data_10016 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C and 15N Chemical Shift Assignments for the Nucleotide-Free Form of Human ABCB6 C-Terminal Domain ; _BMRB_accession_number 10016 _BMRB_flat_file_name bmr10016.str _Entry_type original _Submission_date 2005-12-08 _Accession_date 2005-12-08 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kurashima-Ito Kaori . . 2 Ikeya Teppei . . 3 Senbongi Hiroshi . . 4 Tochio Hidehito . . 5 Mikawa Tsutomu . . 6 Shibata Takehiko . . 7 Ito Yutaka . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 368 "13C chemical shifts" 1016 "15N chemical shifts" 368 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2008-07-01 update BMRB 'complete entry citation' 2006-06-27 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 10017 'ADP-BOUND Form of Human ABCB6 C-Terminal Domain' stop_ save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _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 _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16791740 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kurashima-Ito Kaori . . 2 Ikeya Teppei . . 3 Senbongi Hiroshi . . 4 Tochio Hidehito . . 5 Mikawa Tsutomu . . 6 Shibata Takehiko . . 7 Ito Yutaka . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 35 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 53 _Page_last 71 _Year 2006 _Details . loop_ _Keyword 'ABC transporter' 'Fe homeostasis' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name ABCB6-C _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label ABCB6-C $ABCB6-C stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state 'protein monomer' _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details ; the C-terminal nucleotide-binding domain of the human mitochondrial ABC transporter ABCB6 ; save_ ######################## # Monomeric polymers # ######################## save_ABCB6-C _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common ; the C-terminal nucleotide-binding domain of the human mitochondrial ABC transporter ABCB6 ; _Molecular_mass . _Mol_thiol_state 'all free' loop_ _Biological_function 'iron ion homeostasis' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 285 _Mol_residue_sequence ; FIDMENMFDLLKEETEVKDL PGAGPLRFQKGRIEFENVHF SYADGRETLQDVSFTVMPGQ TLALVGPSGAGKSTILRLLF RFYDISSGCIRIDGQDISQV TQASLRSHIGVVPQDTVLFN DTIADNIRYGRVTAGNDEVE AAAQAAGIHDAIMAFPEGYR TQVGERGLKLSGGEKQRVAI ARTILKAPGIILLDEATSAL DTSNERAIQASLAKVCANRT TIVVAHRLSTVVNADQILVI KDGCIVERGRHEALLSRGGV YADMWQLQQGQEETSEDTKP QTMER ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 558 PHE 2 559 ILE 3 560 ASP 4 561 MET 5 562 GLU 6 563 ASN 7 564 MET 8 565 PHE 9 566 ASP 10 567 LEU 11 568 LEU 12 569 LYS 13 570 GLU 14 571 GLU 15 572 THR 16 573 GLU 17 574 VAL 18 575 LYS 19 576 ASP 20 577 LEU 21 578 PRO 22 579 GLY 23 580 ALA 24 581 GLY 25 582 PRO 26 583 LEU 27 584 ARG 28 585 PHE 29 586 GLN 30 587 LYS 31 588 GLY 32 589 ARG 33 590 ILE 34 591 GLU 35 592 PHE 36 593 GLU 37 594 ASN 38 595 VAL 39 596 HIS 40 597 PHE 41 598 SER 42 599 TYR 43 600 ALA 44 601 ASP 45 602 GLY 46 603 ARG 47 604 GLU 48 605 THR 49 606 LEU 50 607 GLN 51 608 ASP 52 609 VAL 53 610 SER 54 611 PHE 55 612 THR 56 613 VAL 57 614 MET 58 615 PRO 59 616 GLY 60 617 GLN 61 618 THR 62 619 LEU 63 620 ALA 64 621 LEU 65 622 VAL 66 623 GLY 67 624 PRO 68 625 SER 69 626 GLY 70 627 ALA 71 628 GLY 72 629 LYS 73 630 SER 74 631 THR 75 632 ILE 76 633 LEU 77 634 ARG 78 635 LEU 79 636 LEU 80 637 PHE 81 638 ARG 82 639 PHE 83 640 TYR 84 641 ASP 85 642 ILE 86 643 SER 87 644 SER 88 645 GLY 89 646 CYS 90 647 ILE 91 648 ARG 92 649 ILE 93 650 ASP 94 651 GLY 95 652 GLN 96 653 ASP 97 654 ILE 98 655 SER 99 656 GLN 100 657 VAL 101 658 THR 102 659 GLN 103 660 ALA 104 661 SER 105 662 LEU 106 663 ARG 107 664 SER 108 665 HIS 109 666 ILE 110 667 GLY 111 668 VAL 112 669 VAL 113 670 PRO 114 671 GLN 115 672 ASP 116 673 THR 117 674 VAL 118 675 LEU 119 676 PHE 120 677 ASN 121 678 ASP 122 679 THR 123 680 ILE 124 681 ALA 125 682 ASP 126 683 ASN 127 684 ILE 128 685 ARG 129 686 TYR 130 687 GLY 131 688 ARG 132 689 VAL 133 690 THR 134 691 ALA 135 692 GLY 136 693 ASN 137 694 ASP 138 695 GLU 139 696 VAL 140 697 GLU 141 698 ALA 142 699 ALA 143 700 ALA 144 701 GLN 145 702 ALA 146 703 ALA 147 704 GLY 148 705 ILE 149 706 HIS 150 707 ASP 151 708 ALA 152 709 ILE 153 710 MET 154 711 ALA 155 712 PHE 156 713 PRO 157 714 GLU 158 715 GLY 159 716 TYR 160 717 ARG 161 718 THR 162 719 GLN 163 720 VAL 164 721 GLY 165 722 GLU 166 723 ARG 167 724 GLY 168 725 LEU 169 726 LYS 170 727 LEU 171 728 SER 172 729 GLY 173 730 GLY 174 731 GLU 175 732 LYS 176 733 GLN 177 734 ARG 178 735 VAL 179 736 ALA 180 737 ILE 181 738 ALA 182 739 ARG 183 740 THR 184 741 ILE 185 742 LEU 186 743 LYS 187 744 ALA 188 745 PRO 189 746 GLY 190 747 ILE 191 748 ILE 192 749 LEU 193 750 LEU 194 751 ASP 195 752 GLU 196 753 ALA 197 754 THR 198 755 SER 199 756 ALA 200 757 LEU 201 758 ASP 202 759 THR 203 760 SER 204 761 ASN 205 762 GLU 206 763 ARG 207 764 ALA 208 765 ILE 209 766 GLN 210 767 ALA 211 768 SER 212 769 LEU 213 770 ALA 214 771 LYS 215 772 VAL 216 773 CYS 217 774 ALA 218 775 ASN 219 776 ARG 220 777 THR 221 778 THR 222 779 ILE 223 780 VAL 224 781 VAL 225 782 ALA 226 783 HIS 227 784 ARG 228 785 LEU 229 786 SER 230 787 THR 231 788 VAL 232 789 VAL 233 790 ASN 234 791 ALA 235 792 ASP 236 793 GLN 237 794 ILE 238 795 LEU 239 796 VAL 240 797 ILE 241 798 LYS 242 799 ASP 243 800 GLY 244 801 CYS 245 802 ILE 246 803 VAL 247 804 GLU 248 805 ARG 249 806 GLY 250 807 ARG 251 808 HIS 252 809 GLU 253 810 ALA 254 811 LEU 255 812 LEU 256 813 SER 257 814 ARG 258 815 GLY 259 816 GLY 260 817 VAL 261 818 TYR 262 819 ALA 263 820 ASP 264 821 MET 265 822 TRP 266 823 GLN 267 824 LEU 268 825 GLN 269 826 GLN 270 827 GLY 271 828 GLN 272 829 GLU 273 830 GLU 274 831 THR 275 832 SER 276 833 GLU 277 834 ASP 278 835 THR 279 836 LYS 280 837 PRO 281 838 GLN 282 839 THR 283 840 MET 284 841 GLU 285 842 ARG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-02-07 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 10017 "the C-terminal nucleotide-binding domain of the human mitochondrial ABC" 100.00 300 100.00 