . 1 . . . . 800 GLY C . 10016 2 539 . 1 1 244 244 CYS H H 1 7.62 0.02 . 1 . . . . 801 CYS H . 10016 2 540 . 1 1 244 244 CYS C C 13 173.79 0.14 . 1 . . . . 801 CYS C . 10016 2 541 . 1 1 244 244 CYS CA C 13 55.43 0.12 . 1 . . . . 801 CYS CA . 10016 2 542 . 1 1 244 244 CYS CB C 13 30.39 0.02 . 1 . . . . 801 CYS CB . 10016 2 543 . 1 1 244 244 CYS N N 15 116.59 0.07 . 1 . . . . 801 CYS N . 10016 2 544 . 1 1 245 245 ILE H H 1 9.17 0.02 . 1 . . . . 802 ILE H . 10016 2 545 . 1 1 245 245 ILE C C 13 176.96 0.02 . 1 . . . . 802 ILE C . 10016 2 546 . 1 1 245 245 ILE CA C 13 60.25 0.09 . 1 . . . . 802 ILE CA . 10016 2 547 . 1 1 245 245 ILE N N 15 124.05 0.09 . 1 . . . . 802 ILE N . 10016 2 548 . 1 1 246 246 VAL H H 1 9.18 0.02 . 1 . . . . 803 VAL H . 10016 2 549 . 1 1 246 246 VAL C C 13 175.88 0.02 . 1 . . . . 803 VAL C . 10016 2 550 . 1 1 246 246 VAL CA C 13 61.45 0.17 . 1 . . . . 803 VAL CA . 10016 2 551 . 1 1 246 246 VAL N N 15 126.19 0.2 . 1 . . . . 803 VAL N . 10016 2 552 . 1 1 247 247 GLU H H 1 7.64 0.03 . 1 . . . . 804 GLU H . 10016 2 553 . 1 1 247 247 GLU C C 13 173.12 0.12 . 1 . . . . 804 GLU C . 10016 2 554 . 1 1 247 247 GLU CA C 13 54.66 0.11 . 1 . . . . 804 GLU CA . 10016 2 555 . 1 1 247 247 GLU CB C 13 33.52 0.02 . 1 . . . . 804 GLU CB . 10016 2 556 . 1 1 247 247 GLU N N 15 120.9 0.35 . 1 . . . . 804 GLU N . 10016 2 557 . 1 1 248 248 ARG H H 1 8.49 0.02 . 1 . . . . 805 ARG H . 10016 2 558 . 1 1 248 248 ARG C C 13 174.22 0.03 . 1 . . . . 805 ARG C . 10016 2 559 . 1 1 248 248 ARG CA C 13 53.48 0.04 . 1 . . . . 805 ARG CA . 10016 2 560 . 1 1 248 248 ARG CB C 13 33.23 0.02 . 1 . . . . 805 ARG CB . 10016 2 561 . 1 1 248 248 ARG N N 15 118.57 0.06 . 1 . . . . 805 ARG N . 10016 2 562 . 1 1 249 249 GLY H H 1 8.69 0.02 . 1 . . . . 806 GLY H . 10016 2 563 . 1 1 249 249 GLY C C 13 171.1 0.09 . 1 . . . . 806 GLY C . 10016 2 564 . 1 1 249 249 GLY CA C 13 44.21 0.08 . 1 . . . . 806 GLY CA . 10016 2 565 . 1 1 249 249 GLY N N 15 111.29 0.19 . 1 . . . . 806 GLY N . 10016 2 566 . 1 1 250 250 ARG H H 1 8.04 0.02 . 1 . . . . 807 ARG H . 10016 2 567 . 1 1 250 250 ARG C C 13 175.76 0.02 . 1 . . . . 807 ARG C . 10016 2 568 . 1 1 250 250 ARG CA C 13 54.91 0.02 . 1 . . . . 807 ARG CA . 10016 2 569 . 1 1 250 250 ARG CB C 13 30.3 0.02 . 1 . . . . 807 ARG CB . 10016 2 570 . 1 1 250 250 ARG N N 15 120.46 0.15 . 1 . . . . 807 ARG N . 10016 2 571 . 1 1 251 251 HIS H H 1 8.84 0.02 . 1 . . . . 808 HIS H . 10016 2 572 . 1 1 251 251 HIS C C 13 175.33 0.02 . 1 . . . . 808 HIS C . 10016 2 573 . 1 1 251 251 HIS CA C 13 59.99 0.34 . 1 . . . . 808 HIS CA . 10016 2 574 . 1 1 251 251 HIS N N 15 123.14 0.02 . 1 . . . . 808 HIS N . 10016 2 575 . 1 1 252 252 GLU H H 1 9.06 0.02 . 1 . . . . 809 GLU H . 10016 2 576 . 1 1 252 252 GLU C C 13 178.85 0.07 . 1 . . . . 809 GLU C . 10016 2 577 . 1 1 252 252 GLU CA C 13 59.29 0.07 . 1 . . . . 809 GLU CA . 10016 2 578 . 1 1 252 252 GLU CB C 13 26.8 0.02 . 1 . . . . 809 GLU CB . 10016 2 579 . 1 1 252 252 GLU N N 15 116.98 0.05 . 1 . . . . 809 GLU N . 10016 2 580 . 1 1 253 253 ALA H H 1 7.05 0.02 . 1 . . . . 810 ALA H . 10016 2 581 . 1 1 253 253 ALA C C 13 180.47 0.02 . 1 . . . . 810 ALA C . 10016 2 582 . 1 1 253 253 ALA CA C 13 53.31 0.02 . 1 . . . . 810 ALA CA . 10016 2 583 . 1 1 253 253 ALA CB C 13 17.16 0.02 . 1 . . . . 810 ALA CB . 10016 2 584 . 1 1 253 253 ALA N N 15 124.2 0.25 . 1 . . . . 810 ALA N . 10016 2 585 . 1 1 254 254 LEU H H 1 8.24 0.02 . 1 . . . . 811 LEU H . 10016 2 586 . 1 1 254 254 LEU C C 13 180.5 0.02 . 1 . . . . 811 LEU C . 10016 2 587 . 1 1 254 254 LEU CA C 13 56.71 0.02 . 1 . . . . 811 LEU CA . 10016 2 588 . 1 1 254 254 LEU N N 15 122.31 0.02 . 1 . . . . 811 LEU N . 10016 2 589 . 1 1 255 255 LEU H H 1 8.32 0.02 . 1 . . . . 812 LEU H . 10016 2 590 . 1 1 255 255 LEU C C 13 180 0.04 . 1 . . . . 812 LEU C . 10016 2 591 . 1 1 255 255 LEU CA C 13 57.05 0.1 . 1 . . . . 812 LEU CA . 10016 2 592 . 1 1 255 255 LEU CB C 13 39.79 0.02 . 1 . . . . 812 LEU CB . 10016 2 593 . 1 1 255 255 LEU N N 15 122.36 0.15 . 1 . . . . 812 LEU N . 10016 2 594 . 1 1 256 256 SER H H 1 7.64 0.02 . 1 . . . . 813 SER H . 10016 2 595 . 1 1 256 256 SER C C 13 175.09 0.04 . 1 . . . . 813 SER C . 10016 2 596 . 1 1 256 256 SER CA C 13 60 0.15 . 1 . . . . 813 SER CA . 10016 2 597 . 1 1 256 256 SER CB C 13 62.41 0.02 . 1 . . . . 813 SER CB . 10016 2 598 . 1 1 256 256 SER N N 15 116.6 0.13 . 1 . . . . 813 SER N . 10016 2 599 . 1 1 257 257 ARG H H 1 7.48 0.02 . 1 . . . . 814 ARG H . 10016 2 600 . 1 1 257 257 ARG C C 13 178.33 0.17 . 1 . . . . 814 ARG C . 10016 2 601 . 1 1 257 257 ARG CA C 13 56.52 0.03 . 1 . . . . 814 ARG CA . 10016 2 602 . 1 1 257 257 ARG CB C 13 29.46 0.02 . 1 . . . . 814 ARG CB . 10016 2 603 . 1 1 257 257 ARG N N 15 121.34 0.07 . 1 . . . . 814 ARG N . 10016 2 604 . 1 1 258 258 GLY H H 1 7.38 0.02 . 1 . . . . 815 GLY H . 10016 2 605 . 1 1 258 258 GLY C C 13 173.71 0.09 . 1 . . . . 815 GLY C . 10016 2 606 . 1 1 258 258 GLY CA C 13 46.18 0.06 . 1 . . . . 815 GLY CA . 10016 2 607 . 1 1 258 258 GLY N N 15 106.11 0.02 . 1 . . . . 815 GLY N . 10016 2 608 . 1 1 259 259 GLY H H 1 8.5 0.02 . 1 . . . . 816 GLY H . 10016 2 609 . 1 1 259 259 GLY C C 13 173.47 0.02 . 1 . . . . 816 GLY C . 10016 2 610 . 1 1 259 259 GLY CA C 13 43.4 0.02 . 