100.00 0.00e+00 PDB 3NH6 "Nucleotide Binding Domain Of Human Abcb6 (Apo Structure)" 100.00 306 100.00 100.00 0.00e+00 PDB 3NH9 "Nucleotide Binding Domain Of Human Abcb6 (Atp Bound Structure)" 100.00 306 100.00 100.00 0.00e+00 PDB 3NHA "Nucleotide Binding Domain Of Human Abcb6 (Adp Mg Bound Structure)" 100.00 306 100.00 100.00 0.00e+00 PDB 3NHB "Nucleotide Binding Domain Of Human Abcb6 (Adp Bound Structure)" 100.00 306 100.00 100.00 0.00e+00 DBJ BAA96733 "mitochondrial ABC transporter 3 [Homo sapiens]" 100.00 842 100.00 100.00 0.00e+00 DBJ BAB71347 "unnamed protein product [Homo sapiens]" 100.00 766 100.00 100.00 0.00e+00 DBJ BAD18782 "unnamed protein product [Homo sapiens]" 100.00 571 99.30 99.30 0.00e+00 DBJ BAK62401 "ATP-binding cassette sub-family B member 6, mitochondrial precursor [Pan troglodytes]" 100.35 474 99.30 99.30 0.00e+00 DBJ BAK62910 "ATP-binding cassette sub-family B member 6, mitochondrial precursor [Pan troglodytes]" 100.35 437 99.30 99.30 0.00e+00 EMBL CAB95766 "ABC transporter umat [Homo sapiens]" 100.00 842 100.00 100.00 0.00e+00 GB AAC28653 "ABC transporter [Homo sapiens]" 100.00 511 100.00 100.00 0.00e+00 GB AAF75107 "MT-ABC transporter [Homo sapiens]" 100.00 842 100.00 100.00 0.00e+00 GB AAG33617 "ATP-binding cassette half-transporter [Homo sapiens]" 100.00 896 100.00 100.00 0.00e+00 GB AAH00559 "ATP-binding cassette, sub-family B (MDR/TAP), member 6 [Homo sapiens]" 100.00 842 100.00 100.00 0.00e+00 GB AAH43423 "ABCB6 protein [Homo sapiens]" 100.00 301 100.00 100.00 0.00e+00 REF NP_005680 "ATP-binding cassette sub-family B member 6, mitochondrial [Homo sapiens]" 100.00 842 100.00 100.00 0.00e+00 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 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 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 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 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 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Fraction $ABCB6-C human 9606 Eukaryota Metazoa Homo sapiens no stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $ABCB6-C 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $ABCB6-C 0.2 mM '[U-2H; U-13C; U-15N]' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name XWIN-NMR _Version 3.5 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task collection stop_ _Details . save_ save_software_2 _Saveframe_category software _Name AZARA _Version 2.7 loop_ _Vendor _Address _Electronic_address 'Wayne Boucher & Dept. Biochemistry, Univ. Cambridge' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_3 _Saveframe_category software _Name ANSIG-for-OpenGL _Version 1.0.6 loop_ _Vendor _Address _Electronic_address 'Per Kraulis' . . stop_ loop_ _Task assignment stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H-15N_TROSY-HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N TROSY-HSQC' _Sample_label $sample_1 save_ save_TROSY-HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HNCA _Sample_label $sample_1 save_ save_TROSY-HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(CO)CA _Sample_label $sample_1 save_ save_TROSY-HN(CA)CB_4 _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(CA)CB _Sample_label $sample_1 save_ save_TROSY-HN(COCA)CB_5 _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(COCA)CB _Sample_label $sample_1 save_ save_TROSY-HN(CA)CO_6 _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(CA)CO _Sample_label $sample_1 save_ save_TRSOY-HNCO_7 _Saveframe_category NMR_applied_experiment _Experiment_name TRSOY-HNCO _Sample_label $sample_1 save_ save_1H-15N_TROSY-HSQC _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N TROSY-HSQC' _BMRB_pulse_sequence_accession_number . _Details . save_ save_TROSY-HNCA _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HNCA _BMRB_pulse_sequence_accession_number . _Details . save_ save_TROSY-HN(CO)CA _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(CO)CA _BMRB_pulse_sequence_accession_number . _Details . save_ save_TROSY-HN(CA)CB _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(CA)CB _BMRB_pulse_sequence_accession_number . _Details . save_ save_TROSY-HN(COCA)CB _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(COCA)CB _BMRB_pulse_sequence_accession_number . _Details . save_ save_TROSY-HN(CA)CO _Saveframe_category NMR_applied_experiment _Experiment_name TROSY-HN(CA)CO _BMRB_pulse_sequence_accession_number . _Details . save_ save_TRSOY-HNCO _Saveframe_category NMR_applied_experiment _Experiment_name TRSOY-HNCO _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_condition_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 8.5 0.1 pH temperature 298 0.1 K stop_ save_ save_condition_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.5 0.1 pH temperature 278 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_ph85_298K _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $software_3 stop_ loop_ _Experiment_label '1H-15N TROSY-HSQC' TROSY-HNCA TROSY-HN(CO)CA TROSY-HN(CA)CB TROSY-HN(COCA)CB TROSY-HN(CA)CO TRSOY-HNCO stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $condition_1 _Chem_shift_reference_set_label $reference_1 _Mol_system_component_name ABCB6-C _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 572 15 THR C C 173.9 0.02 1 2 572 15 THR CA C 60.73 0.02 1 3 572 15 THR CB C 68.89 0.02 1 4 573 16 GLU H H 8.4 0.02 1 5 573 16 GLU C C 176.09 0.02 1 6 573 16 GLU CA C 55.8 0.04 1 7 573 16 GLU CB C 29.38 0.13 1 8 573 16 GLU N N 125.71 0.17 1 9 574 17 VAL H H 8.05 0.02 1 10 574 17 VAL C C 175.69 0.16 1 11 574 17 VAL CA C 61.9 0.18 1 12 574 17 VAL CB C 31.26 0.19 1 13 574 17 VAL N N 125.25 0.13 1 14 575 18 LYS H H 8.64 0.02 1 15 575 18 LYS C C 176.81 0.02 1 16 575 18 LYS CA C 53.94 0.07 1 17 575 18 LYS CB C 33.54 0.14 1 18 575 18 LYS N N 128.01 0.12 1 19 576 19 ASP H H 8.45 0.03 1 20 576 19 ASP C C 176.88 0.02 1 21 576 19 ASP CA C 53.05 0.03 1 22 576 19 ASP CB C 40.36 0.22 1 23 576 19 ASP N N 124.74 0.19 1 24 577 20 LEU H H 8.82 0.02 1 25 577 20 LEU C C 175.85 0.02 1 26 577 20 LEU CA C 52.68 0.02 1 27 577 20 LEU CB C 40.01 0.02 1 28 577 20 LEU N N 