1 . . . . 816 GLY CA . 10016 2 611 . 1 1 259 259 GLY N N 15 113.43 0.17 . 1 . . . . 816 GLY N . 10016 2 612 . 1 1 260 260 VAL H H 1 9.77 0.02 . 1 . . . . 817 VAL H . 10016 2 613 . 1 1 260 260 VAL N N 15 129.44 0.02 . 1 . . . . 817 VAL N . 10016 2 614 . 1 1 261 261 TYR H H 1 9.39 0.02 . 1 . . . . 818 TYR H . 10016 2 615 . 1 1 261 261 TYR CA C 13 61.57 0.02 . 1 . . . . 818 TYR CA . 10016 2 616 . 1 1 261 261 TYR N N 15 124.37 0.02 . 1 . . . . 818 TYR N . 10016 2 617 . 1 1 262 262 ALA C C 13 179.71 0.02 . 1 . . . . 819 ALA C . 10016 2 618 . 1 1 262 262 ALA CA C 13 54.21 0.02 . 1 . . . . 819 ALA CA . 10016 2 619 . 1 1 263 263 ASP H H 1 8.32 0.02 . 1 . . . . 820 ASP H . 10016 2 620 . 1 1 263 263 ASP C C 13 178.78 0.02 . 1 . . . . 820 ASP C . 10016 2 621 . 1 1 263 263 ASP CA C 13 56.56 0.02 . 1 . . . . 820 ASP CA . 10016 2 622 . 1 1 263 263 ASP N N 15 121.34 0.02 . 1 . . . . 820 ASP N . 10016 2 623 . 1 1 264 264 MET H H 1 8.17 0.02 . 1 . . . . 821 MET H . 10016 2 624 . 1 1 264 264 MET CA C 13 58.96 0.02 . 1 . . . . 821 MET CA . 10016 2 625 . 1 1 264 264 MET N N 15 122.92 0.02 . 1 . . . . 821 MET N . 10016 2 626 . 1 1 265 265 TRP C C 13 177.97 0.02 . 1 . . . . 822 TRP C . 10016 2 627 . 1 1 266 266 GLN H H 1 8.25 0.02 . 1 . . . . 823 GLN H . 10016 2 628 . 1 1 266 266 GLN C C 13 178.73 0.02 . 1 . . . . 823 GLN C . 10016 2 629 . 1 1 266 266 GLN CA C 13 57.72 0.02 . 1 . . . . 823 GLN CA . 10016 2 630 . 1 1 266 266 GLN N N 15 119.68 0.03 . 1 . . . . 823 GLN N . 10016 2 631 . 1 1 267 267 LEU H H 1 7.74 0.02 . 1 . . . . 824 LEU H . 10016 2 632 . 1 1 267 267 LEU CA C 13 56.62 0.02 . 1 . . . . 824 LEU CA . 10016 2 633 . 1 1 267 267 LEU N N 15 121.86 0.12 . 1 . . . . 824 LEU N . 10016 2 634 . 1 1 268 268 GLN H H 1 7.8 0.02 . 1 . . . . 825 GLN H . 10016 2 635 . 1 1 268 268 GLN C C 13 177.33 0.02 . 1 . . . . 825 GLN C . 10016 2 636 . 1 1 268 268 GLN CA C 13 56.91 0.05 . 1 . . . . 825 GLN CA . 10016 2 637 . 1 1 268 268 GLN N N 15 118.83 0.02 . 1 . . . . 825 GLN N . 10016 2 638 . 1 1 269 269 GLN H H 1 7.95 0.02 . 1 . . . . 826 GLN H . 10016 2 639 . 1 1 269 269 GLN C C 13 177.11 0.07 . 1 . . . . 826 GLN C . 10016 2 640 . 1 1 269 269 GLN CA C 13 55.54 0.04 . 1 . . . . 826 GLN CA . 10016 2 641 . 1 1 269 269 GLN CB C 13 27.49 0.02 . 1 . . . . 826 GLN CB . 10016 2 642 . 1 1 269 269 GLN N N 15 120.23 0.15 . 1 . . . . 826 GLN N . 10016 2 643 . 1 1 270 270 GLY H H 1 7.91 0.02 . 1 . . . . 827 GLY H . 10016 2 644 . 1 1 270 270 GLY C C 13 174.07 0.08 . 1 . . . . 827 GLY C . 10016 2 645 . 1 1 270 270 GLY CA C 13 44.74 0.13 . 1 . . . . 827 GLY CA . 10016 2 646 . 1 1 270 270 GLY N N 15 109.64 0.03 . 