127.74 0.1 1 29 578 21 PRO C C 178.19 0.02 1 30 578 21 PRO CA C 63.04 0.09 1 31 578 21 PRO CB C 30.63 0.15 1 32 579 22 GLY H H 8.37 0.02 1 33 579 22 GLY C C 174.3 0.02 1 34 579 22 GLY CA C 44.47 0.15 1 35 579 22 GLY N N 113.96 0.16 1 36 580 23 ALA H H 7.52 0.02 1 37 580 23 ALA C C 177.16 0.02 1 38 580 23 ALA CA C 52.69 0.02 1 39 580 23 ALA CB C 18.44 0.49 1 40 580 23 ALA N N 124.98 0.05 1 41 581 24 GLY H H 8.34 0.02 1 42 581 24 GLY C C 171.11 0.02 1 43 581 24 GLY CA C 42.6 0.02 1 44 581 24 GLY N N 112.49 0.15 1 45 582 25 PRO CA C 61.2 0.05 1 46 582 25 PRO CB C 30.98 0.02 1 47 583 26 LEU H H 8.67 0.02 1 48 583 26 LEU C C 175.57 0.02 1 49 583 26 LEU CA C 54.79 0.11 1 50 583 26 LEU CB C 41.45 0.14 1 51 583 26 LEU N N 123.66 0.13 1 52 584 27 ARG H H 9.41 0.02 1 53 584 27 ARG C C 175.13 0.05 1 54 584 27 ARG CA C 53.84 0.03 1 55 584 27 ARG CB C 27.14 0.32 1 56 584 27 ARG N N 132.53 0.12 1 57 585 28 PHE H H 8.28 0.02 1 58 585 28 PHE C C 175.02 0.03 1 59 585 28 PHE CA C 59.17 0.09 1 60 585 28 PHE CB C 38.18 0.26 1 61 585 28 PHE N N 129.91 0.23 1 62 586 29 GLN H H 8.46 0.02 1 63 586 29 GLN C C 173.67 0.07 1 64 586 29 GLN CA C 55.48 0.08 1 65 586 29 GLN CB C 29.42 0.4 1 66 586 29 GLN N N 130.99 0.18 1 67 587 30 LYS H H 7.83 0.02 1 68 587 30 LYS C C 175.54 0.02 1 69 587 30 LYS CA C 55.07 0.04 1 70 587 30 LYS CB C 33.81 0.02 1 71 587 30 LYS N N 119.21 0.09 1 72 588 31 GLY H H 9.47 0.02 1 73 588 31 GLY C C 173.57 0.05 1 74 588 31 GLY CA C 46.8 0.14 1 75 588 31 GLY N N 115.39 0.16 1 76 589 32 ARG H H 8.8 0.02 1 77 589 32 ARG C C 176.09 0.02 1 78 589 32 ARG CA C 55.09 0.05 1 79 589 32 ARG CB C 30.56 0.19 1 80 589 32 ARG N N 126.39 0.12 1 81 590 33 ILE H H 8.83 0.02 1 82 590 33 ILE C C 174.53 0.02 1 83 590 33 ILE CA C 59.93 0.03 1 84 590 33 ILE CB C 40.59 0.16 1 85 590 33 ILE N N 130.58 0.21 1 86 591 34 GLU H H 9.2 0.02 1 87 591 34 GLU C C 174.08 0.2 1 88 591 34 GLU CA C 54.3 0.02 1 89 591 34 GLU CB C 33.18 0.03 1 90 591 34 GLU N N 127.56 0.1 1 91 592 35 PHE H H 9.03 0.02 1 92 592 35 PHE C C 175.02 0.04 1 93 592 35 PHE CA C 56 0.02 1 94 592 35 PHE CB C 38.17 0.2 1 95 592 35 PHE N N 128.94 0.1 1 96 593 36 GLU H H 9.25 0.02 1 97 593 36 GLU C C 172.71 0.03 1 98 593 36 GLU CA C 54.32 0.07 1 99 593 36 GLU CB C 30.77 0.17 1 100 593 36 GLU N N 129.03 0.15 1 101 594 37 ASN H H 8.93 0.02 1 102 594 37 ASN C C 174.13 0.07 1 103 594 37 ASN CA C 54.05 0.15 1 104 594 37 ASN CB C 37.61 0.2 1 105 594 37 ASN N N 125.71 0.14 1 106 595 38 VAL H H 8.6 0.02 1 107 595 38 VAL C C 176.74 0.03 1 108 595 38 VAL CA C 64.39 0.09 1 109 595 38 VAL CB C 31.2 0.31 1 110 595 38 VAL N N 121.7 0.17 1 111 596 39 HIS H H 8.24 0.02 1 112 596 39 HIS C C 174.36 0.06 1 113 596 39 HIS CA C 53.94 0.09 1 114 596 39 HIS CB C 31.58 0.12 1 115 596 39 HIS N N 126.38 0.08 1 116 597 40 PHE H H 8.7 0.02 1 117 597 40 PHE C C 172.5 0.19 1 118 597 40 PHE CA C 57.78 0.12 1 119 597 40 PHE CB C 43.1 0.02 1 120 597 40 PHE N N 123.5 0.2 1 121 598 41 SER H H 7.26 0.02 1 122 598 41 SER C C 172.03 0.02 1 123 598 41 SER CA C 56.45 0.06 1 124 598 41 SER N N 123.8 0.09 1 125 599 42 TYR H H 7.88 0.02 1 126 599 42 TYR CA C 57.48 0.02 1 127 599 42 TYR CB C 38.22 0.02 1 128 599 42 TYR N N 124.62 0.1 1 129 606 49 LEU C C 176.6 0.02 1 130 606 49 LEU CA C 53.52 0.02 1 131 606 49 LEU CB C 44.34 0.23 1 132 607 50 GLN H H 8.8 0.02 1 133 607 50 GLN C C 172.41 0.02 1 134 607 50 GLN CA C 54.08 0.02 1 135 607 50 GLN CB C 30.59 0.02 1 136 607 50 GLN N N 124.74 0.16 1 137 608 51 ASP C C 173.8 0.02 1 138 608 51 ASP CA C 54.82 0.03 1 139 608 51 ASP CB C 38.58 0.26 1 140 609 52 VAL H H 8.96 0.02 1 141 609 52 VAL C C 175.69 0.02 1 142 609 52 VAL CA C 63.48 0.05 1 143 609 52 VAL CB C 31.45 0.34 1 144 609 52 VAL N N 123.39 0.21 1 145 610 53 SER H H 7.88 0.02 1 146 610 53 SER C C 173.09 0.02 1 147 610 53 SER CA C 55.97 0.12 1 148 610 53 SER CB C 65.3 0.04 1 149 610 53 SER N N 125.61 0.03 1 150 611 54 PHE H H 8.43 0.02 1 151 611 54 PHE C C 172.66 0.02 1 152 611 54 PHE CA C 57.25 0.07 1 153 611 54 PHE CB C 38.76 0.47 1 154 611 54 PHE N N 119.46 0.13 1 155 612 55 THR H H 8.86 0.02 1 156 612 55 THR C C 173.43 0.02 1 157 612 55 THR CA C 60.91 0.13 1 158 612 55 THR CB C 71.51 0.31 1 159 612 55 THR N N 118.44 0.26 1 160 613 56 VAL H H 9.65 0.02 1 161 613 56 VAL C C 174.85 0.06 1 162 613 56 VAL CA C 60.88 0.02 1 163 613 56 VAL CB C 32.4 0.44 1 164 613 56 VAL N N 129.76 0.11 1 165 614 57 MET H H 8.14 0.02 1 166 614 57 MET C C 172.87 0.02 1 167 614 57 MET CA C 52 0.02 1 168 614 57 MET CB C 28.71 0.02 1 169 614 57 MET N N 126.79 0.12 1 170 616 59 GLY C C 173.82 0.02 1 171 616 59 GLY CA C 44.59 0.02 1 172 617 60 GLN H H 7.93 0.02 1 173 617 60 GLN C C 174.58 0.1 1 174 617 60 GLN CA C 55.25 0.11 1 175 617 60 GLN CB C 29.37 0.29 1 176 617 60 GLN N N 121.72 0.12 1 177 618 61 THR H H 9.24 0.02 1 178 618 61 THR C C 173.69 0.08 1 179 618 61 THR CA C 61.3 0.02 1 180 618 61 THR CB C 70.33 0.38 1 181 618 61 THR N N 116.33 0.09 1 182 619 62 LEU H H 9 0.02 1 183 619 62 LEU C C 173.59 0.03 1 184 619 62 LEU CA C 52.24 0.08 1 185 619 62 LEU CB C 43.97 0.43 1 186 619 62 LEU N N 132.79 0.17 1 187 620 63 ALA H H 8.91 0.02 1 188 620 63 ALA C C 174.51 0.04 1 189 620 63 ALA CA C 48.68 0.1 1 190 620 63 ALA CB C 21.34 0.38 1 191 620 63 ALA N N 130.28 0.17 1 192 621 64 LEU H H 9.02 0.02 1 193 621 64 LEU C C 174.66 0.8 1 194 621 64 LEU CA C 52.58 0.15 1 195 621 64 LEU CB C 42.34 0.15 1 196 621 64 LEU N N 124.47 0.14 1 197 622 65 VAL H H 8.56 0.02 1 198 622 65 VAL C C 174.08 0.02 1 199 622 65 VAL CA C 57.47 0.07 1 200 622 65 VAL CB C 34.54 0.9 1 201 622 65 VAL N N 116.58 0.17 1 202 623 66 GLY H H 8.64 0.02 1 203 623 66 GLY CA C 43.94 0.02 1 204 623 66 GLY N N 109.45 0.32 1 205 634 77 ARG C C 175.88 0.02 1 206 634 77 ARG CA C 57.83 0.03 1 207 634 77 ARG CB C 27.92 0.02 1 208 635 78 LEU H H 7.6 0.02 1 209 635 78 LEU C C 175.5 0.02 1 210 635 78 LEU CA C 52.07 0.09 1 211 635 78 LEU CB C 41.51 0.46 1 212 635 78 LEU N N 118.47 0.1 1 213 636 79 LEU H H 8.87 0.02 1 214 636 79 LEU C C 177.29 0.02 1 215 636 79 LEU CA C 55.46 0.02 1 216 636 79 LEU CB C 39.4 0.02 1 217 636 79 LEU N N 125.28 0.17 1 218 637 80 PHE H H 7.95 0.02 1 219 637 80 PHE CA C 54.62 0.02 1 220 637 80 PHE CB C 40.9 0.02 1 221 637 80 PHE N N 122.27 0.11 1 222 639 82 PHE C C 174.72 0.02 1 223 639 82 PHE CA C 59.26 0.07 1 224 640 83 TYR H H 6.67 0.03 1 225 640 83 TYR C C 174.6 0.02 1 226 640 83 TYR CA C 52.88 0.1 1 227 640 83 TYR CB C 42.14 0.37 1 228 640 83 TYR N N 110.69 0.14 1 229 641 84 ASP H H 8.61 0.02 1 230 641 84 ASP C C 176.42 0.02 1 231 641 84 ASP CA C 53.51 0.13 1 232 641 84 ASP CB C 41.96 0.08 1 233 641 84 ASP N N 121.87 0.05 1 234 642 85 ILE H H 8.04 0.02 1 235 642 85 ILE C C 175.89 0.03 1 236 642 85 ILE CA C 61.01 0.06 1 237 642 85 ILE CB C 37.79 0.65 1 238 642 85 ILE N N 115.18 0.16 1 239 643 86 SER H H 8.62 0.02 1 240 643 86 SER C C 174.83 0.03 1 241 643 86 SER CA C 59.54 0.05 1 242 643 86 SER CB C 63.05 0.71 1 243 643 86 SER N N 119.02 0.15 1 244 644 87 SER H H 7.72 0.02 1 245 644 87 SER C C 172.33 0.11 1 246 644 87 SER CA C 57.87 0.03 1 247 644 87 SER CB C 63.46 0.65 1 248 644 87 SER N N 115.7 0.24 1 249 645 88 GLY H H 8.34 0.02 1 250 645 88 GLY C C 173.79 0.07 1 251 645 88 GLY CA C 44.14 0.05 1 252 645 88 GLY N N 111.56 0.11 1 253 646 89 CYS H H 8.27 0.02 1 254 646 89 CYS C C 171.34 0.09 1 255 646 89 CYS CA C 58.6 0.11 1 256 646 89 CYS CB C 29.98 0.6 1 257 646 89 CYS N N 121.3 0.13 1 258 647 90 ILE H H 8.8 0.02 1 259 647 90 ILE C C 174.3 0.09 1 260 647 90 ILE CA C 59.69 0.13 1 261 647 90 ILE CB C 38.3 0.27 1 262 647 90 ILE N N 131.29 0.32 1 263 648 91 ARG H H 9.09 0.02 1 264 648 91 ARG C C 176.54 0.04 1 265 648 91 ARG CA C 52.83 0.13 1 266 648 91 ARG CB C 34.51 0.4 1 267 648 91 ARG N N 125.36 0.14 1 268 649 92 ILE H H 8.17 0.02 1 269 649 92 ILE C C 175.36 0.07 1 270 649 92 ILE CA C 59.21 0.05 1 271 649 92 ILE CB C 39.9 0.7 1 272 649 92 ILE N N 122.77 0.04 1 273 650 93 ASP H H 9.55 0.02 1 274 650 93 ASP C C 176.97 0.03 1 275 650 93 ASP CA C 55.77 0.1 1 276 650 93 ASP CB C 39.4 0.29 1 277 650 93 ASP N N 130.09 0.09 1 278 651 94 GLY H H 9.21 0.02 1 279 651 94 GLY C C 173.76 0.02 1 280 651 94 GLY CA C 44.77 0.02 1 281 651 94 GLY N N 105.59 0.08 1 282 652 95 GLN H H 7.91 0.02 1 283 652 95 GLN C C 174 0.04 1 284 652 95 GLN CA C 54.29 0.02 1 285 652 95 GLN CB C 29.31 0.48 1 286 652 95 GLN N N 125.19 0.1 1 287 653 96 ASP H H 8.34 0.02 1 288 653 96 ASP C C 179.25 0.02 1 289 653 96 ASP CA C 52.86 0.05 1 290 653 96 ASP CB C 39.89 0.51 1 291 653 96 ASP N N 126.76 0.07 1 292 654 97 ILE H H 8.71 0.02 1 293 654 97 ILE C C 176.5 0.08 1 294 654 97 ILE CA C 64.03 0.06 1 295 654 97 ILE CB C 36.23 0.23 1 296 654 97 ILE N N 125.96 0.09 1 297 655 98 SER H H 9.09 0.02 1 298 655 98 SER C C 175.79 0.02 1 299 655 98 SER CA C 59.94 0.09 1 300 655 98 SER CB C 63.4 0.85 1 301 655 98 SER N N 119.82 0.15 1 302 656 99 GLN H H 7.77 0.02 1 303 656 99 GLN C C 174.77 0.02 1 304 656 99 GLN CA C 54.56 0.12 1 305 656 99 GLN CB C 28.37 0.53 1 306 656 99 GLN N N 121.9 0.21 1 307 657 100 VAL H H 6.68 0.02 1 308 657 100 VAL C C 177.5 0.02 1 309 657 100 VAL CA C 57.47 0.02 1 310 657 100 VAL CB C 33.81 0.15 1 311 657 100 VAL N N 111.84 0.15 1 312 658 101 THR H H 8.27 0.02 1 313 658 101 THR C C 176.3 0.05 1 314 658 101 THR CA C 60.27 0.02 1 315 658 101 THR CB C 67.97 0.24 1 316 658 101 THR N N 116.89 0.12 1 317 659 102 GLN H H 10.41 0.02 1 318 659 102 GLN C C 178.26 0.11 1 319 659 102 GLN CA C 58.9 0.09 1 320 659 102 GLN CB C 29.5 0.02 1 321 659 102 GLN N N 130.93 0.09 1 322 660 103 ALA H H 9.21 0.02 1 323 660 103 ALA C C 180.72 0.04 1 324 660 103 ALA CA C 54.41 0.26 1 325 660 103 ALA CB C 17.33 0.02 1 326 660 103 ALA N N 122.16 0.17 1 327 661 104 SER H H 7.38 0.02 1 328 661 104 SER C C 176.84 0.02 1 329 661 104 SER CA C 60.24 0.02 1 330 661 104 SER CB C 62.23 0.45 1 331 661 104 SER N N 115.91 0.2 1 332 662 105 LEU H H 7.61 0.02 1 333 662 105 LEU C C 177.49 0.02 1 334 662 105 LEU CA C 58.04 0.03 1 335 662 105 LEU CB C 41.47 0.03 1 336 662 105 LEU N N 128.03 0.19 1 337 663 106 ARG H H 7.8 0.02 1 338 663 106 ARG C C 177.72 0.09 1 339 663 106 ARG CA C 58.36 0.02 1 340 663 106 ARG CB C 28.83 0.02 1 341 663 106 ARG N N 114.74 0.13 1 342 664 107 SER H H 7.5 0.02 1 343 664 107 SER C C 174.19 0.02 1 344 664 107 SER CA C 60.38 0.16 1 345 664 107 SER CB C 61.98 0.69 1 346 664 107 SER N N 116.88 0.06 1 347 665 108 HIS H H 6.93 0.02 1 348 665 108 HIS C C 172.82 0.04 1 349 665 108 HIS CA C 56.5 0.09 1 350 665 108 HIS CB C 30.43 0.02 1 351 665 108 HIS N N 119.86 0.13 1 352 666 109 ILE H H 7.12 0.02 1 353 666 109 ILE C C 174.89 0.04 1 354 666 109 ILE CA C 59.58 0.03 1 355 666 109 ILE CB C 40.12 0.5 1 356 666 109 ILE N N 120.26 0.13 1 357 667 110 GLY H H 9.16 0.02 1 358 667 110 GLY C C 170.98 0.02 1 359 667 110 GLY CA C 43.55 0.02 1 360 667 110 GLY N N 116.85 0.16 1 361 670 113 PRO C C 177.73 0.02 1 362 670 113 PRO CA C 62.96 0.07 1 363 670 113 PRO CB C 30.29 0.02 1 364 671 114 GLN H H 8.34 0.03 1 365 671 114 GLN C C 178.55 0.05 1 366 671 114 GLN CA C 58.51 0.02 1 367 671 114 GLN CB C 26.99 0.02 1 368 671 114 GLN N N 122.61 0.09 1 369 672 115 ASP H H 8.09 0.02 1 370 672 115 ASP CA C 56.66 0.02 1 371 672 115 ASP CB C 39.88 0.02 1 372 672 115 ASP N N 120.42 0.07 1 373 674 117 VAL C C 174.86 0.02 1 374 674 117 VAL CA C 61.6 0.04 1 375 674 117 VAL CB C 31.6 0.06 1 376 675 118 LEU H H 8.27 0.02 1 377 675 118 LEU C C 175.55 0.02 1 378 675 118 LEU CA C 52.02 0.02 1 379 675 118 LEU CB C 41.57 0.02 1 380 675 118 LEU N N 129.49 0.11 1 381 677 120 ASN C C 172.47 0.02 1 382 677 120 ASN CA C 52.83 0.02 1 383 677 120 ASN CB C 36.05 0.02 1 384 678 121 ASP H H 8.02 0.02 1 385 678 121 ASP C C 176.25 0.06 1 386 678 121 ASP CA C 51.9 0.21 1 387 678 121 ASP CB C 44.02 0.22 1 388 678 121 ASP N N 129.16 0.14 1 389 679 122 THR H H 9.87 0.02 1 390 679 122 THR C C 178.43 0.05 1 391 679 122 THR CA C 61.74 0.13 1 392 679 122 THR CB C 70.99 0.25 1 393 679 122 THR N N 112.54 0.1 1 394 680 123 ILE H H 8.81 0.02 1 395 680 123 ILE C C 176.41 0.02 1 396 680 123 ILE CA C 62.17 0.18 1 397 680 123 ILE CB C 36.8 0.3 1 398 680 123 ILE N N 124 0.11 1 399 681 124 ALA H H 7.94 0.02 1 400 681 124 ALA C C 179.21 0.08 1 401 681 124 ALA CA C 55.52 0.02 1 402 681 124 ALA CB C 18.25 0.3 1 403 681 124 ALA N N 125.45 0.09 1 404 