1 . . . . 827 GLY N . 10016 2 647 . 1 1 271 271 GLN H H 1 7.96 0.02 . 1 . . . . 828 GLN H . 10016 2 648 . 1 1 271 271 GLN C C 13 175.87 0.06 . 1 . . . . 828 GLN C . 10016 2 649 . 1 1 271 271 GLN CA C 13 54.89 0.02 . 1 . . . . 828 GLN CA . 10016 2 650 . 1 1 271 271 GLN CB C 13 28.13 0.02 . 1 . . . . 828 GLN CB . 10016 2 651 . 1 1 271 271 GLN N N 15 121.32 0.03 . 1 . . . . 828 GLN N . 10016 2 652 . 1 1 272 272 GLU H H 1 8.36 0.02 . 1 . . . . 829 GLU H . 10016 2 653 . 1 1 272 272 GLU C C 13 176.29 0.02 . 1 . . . . 829 GLU C . 10016 2 654 . 1 1 272 272 GLU CA C 13 55.79 0.05 . 1 . . . . 829 GLU CA . 10016 2 655 . 1 1 272 272 GLU CB C 13 28.75 0.02 . 1 . . . . 829 GLU CB . 10016 2 656 . 1 1 272 272 GLU N N 15 123.81 0.03 . 1 . . . . 829 GLU N . 10016 2 657 . 1 1 273 273 GLU H H 1 8.55 0.02 . 1 . . . . 830 GLU H . 10016 2 658 . 1 1 273 273 GLU C C 13 176.37 0.05 . 1 . . . . 830 GLU C . 10016 2 659 . 1 1 273 273 GLU CA C 13 55.7 0.02 . 1 . . . . 830 GLU CA . 10016 2 660 . 1 1 273 273 GLU CB C 13 28.98 0.02 . 1 . . . . 830 GLU CB . 10016 2 661 . 1 1 273 273 GLU N N 15 124.41 0.06 . 1 . . . . 830 GLU N . 10016 2 662 . 1 1 274 274 THR H H 1 8.4 0.02 . 1 . . . . 831 THR H . 10016 2 663 . 1 1 274 274 THR C C 13 174.2 0.02 . 1 . . . . 831 THR C . 10016 2 664 . 1 1 274 274 THR CA C 13 60.77 0.12 . 1 . . . . 831 THR CA . 10016 2 665 . 1 1 274 274 THR CB C 13 69.01 0.08 . 1 . . . . 831 THR CB . 10016 2 666 . 1 1 274 274 THR N N 15 117.91 0.07 . 1 . . . . 831 THR N . 10016 2 667 . 1 1 275 275 SER H H 1 8.53 0.02 . 1 . . . . 832 SER H . 10016 2 668 . 1 1 275 275 SER C C 13 174.37 0.03 . 1 . . . . 832 SER C . 10016 2 669 . 1 1 275 275 SER CA C 13 57.52 0.02 . 1 . . . . 832 SER CA . 10016 2 670 . 1 1 275 275 SER CB C 13 63.13 0.02 . 1 . . . . 832 SER CB . 10016 2 671 . 1 1 275 275 SER N N 15 120.73 0.02 . 1 . . . . 832 SER N . 10016 2 672 . 1 1 276 276 GLU H H 1 8.66 0.02 . 1 . . . . 833 GLU H . 10016 2 673 . 1 1 276 276 GLU C C 13 175.99 0.02 . 1 . . . . 833 GLU C . 10016 2 674 . 1 1 276 276 GLU CA C 13 55.82 0.17 . 1 . . . . 833 GLU CA . 10016 2 675 . 1 1 276 276 GLU CB C 13 28.94 0.09 . 1 . . . . 833 GLU CB . 10016 2 676 . 1 1 276 276 GLU N N 15 125.21 0.06 . 1 . . . . 833 GLU N . 10016 2 677 . 1 1 277 277 ASP H H 1 8.48 0.02 . 1 . . . . 834 ASP H . 10016 2 678 . 1 1 277 277 ASP C C 13 176.07 0.05 . 1 . . . . 834 ASP C . 10016 2 679 . 1 1 277 277 ASP CA C 13 53.67 0.02 . 1 . . . . 834 ASP CA . 10016 2 680 . 1 1 277 277 ASP CB C 13 39.95 0.02 . 1 . . . . 834 ASP CB . 10016 2 681 . 1 1 277 277 ASP N N 15 123.28 0.02 . 1 . . . . 834 ASP N . 10016 2 682 . 