682 125 ASP H H 8.26 0.02 1 405 682 125 ASP C C 178.56 0.02 1 406 682 125 ASP CA C 57.25 0.02 1 407 682 125 ASP CB C 38.91 0.02 1 408 682 125 ASP N N 119.63 0.06 1 409 683 126 ASN H H 8.23 0.02 1 410 683 126 ASN C C 178.34 0.02 1 411 683 126 ASN CA C 57.01 0.03 1 412 683 126 ASN CB C 40.2 0.04 1 413 683 126 ASN N N 121.08 0.12 1 414 684 127 ILE H H 7.86 0.02 1 415 684 127 ILE CA C 65.08 0.02 1 416 684 127 ILE CB C 37.03 0.02 1 417 684 127 ILE N N 124.37 0.19 1 418 687 130 GLY C C 174.01 0.02 1 419 687 130 GLY CA C 46.29 0.02 1 420 688 131 ARG H H 7.74 0.02 1 421 688 131 ARG C C 174.85 0.04 1 422 688 131 ARG CA C 56.67 0.06 1 423 688 131 ARG CB C 30.69 0.02 1 424 688 131 ARG N N 121.92 0.08 1 425 689 132 VAL H H 8.14 0.02 1 426 689 132 VAL C C 175.72 0.02 1 427 689 132 VAL CA C 64.73 0.03 1 428 689 132 VAL CB C 30.93 0.02 1 429 689 132 VAL N N 124.61 0.18 1 430 690 133 THR H H 7.01 0.02 1 431 690 133 THR C C 174.87 0.03 1 432 690 133 THR CA C 60.63 0.02 1 433 690 133 THR CB C 68.25 1.48 1 434 690 133 THR N N 109.22 0.24 1 435 691 134 ALA H H 8.15 0.02 1 436 691 134 ALA C C 178.27 0.03 1 437 691 134 ALA CA C 52.16 0.15 1 438 691 134 ALA CB C 19.4 0.33 1 439 691 134 ALA N N 127.77 0.06 1 440 692 135 GLY H H 8.88 0.02 1 441 692 135 GLY C C 174.67 0.02 1 442 692 135 GLY CA C 43.27 0.03 1 443 692 135 GLY N N 112.39 0.11 1 444 694 137 ASP C C 178.73 0.02 1 445 694 137 ASP CA C 56.04 0.13 1 446 695 138 GLU H H 7.41 0.02 1 447 695 138 GLU C C 179.17 0.07 1 448 695 138 GLU CA C 58.45 0.11 1 449 695 138 GLU CB C 29.53 0.09 1 450 695 138 GLU N N 124.56 0.18 1 451 696 139 VAL H H 7.83 0.02 1 452 696 139 VAL C C 176.75 0.02 1 453 696 139 VAL CA C 66.62 0.08 1 454 696 139 VAL CB C 30.34 0.6 1 455 696 139 VAL N N 124.14 0.21 1 456 697 140 GLU H H 7.84 0.02 1 457 697 140 GLU C C 178.73 0.02 1 458 697 140 GLU CA C 58.33 0.07 1 459 697 140 GLU CB C 27.92 0.16 1 460 697 140 GLU N N 121.25 0.09 1 461 698 141 ALA H H 7.74 0.02 1 462 698 141 ALA C C 181.2 0.05 1 463 698 141 ALA CA C 54.32 0.02 1 464 698 141 ALA CB C 17.02 0.2 1 465 698 141 ALA N N 122.83 0.1 1 466 699 142 ALA H H 8.04 0.02 1 467 699 142 ALA C C 179.05 0.02 1 468 699 142 ALA CA C 54.54 0.11 1 469 699 142 ALA CB C 17.22 0.09 1 470 699 142 ALA N N 125.61 0.07 1 471 700 143 ALA H H 8.52 0.02 1 472 700 143 ALA C C 180.93 0.06 1 473 700 143 ALA CA C 54.63 0.27 1 474 700 143 ALA CB C 18.77 0.2 1 475 700 143 ALA N N 122.58 0.2 1 476 701 144 GLN H H 8.77 0.02 1 477 701 144 GLN C C 179.73 0.05 1 478 701 144 GLN CA C 58.34 0.1 1 479 701 144 GLN CB C 26.64 0.15 1 480 701 144 GLN N N 122.37 0.19 1 481 702 145 ALA H H 8.02 0.02 1 482 702 145 ALA C C 179.14 0.03 1 483 702 145 ALA CA C 54.3 0.04 1 484 702 145 ALA CB C 17.73 0.43 1 485 702 145 ALA N N 126.61 0.13 1 486 703 146 ALA H H 8.05 0.02 1 487 703 146 ALA C C 176.75 0.02 1 488 703 146 ALA CA C 51.59 0.14 1 489 703 146 ALA CB C 19.69 0.54 1 490 703 146 ALA N N 119.91 0.14 1 491 704 147 GLY H H 7.65 0.02 1 492 704 147 GLY C C 174.75 0.07 1 493 704 147 GLY CA C 45.82 0.14 1 494 704 147 GLY N N 107.47 0.12 1 495 705 148 ILE H H 8.27 0.02 1 496 705 148 ILE C C 173.6 0.09 1 497 705 148 ILE CA C 57.5 0.04 1 498 705 148 ILE CB C 41.6 0.63 1 499 705 148 ILE N N 117.53 0.17 1 500 706 149 HIS H H 7.05 0.02 1 501 706 149 HIS C C 175.3 0.21 1 502 706 149 HIS CA C 59.51 0.09 1 503 706 149 HIS CB C 30.66 0.15 1 504 706 149 HIS N N 126.78 0.15 1 505 707 150 ASP H H 8.3 0.02 1 506 707 150 ASP C C 178.64 0.05 1 507 707 150 ASP CA C 56.95 0.02 1 508 707 150 ASP CB C 38.46 0.21 1 509 707 150 ASP N N 118.69 0.11 1 510 708 151 ALA H H 7.52 0.02 1 511 708 151 ALA C C 179.27 0.03 1 512 708 151 ALA CA C 53.77 0.08 1 513 708 151 ALA CB C 16.63 0.02 1 514 708 151 ALA N N 124.85 0.16 1 515 709 152 ILE H H 7.21 0.02 1 516 709 152 ILE C C 178.26 0.02 1 517 709 152 ILE CA C 62.93 0.02 1 518 709 152 ILE CB C 36.04 0.26 1 519 709 152 ILE N N 120.41 0.21 1 520 710 153 MET H H 7.6 0.02 1 521 710 153 MET C C 177.54 0.02 1 522 710 153 MET CA C 54.39 0.06 1 523 710 153 MET CB C 29.07 0.66 1 524 710 153 MET N N 116.77 0.14 1 525 711 154 ALA H H 6.92 0.02 1 526 711 154 ALA C C 178.6 0.02 1 527 711 154 ALA CA C 51.15 0.11 1 528 711 154 ALA CB C 17.73 0.02 1 529 711 154 ALA N N 122.36 0.15 1 530 712 155 PHE H H 7.66 0.02 1 531 712 155 PHE C C 176.84 0.02 1 532 712 155 PHE CA C 52.82 0.02 1 533 712 155 PHE CB C 35.83 0.02 1 534 712 155 PHE N N 124.41 0.15 1 535 713 156 PRO CA C 65.44 0.02 1 536 713 156 PRO CB C 30.91 0.02 1 537 714 157 GLU H H 7.61 0.02 1 538 714 157 GLU C C 177.61 0.02 1 539 714 157 GLU CA C 54.13 0.14 1 540 714 157 GLU CB C 28.68 0.02 1 541 714 157 GLU N N 114.39 0.16 1 542 715 158 GLY H H 7.59 0.02 1 543 715 158 GLY C C 178.07 0.02 1 544 715 158 GLY CA C 45.89 0.05 1 545 715 158 GLY N N 111.14 0.11 1 546 716 159 TYR H H 9.39 0.02 1 547 716 159 TYR C C 175.63 0.07 1 548 716 159 TYR CA C 62.15 0.11 1 549 716 159 TYR CB C 37.81 0.02 1 550 716 159 TYR N N 128.88 0.15 1 551 717 160 ARG H H 7.88 0.02 1 552 717 160 ARG C C 175.15 0.02 1 553 717 160 ARG CA C 55.12 0.12 1 554 717 160 ARG CB C 28.41 0.13 1 555 717 160 ARG N N 118.25 0.07 1 556 718 161 THR H H 7.42 0.02 1 557 718 161 THR C C 174.17 0.1 1 558 718 161 THR CA C 64.38 0.09 1 559 718 161 THR CB C 69.21 0.18 1 560 718 161 THR N N 119.67 0.14 1 561 719 162 GLN H H 8.84 0.02 1 562 719 162 GLN C C 176.17 0.08 1 563 719 162 GLN CA C 55.79 0.02 1 564 719 162 GLN CB C 26.86 0.22 1 565 719 162 GLN N N 129.7 0.2 1 566 720 163 VAL H H 8.15 0.02 1 567 720 163 VAL C C 174.38 0.03 1 568 720 163 VAL CA C 59.43 0.05 1 569 720 163 VAL CB C 32.53 0.32 1 570 720 163 VAL N N 121.24 0.1 1 571 721 164 GLY H H 7.96 0.02 1 572 721 164 GLY C C 175.27 0.02 1 573 721 164 GLY CA C 43.3 0.06 1 574 721 164 GLY N N 108.26 0.17 1 575 722 165 GLU H H 8.28 0.02 1 576 722 165 GLU C C 177.95 0.02 1 577 722 165 GLU CA C 58.41 0.02 1 578 722 165 GLU CB C 29.2 0.02 1 579 722 165 GLU N N 123.61 0.09 1 580 723 166 ARG C C 175.84 0.02 1 581 723 166 ARG CA C 55.01 0.02 1 582 723 166 ARG CB C 28.31 0.02 1 583 724 167 GLY H H 7.27 0.02 1 584 724 167 GLY C C 172.41 0.04 1 585 724 167 GLY CA C 43.24 0.25 1 586 724 167 GLY N N 111 0.14 1 587 725 168 LEU H H 8.14 0.02 1 588 725 168 LEU C C 176.02 0.03 1 589 725 168 LEU CA C 54.88 0.04 1 590 725 168 LEU CB C 41.28 0.19 1 591 725 168 LEU N N 127.96 0.04 1 592 726 169 LYS H H 8.17 0.02 1 593 726 169 LYS C C 175.84 0.09 1 594 726 169 LYS CA C 55.12 0.14 1 595 726 169 LYS CB C 30.93 0.47 1 596 726 169 LYS N N 127.55 0.11 1 597 727 170 LEU H H 7.94 0.02 1 598 727 170 LEU C C 176.97 0.02 1 599 727 170 LEU CA C 53.35 0.18 1 600 727 170 LEU CB C 41.82 0.29 1 601 727 170 LEU N N 128.33 0.23 1 602 728 171 SER H H 9.19 0.02 1 603 728 171 SER C C 174.97 0.02 1 604 728 171 SER CA C 56.82 0.02 1 605 728 171 SER CB C 64.84 0.02 1 606 728 171 SER N N 120.81 0.17 1 607 730 173 GLY C C 176.19 0.02 1 608 730 173 GLY CA C 46.4 0.02 1 609 731 174 GLU H H 7.6 0.02 1 610 731 174 GLU C C 178.72 0.15 1 611 731 174 GLU CA C 59.06 0.07 1 612 731 174 GLU CB C 29.09 0.05 1 613 731 174 GLU N N 124.02 0.1 1 614 732 175 LYS H H 8.6 0.02 1 615 732 175 LYS C C 178.78 0.08 1 616 732 175 LYS CA C 60.77 0.1 1 617 732 175 LYS CB C 31.31 0.02 1 618 732 175 LYS N N 120.46 0.1 1 619 733 176 GLN H H 8 0.02 1 620 733 176 GLN C C 178.9 0.04 1 621 733 176 GLN CA C 57.84 0.02 1 622 733 176 GLN N N 119.67 0.12 1 623 734 177 ARG H H 7.76 0.02 1 624 734 177 ARG C C 178.81 0.04 1 625 734 177 ARG CA C 59.68 0.06 1 626 734 177 ARG CB C 29.1 0.02 1 627 734 177 ARG N N 120.1 0.22 1 628 735 178 VAL H H 8.09 0.02 1 629 735 178 VAL C C 177.34 0.03 1 630 735 178 VAL CA C 67.01 0.07 1 631 735 178 VAL CB C 29.75 0.1 1 632 735 178 VAL N N 123.84 0.11 1 633 736 179 ALA H H 7.78 0.02 1 634 736 179 ALA C C 181.66 0.13 1 635 736 179 ALA CA C 55.22 0.06 1 636 736 179 ALA CB C 17.66 0.49 1 637 736 179 ALA N N 124.22 0.16 1 638 737 180 ILE H H 8.15 0.03 1 639 737 180 ILE C C 176.9 0.02 1 640 737 180 ILE CA C 65.64 0.02 1 641 737 180 ILE N N 122.71 0.13 1 642 738 181 ALA H H 8.57 0.02 1 643 738 181 ALA C C 178.67 0.04 1 644 738 181 ALA CA C 54.98 0.06 1 645 738 181 ALA CB C 17.36 0.02 1 646 738 181 ALA N N 125.73 0.17 1 647 739 182 ARG H H 8.59 0.02 1 648 739 182 ARG C C 178.53 0.02 1 649 739 182 ARG CA C 59.15 0.13 1 650 739 182 ARG CB C 30.41 0.02 1 651 739 182 ARG N N 117.94 0.17 1 652 740 183 THR H H 7.55 0.02 1 653 740 183 THR C C 175.88 0.02 1 654 740 183 THR CA C 66.77 0.02 1 655 740 183 THR N N 118.27 0.04 1 656 741 184 ILE H H 8.49 0.02 1 657 741 184 ILE CA C 64.58 0.02 1 658 741 184 ILE CB C 37.72 0.02 1 659 741 184 ILE N N 125.23 0.02 1 660 742 185 LEU CA C 56.56 0.02 1 661 742 185 LEU CB C 41.05 0.02 1 662 743 186 LYS H H 7.71 0.02 1 663 743 186 LYS C C 175.44 0.02 1 664 743 186 LYS CA C 58.64 0.02 1 665 743 186 LYS CB C 31.99 0.11 1 666 743 186 LYS N N 121.98 0.04 1 667 744 187 ALA H H 8.1 0.02 1 668 744 187 ALA C C 173.75 0.02 1 669 744 187 ALA CA C 51.66 0.02 1 670 744 187 ALA CB C 16.15 0.02 1 671 744 187 ALA N N 120.45 0.25 1 672 746 189 GLY C C 173.27 0.02 1 673 746 189 GLY CA C 45.27 0.02 1 674 747 190 ILE H H 7.82 0.02 1 675 747 190 ILE C C 173.82 0.02 1 676 747 190 ILE CA C 58.88 0.12 1 677 747 190 ILE CB C 40.66 0.17 1 678 747 190 ILE N N 122.51 0.12 1 679 748 191 ILE H H 9.1 0.02 1 680 748 191 ILE C C 173.2 0.02 1 681 748 191 ILE CA C 57.99 0.28 1 682 748 191 ILE CB C 38.13 0.73 1 683 748 191 ILE N N 129.47 0.17 1 684 749 192 LEU H H 8.75 0.02 1 685 749 192 LEU C C 174.78 0.02 1 686 749 192 LEU CA C 51.72 0.07 1 687 749 192 LEU CB C 41.01 0.18 1 688 749 192 LEU N N 126.84 0.18 1 689 750 193 LEU H H 8.99 0.02 1 690 750 193 LEU C C 174 0.02 1 691 750 193 LEU CA C 52.61 0.26 1 692 750 193 LEU CB C 42.4 0.42 1 693 750 193 LEU N N 126.22 0.11 1 694 751 194 ASP H H 8.07 0.02 1 695 751 194 ASP CA C 51.73 0.02 1 696 751 194 ASP CB C 41.17 0.02 1 697 751 194 ASP N N 126.31 0.2 1 698 757 200 LEU C C 176.56 0.02 1 699 757 200 LEU CA C 53.45 0.02 1 700 757 200 LEU CB C 41.76 0.02 1 701 758 201 ASP H H 8.12 0.02 1 702 758 201 ASP C C 175.97 0.02 1 703 758 201 ASP CA C 52.72 0.02 1 704 758 201 ASP CB C 40.46 0.02 1 705 758 201 ASP N N 121.84 0.18 1 706 766 209 GLN C C 178.56 0.02 1 707 766 209 GLN CA C 54.49 0.02 1 708 767 210 ALA H H 7.85 0.02 1 709 767 210 ALA C C 180.33 0.23 1 710 767 210 ALA CA C 54.31 0.02 1 711 767 210 ALA N N 123.78 0.13 1 712 768 211 SER H H 7.76 0.02 1 713 768 211 SER CA C 61.78 0.15 1 714 768 211 SER N N 117.87 0.11 1 715 769 212 LEU H H 8.46 0.02 1 716 769 212 LEU C C 178.22 0.06 1 717 769 212 LEU CA C 56.68 0.09 1 718 769 212 LEU CB C 40.66 1.08 1 719 769 212 LEU N N 124.56 0.05 1 720 770 213 ALA H H 8.06 0.02 1 721 770 213 ALA C C 180.3 0.03 1 722 770 213 ALA CA C 54.26 0.07 1 723 770 213 ALA CB C 16.92 0.02 1 724 770 213 ALA N N 123.52 0.22 1 725 771 214 LYS H H 7.19 0.03 1 726 771 214 LYS C C 178.9 0.15 1 727 771 214 LYS CA C 58.02 0.07 1 728 771 214 LYS CB C 30.73 0.02 1 729 771 214 LYS N N 117.96 0.24 1 730 772 215 VAL H H 7.57 0.02 1 731 772 215 VAL CA C 63.82 0.02 1 732 772 215 VAL CB C 31.26 0.02 1 733 772 215 VAL N N 120.6 0.09 1 734 774 217 ALA C C 177.74 0.1 1 735 774 217 ALA CA C 53.21 0.02 1 736 774 217 ALA CB C 17.53 0.02 1 737 775 218 ASN H H 8.86 0.03 1 738 775 218 ASN C C 173.76 0.14 1 739 775 218 ASN CA C 54.05 0.12 1 740 775 218 ASN CB C 37.17 0.04 1 741 775 218 ASN N N 117.09 0.14 1 742 776 219 ARG H H 7.86 0.02 1 743 776 219 ARG C C 175.62 0.04 1 744 776 219 ARG CA C 54.22 0.05 1 745 776 219 ARG CB C 31.55 0.46 1 746 776 219 ARG N N 120.82 0.09 1 747 777 220 THR H H 8.12 0.02 1 748 777 220 THR C C 172.88 0.02 1 749 777 220 THR CA C 63.41 0.13 1 750 777 220 THR CB C 68.96 0.02 1 751 777 220 THR N N 123.42 0.12 1 752 778 221 THR H H 8.87 0.02 1 753 778 221 THR C C 173.41 0.07 1 754 778 221 THR CA C 61.45 0.16 1 755 778 221 THR CB C 70.97 0.53 1 756 778 221 THR N N 127.96 0.09 1 757 779 222 ILE H H 8.66 0.02 1 758 779 222 ILE C C 173.65 0.1 1 759 779 222 ILE CA C 59.3 0.21 1 760 779 222 ILE CB C 38.31 0.33 1 761 779 222 ILE N N 126.71 0.18 1 762 780 223 VAL H H 9.12 0.02 1 763 780 223 VAL C C 173.99 0.08 1 764 780 223 VAL CA C 58.2 0.1 1 765 780 223 VAL CB C 34.12 0.02 1 766 780 223 VAL N N 127.91 0.14 1 767 781 224 VAL H H 8.79 0.02 1 768 781 