1 1 278 278 THR H H 1 8.15 0.02 . 1 . . . . 835 THR H . 10016 2 683 . 1 1 278 278 THR C C 13 174.12 0.02 . 1 . . . . 835 THR C . 10016 2 684 . 1 1 278 278 THR CA C 13 60.98 0.05 . 1 . . . . 835 THR CA . 10016 2 685 . 1 1 278 278 THR CB C 13 68.67 0.02 . 1 . . . . 835 THR CB . 10016 2 686 . 1 1 278 278 THR N N 15 116.89 0.03 . 1 . . . . 835 THR N . 10016 2 687 . 1 1 279 279 LYS H H 1 8.39 0.02 . 1 . . . . 836 LYS H . 10016 2 688 . 1 1 279 279 LYS CA C 13 53.6 0.02 . 1 . . . . 836 LYS CA . 10016 2 689 . 1 1 279 279 LYS CB C 13 30.86 0.02 . 1 . . . . 836 LYS CB . 10016 2 690 . 1 1 279 279 LYS N N 15 127.76 0.03 . 1 . . . . 836 LYS N . 10016 2 691 . 1 1 280 280 PRO C C 13 176.65 0.02 . 1 . . . . 837 PRO C . 10016 2 692 . 1 1 280 280 PRO CA C 13 62.16 0.02 . 1 . . . . 837 PRO CA . 10016 2 693 . 1 1 280 280 PRO CB C 13 30.88 0.02 . 1 . . . . 837 PRO CB . 10016 2 694 . 1 1 281 281 GLN H H 1 8.73 0.02 . 1 . . . . 838 GLN H . 10016 2 695 . 1 1 281 281 GLN C C 13 175.93 0.04 . 1 . . . . 838 GLN C . 10016 2 696 . 1 1 281 281 GLN CA C 13 54.87 0.03 . 1 . . . . 838 GLN CA . 10016 2 697 . 1 1 281 281 GLN CB C 13 28.2 0.05 . 1 . . . . 838 GLN CB . 10016 2 698 . 1 1 281 281 GLN N N 15 123.48 0.02 . 1 . . . . 838 GLN N . 10016 2 699 . 1 1 282 282 THR H H 1 8.38 0.02 . 1 . . . . 839 THR H . 10016 2 700 . 1 1 282 282 THR C C 13 173.94 0.04 . 1 . . . . 839 THR C . 10016 2 701 . 1 1 282 282 THR CA C 13 60.98 0.06 . 1 . . . . 839 THR CA . 10016 2 702 . 1 1 282 282 THR CB C 13 68.82 0.09 . 1 . . . . 839 THR CB . 10016 2 703 . 1 1 282 282 THR N N 15 118.49 0.06 . 1 . . . . 839 THR N . 10016 2 704 . 1 1 283 283 MET H H 1 8.56 0.02 . 1 . . . . 840 MET H . 10016 2 705 . 1 1 283 283 MET C C 13 175.66 0.02 . 1 . . . . 840 MET C . 10016 2 706 . 1 1 283 283 MET CA C 13 54.36 0.04 . 1 . . . . 840 MET CA . 10016 2 707 . 1 1 283 283 MET N N 15 125.24 0.04 . 1 . . . . 840 MET N . 10016 2 708 . 1 1 284 284 GLU H H 1 8.56 0.02 . 1 . . . . 841 GLU H . 10016 2 709 . 1 1 284 284 GLU C C 13 175.13 0.02 . 1 . . . . 841 GLU C . 10016 2 710 . 1 1 284 284 GLU CA C 13 55.73 0.03 . 1 . . . . 841 GLU CA . 10016 2 711 . 1 1 284 284 GLU CB C 13 31.71 0.02 . 1 . . . . 841 GLU CB . 10016 2 712 . 1 1 284 284 GLU N N 15 125.31 0.06 . 1 . . . . 841 GLU N . 10016 2 713 . 1 1 285 285 ARG H H 1 8.14 0.02 . 1 . . . . 842 ARG H . 10016 2 714 . 1 1 285 285 ARG C C 13 180.68 0.02 . 1 . . . . 842 ARG C . 10016 2 715 . 1 1 285 285 ARG CA C 13 56.5 0.02 . 1 . . . . 842 ARG CA . 10016 2 716 . 1 1 285 285 ARG CB C 13 29.9 0.02 . 1 . . . . 842 ARG CB . 10016 2 717 . 1 1 285 285 ARG N N 15 129.59 0.02 . 1 . . . . 842 ARG N . 10016 2 stop_ save_