224 VAL C C 174.85 0.02 1 769 781 224 VAL CA C 61.21 0.05 1 770 781 224 VAL CB C 31.41 0.42 1 771 781 224 VAL N N 129.77 0.02 1 772 782 225 ALA H H 7.87 0.02 1 773 782 225 ALA C C 175.68 0.02 1 774 782 225 ALA CA C 50.48 0.02 1 775 782 225 ALA CB C 21.97 0.02 1 776 782 225 ALA N N 130.54 0.11 1 777 787 230 THR C C 176.26 0.02 1 778 787 230 THR CA C 63.55 0.02 1 779 787 230 THR CB C 68.59 0.02 1 780 788 231 VAL H H 7.65 0.03 1 781 788 231 VAL C C 175.82 0.04 1 782 788 231 VAL CA C 60.48 0.02 1 783 788 231 VAL CB C 30.9 0.3 1 784 788 231 VAL N N 114.83 0.15 1 785 789 232 VAL H H 6.52 0.04 1 786 789 232 VAL C C 176.98 0.17 1 787 789 232 VAL CA C 64.29 0.09 1 788 789 232 VAL CB C 30.64 0.02 1 789 789 232 VAL N N 116.68 0.25 1 790 790 233 ASN H H 8.3 0.03 1 791 790 233 ASN C C 175.29 0.09 1 792 790 233 ASN CA C 51.91 0.02 1 793 790 233 ASN CB C 38 0.27 1 794 790 233 ASN N N 118.72 0.11 1 795 791 234 ALA H H 7.82 0.02 1 796 791 234 ALA C C 177.07 0.1 1 797 791 234 ALA CA C 52.87 0.02 1 798 791 234 ALA CB C 18.09 0.02 1 799 791 234 ALA N N 126.53 0.08 1 800 792 235 ASP H H 8.16 0.02 1 801 792 235 ASP C C 175.7 0.02 1 802 792 235 ASP CA C 57.12 0.02 1 803 792 235 ASP CB C 40.97 0.55 1 804 792 235 ASP N N 122.78 0.02 1 805 793 236 GLN H H 7.46 0.02 1 806 793 236 GLN C C 171.54 0.06 1 807 793 236 GLN CA C 55.24 0.1 1 808 793 236 GLN CB C 32.19 0.23 1 809 793 236 GLN N N 115.94 0.15 1 810 794 237 ILE H H 8.55 0.02 1 811 794 237 ILE C C 174.41 0.1 1 812 794 237 ILE CA C 59.97 0.12 1 813 794 237 ILE CB C 38.47 0.04 1 814 794 237 ILE N N 128.87 0.17 1 815 795 238 LEU H H 8.91 0.02 1 816 795 238 LEU C C 174.39 0.1 1 817 795 238 LEU CA C 52.43 0.04 1 818 795 238 LEU CB C 42.1 0.12 1 819 795 238 LEU N N 126.78 0.09 1 820 796 239 VAL H H 8.36 0.02 1 821 796 239 VAL C C 174.69 0.16 1 822 796 239 VAL CA C 59.88 0.1 1 823 796 239 VAL CB C 30.41 0.08 1 824 796 239 VAL N N 124.88 0.16 1 825 797 240 ILE H H 9.22 0.02 1 826 797 240 ILE C C 174.15 0.08 1 827 797 240 ILE CA C 57.58 0.17 1 828 797 240 ILE CB C 37.23 0.02 1 829 797 240 ILE N N 131.67 0.12 1 830 798 241 LYS H H 8.78 0.02 1 831 798 241 LYS C C 176.02 0.02 1 832 798 241 LYS CA C 55.4 0.02 1 833 798 241 LYS CB C 35.48 0.02 1 834 798 241 LYS N N 126.63 0.13 1 835 799 242 ASP H H 9.35 0.02 1 836 799 242 ASP C C 175.46 0.02 1 837 799 242 ASP CA C 55.18 0.14 1 838 799 242 ASP N N 129.53 0.03 1 839 800 243 GLY H H 8.09 0.02 1 840 800 243 GLY C C 172.34 0.07 1 841 800 243 GLY CA C 46.02 0.02 1 842 800 243 GLY N N 105.46 0.15 1 843 801 244 CYS H H 7.53 0.02 1 844 801 244 CYS C C 173.86 0.06 1 845 801 244 CYS CA C 55.61 0.14 1 846 801 244 CYS CB C 30.58 0.66 1 847 801 244 CYS N N 116.92 0.1 1 848 802 245 ILE H H 9 0.02 1 849 802 245 ILE C C 177.09 0.09 1 850 802 245 ILE CA C 60.63 0.03 1 851 802 245 ILE CB C 35.82 0.66 1 852 802 245 ILE N N 124.2 0.15 1 853 803 246 VAL H H 8.99 0.02 1 854 803 246 VAL C C 176.06 0.05 1 855 803 246 VAL CA C 61.73 0.04 1 856 803 246 VAL CB C 31.64 0.59 1 857 803 246 VAL N N 126.24 0.18 1 858 804 247 GLU H H 7.5 0.02 1 859 804 247 GLU C C 173.35 0.02 1 860 804 247 GLU CA C 54.84 0.02 1 861 804 247 GLU CB C 33.54 0.02 1 862 804 247 GLU N N 120.72 0.14 1 863 805 248 ARG H H 8.27 0.02 1 864 805 248 ARG C C 174.44 0.04 1 865 805 248 ARG CA C 53.77 0.22 1 866 805 248 ARG CB C 33.34 0.35 1 867 805 248 ARG N N 118.72 0.09 1 868 806 249 GLY H H 8.57 0.02 1 869 806 249 GLY C C 171.31 0.09 1 870 806 249 GLY CA C 44.51 0.06 1 871 806 249 GLY N N 111.43 0.19 1 872 807 250 ARG H H 7.82 0.02 1 873 807 250 ARG C C 176.03 0.03 1 874 807 250 ARG CA C 55.13 0.08 1 875 807 250 ARG CB C 30.83 0.02 1 876 807 250 ARG N N 120.67 0.09 1 877 808 251 HIS H H 8.7 0.02 1 878 808 251 HIS C C 175.56 0.11 1 879 808 251 HIS CA C 60.12 0.02 1 880 808 251 HIS CB C 31.27 0.59 1 881 808 251 HIS N N 123.49 0.16 1 882 809 252 GLU H H 8.92 0.02 1 883 809 252 GLU C C 179 0.04 1 884 809 252 GLU CA C 59.45 0.08 1 885 809 252 GLU CB C 27.09 0.65 1 886 809 252 GLU N N 117.24 0.15 1 887 810 253 ALA H H 6.91 0.02 1 888 810 253 ALA C C 180.65 0.02 1 889 810 253 ALA CA C 53.58 0.1 1 890 810 253 ALA CB C 18.09 0.69 1 891 810 253 ALA N N 124.24 0.16 1 892 811 254 LEU H H 8.09 0.02 1 893 811 254 LEU C C 180.65 0.08 1 894 811 254 LEU CA C 56.69 0.06 1 895 811 254 LEU CB C 40.82 0.02 1 896 811 254 LEU N N 122.13 0.14 1 897 812 255 LEU H H 8.17 0.02 1 898 812 255 LEU C C 179.92 0.02 1 899 812 255 LEU CA C 57.25 0.11 1 900 812 255 LEU CB C 40.08 0.15 1 901 812 255 LEU N N 122.63 0.08 1 902 813 256 SER H H 7.44 0.02 1 903 813 256 SER C C 175.28 0.02 1 904 813 256 SER CA C 60.14 0.13 1 905 813 256 SER CB C 62.9 0.29 1 906 813 256 SER N N 116.3 0.1 1 907 814 257 ARG H H 7.34 0.02 1 908 814 257 ARG C C 178.41 0.06 1 909 814 257 ARG CA C 56.73 0.19 1 910 814 257 ARG CB C 29.52 0.26 1 911 814 257 ARG N N 121.56 0.15 1 912 815 258 GLY H H 7.25 0.02 1 913 815 258 GLY C C 173.94 0.12 1 914 815 258 GLY CA C 46.32 0.05 1 915 815 258 GLY N N 106.23 0.14 1 916 816 259 GLY H H 8.35 0.02 1 917 816 259 GLY C C 173.87 0.02 1 918 816 259 GLY CA C 43.62 0.06 1 919 816 259 GLY N N 113.43 0.2 1 920 817 260 VAL H H 9.58 0.02 1 921 817 260 VAL C C 179.07 0.02 1 922 817 260 VAL CA C 65.39 0.02 1 923 817 260 VAL CB C 31.37 0.16 1 924 817 260 VAL N N 129.68 0.16 1 925 818 261 TYR H H 9.27 0.02 1 926 818 261 TYR C C 176.83 0.02 1 927 818 261 TYR CA C 61.78 0.02 1 928 818 261 TYR CB C 38 0.02 1 929 818 261 TYR N N 124.5 0.2 1 930 819 262 ALA H H 8.13 0.02 1 931 819 262 ALA C C 179.84 0.02 1 932 819 262 ALA CA C 54.46 0.31 1 933 819 262 ALA CB C 17.73 0.02 1 934 819 262 ALA N N 122.2 0.11 1 935 820 263 ASP H H 8.16 0.02 1 936 820 263 ASP C C 178.89 0.02 1 937 820 263 ASP CA C 56.8 0.03 1 938 820 263 ASP CB C 39.74 0.09 1 939 820 263 ASP N N 121.65 0.16 1 940 821 264 MET H H 8.09 0.02 1 941 821 264 MET C C 178 0.02 1 942 821 264 MET CA C 58.91 0.06 1 943 821 264 MET CB C 32.97 0.02 1 944 821 264 MET N N 122.63 0.11 1 945 822 265 TRP H H 8.8 0.02 1 946 822 265 TRP C C 178.18 0.02 1 947 822 265 TRP CA C 59.93 0.17 1 948 822 265 TRP CB C 28.83 0.02 1 949 822 265 TRP N N 122.66 0.05 1 950 823 266 GLN H H 8.09 0.02 1 951 823 266 GLN C C 178.87 0.03 1 952 823 266 GLN CA C 57.91 0.07 1 953 823 266 GLN CB C 27.34 0.76 1 954 823 266 GLN N N 119.66 0.12 1 955 824 267 LEU H H 7.64 0.02 1 956 824 267 LEU C C 179.2 0.02 1 957 824 267 LEU CA C 56.81 0.02 1 958 824 267 LEU CB C 40.81 0.32 1 959 824 267 LEU N N 122.05 0.13 1 960 825 268 GLN H H 7.67 0.02 1 961 825 268 GLN C C 177.46 0.03 1 962 825 268 GLN CA C 57.08 0.05 1 963 825 268 GLN CB C 27.05 0.06 1 964 825 268 GLN N N 118.88 0.1 1 965 826 269 GLN H H 7.79 0.02 1 966 826 269 GLN C C 177.2 0.07 1 967 826 269 GLN CA C 55.72 0.13 1 968 826 269 GLN CB C 27.79 0.57 1 969 826 269 GLN N N 120.3 0.11 1 970 827 270 GLY H H 7.74 0.02 1 971 827 270 GLY C C 174.22 0.08 1 972 827 270 GLY CA C 44.94 0.21 1 973 827 270 GLY N N 109.78 0.12 1 974 828 271 GLN H H 7.81 0.02 1 975 828 271 GLN C C 175.97 0.02 1 976 828 271 GLN CA C 55.17 0.12 1 977 828 271 GLN CB C 28.21 0.05 1 978 828 271 GLN N N 121.46 0.1 1 979 829 272 GLU H H 8.18 0.02 1 980 829 272 GLU C C 176.45 0.03 1 981 829 272 GLU CA C 56.06 0.02 1 982 829 272 GLU CB C 29.19 0.19 1 983 829 272 GLU N N 123.91 0.12 1 984 830 273 GLU H H 8.35 0.02 1 985 830 273 GLU C C 176.3 0.08 1 986 830 273 GLU CA C 55.99 0.1 1 987 830 273 GLU CB C 29.27 0.21 1 988 830 273 GLU N N 124.42 0.11 1 989 831 274 THR H H 8.04 0.02 1 990 831 274 THR CA C 60.76 0.02 1 991 831 274 THR CB C 69.32 0.02 1 992 831 274 THR N N 117.3 0.15 1 993 832 275 SER H H 8.3 0.02 1 994 832 275 SER CA C 57.9 0.02 1 995 832 275 SER N N 120.77 0.02 1 996 833 276 GLU H H 8.44 0.02 1 997 833 276 GLU CA C 56.06 0.08 1 998 833 276 GLU N N 125.43 0.02 1 999 834 277 ASP H H 8.28 0.02 1 1000 834 277 ASP C C 176.21 0.06 1 1001 834 277 ASP CA C 53.89 0.02 1 1002 834 277 ASP CB C 40.32 0.02 1 1003 834 277 ASP N N 123.26 0.19 1 1004 835 278 THR H H 7.93 0.02 1 1005 835 278 THR C C 174.25 0.02 1 1006 835 278 THR CA C 61.11 0.17 1 1007 835 278 THR CB C 68.91 0.09 1 1008 835 278 THR N N 116.64 0.18 1 1009 836 279 LYS H H 8.15 0.02 1 1010 836 279 LYS C C 174.24 0.02 1 1011 836 279 LYS CA C 53.8 0.02 1 1012 836 279 LYS CB C 31.32 0.02 1 1013 836 279 LYS N N 127.56 0.13 1 1014 838 281 GLN H H 8.49 0.02 1 1015 838 281 GLN C C 176.49 0.02 1 1016 838 281 GLN CA C 55.89 0.06 1 1017 838 281 GLN CB C 28.98 0.02 1 1018 838 281 GLN N N 123.35 0.02 1 1019 839 282 THR H H 8.16 0.02 1 1020 839 282 THR CA C 60.88 0.02 1 1021 839 282 THR CB C 69.14 0.02 1 1022 839 282 THR N N 117.72 0.21 1 1023 840 283 MET H H 8.32 0.02 1 1024 840 283 MET C C 175.72 0.02 1 1025 840 283 MET CA C 54.52 0.28 1 1026 840 283 MET N N 125.07 0.04 1 1027 841 284 GLU H H 8.33 0.02 1 1028 841 284 GLU C C 175.26 0.02 1 1029 841 284 GLU CA C 56.06 0.04 1 1030 841 284 GLU N N 125.28 0.17 1 1031 842 285 ARG H H 7.88 0.02 1 1032 842 285 ARG C C 180.74 0.02 1 1033 842 285 ARG CA C 56.69 0.02 1 1034 842 285 ARG CB C 30.18 0.02 1 1035 842 285 ARG N N 129.44 0.1 1 stop_ save_ save_ph75_278K _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $software_3 stop_ loop_ _Experiment_label '1H-15N TROSY-HSQC' TROSY-HNCA TROSY-HN(CO)CA TROSY-HN(CA)CB TROSY-HN(COCA)CB TROSY-HN(CA)CO TRSOY-HNCO stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $condition_2 _Chem_shift_reference_set_label $reference_1 _Mol_system_component_name ABCB6-C _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 574 17 VAL C C 175.44 0.02 1 2 574 17 VAL CA C 61.33 0.02 1 3 575 18 LYS H H 8.95 0.02 1 4 575 18 LYS C C 176.79 0.02 1 5 575 18 LYS CA C 53.5 0.14 1 6 575 18 LYS N N 128.25 0.02 1 7 576 19 ASP H H 8.76 0.02 1 8 576 19 ASP C C 176.73 0.02 1 9 576 19 ASP CA C 52.86 0.02 1 10 576 19 ASP CB C 39.39 0.02 1 11 576 19 ASP N N 125.02 0.12 1 12 577 20 LEU H H 9.03 0.02 1 13 577 20 LEU CA C 52.47 0.02 1 14 577 20 LEU CB C 39.74 0.02 1 15 577 20 LEU N N 127.96 0.05 1 16 578 21 PRO CA C 63.16 0.07 1 17 579 22 GLY H H 8.86 0.02 1 18 579 22 GLY C C 174.03 0.02 1 19 579 22 GLY CA C 44.37 0.03 1 20 579 22 GLY N N 114.03 0.08 1 21 580 23 ALA H H 7.66 0.02 1 22 580 23 ALA C C 176.96 0.02 1 23 580 23 ALA CA C 52.45 0.17 1 24 580 23 ALA CB C 18.4 0.13 1 25 580 23 ALA N N 124.67 0.04 1 26 581 24 GLY H H 8.67 0.02 1 27 581 24 GLY C C 170.88 0.02 1 28 581 24 GLY CA C 42.4 0.02 1 29 581 24 GLY N N 112.63 0.06 1 30 582 25 PRO C C 177.63 0.02 1 31 583 26 LEU H H 8.79 0.02 1 32 583 26 LEU C C 175.35 0.02 1 33 583 26 LEU CA C 54.62 0.08 1 34 583 26 LEU CB C 41.25 0.02 1 35 583 26 LEU N N 123.52 0.02 1 36 584 27 ARG H H 9.6 0.02 1 37 584 27 ARG C C 174.88 0.05 1 38 584 27 ARG CA C 53.74 0.05 1 39 584 27 ARG CB C 26.64 0.02 1 40 584 27 ARG N N 132.47 0.02 1 41 585 28 PHE H H 8.54 0.02 1 42 585 28 PHE C C 174.81 0.06 1 43 585 28 PHE CA C 58.88 0.1 1 44 585 28 PHE CB C 38.09 0.02 1 45 585 28 PHE N N 129.86 0.1 1 46 586 29 GLN H H 8.59 0.03 1 47 586 29 GLN C C 173.05 0.02 1 48 586 29 GLN CA C 55.18 0.02 1 49 586 29 GLN N N 131.22 0.25 1 50 587 30 LYS H H 7.91 0.02 1 51 587 30 LYS CA C 54.69 0.02 1 52 587 30 LYS N N 118.92 0.02 1 53 588 31 GLY H H 9.56 0.02 1 54 588 31 GLY C C 173.37 0.02 1 55 588 31 GLY CA C 46.77 0.02 1 56 588 31 GLY N N 115.58 0.02 1 57 589 32 ARG H H 8.96 0.02 1 58 589 32 ARG C C 175.88 0.05 1 59 589 32 ARG CA C 54.88 0.18 1 60 589 32 ARG CB C 29.89 0.02 1 61 589 32 ARG N N 126.23 0.18 1 62 590 33 ILE H H 8.98 0.02 1 63 590 33 ILE C C 174.21 0.02 1 64 590 33 ILE CA C 59.66 0.08 1 65 590 33 ILE CB C 40.3 0.02 1 66 590 33 ILE N N 130.41 0.08 1 67 591 34 GLU H H 9.36 0.02 1 68 591 34 GLU C C 173.78 0.02 1 69 591 34 GLU CA C 54.01 0.02 1 70 591 34 GLU CB C 32.76 0.02 1 71 591 34 GLU N N 127.44 0.04 1 72 592 35 PHE H H 9.18 0.02 1 73 592 35 PHE C C 174.82 0.02 1 74 592 35 PHE CA C 55.7 0.21 1 75 592 35 PHE CB C 37.89 0.02 1 76 592 35 PHE N N 129.1 0.15 1 77 593 36 GLU H H 9.43 0.02 1 78 593 36 GLU C C 172.39 0.02 1 79 593 36 GLU CA C 54 0.02 1 80 593 36 GLU N N 129.05 0.11 1 81 594 37 ASN H H 9.1 0.02 1 82 594 37 ASN CA C 53.76 0.02 1 83 594 37 ASN CB C 37.29 0.02 1 84 594 37 ASN N N 125.41 0.18 1 85 595 38 VAL H H 8.76 0.02 1 86 595 38 VAL C C 173.81 0.02 1 87 595 38 VAL CA C 64.16 0.24 1 88 595 38 VAL N N 121.55 0.02 1 89 596 39 HIS H H 8.34 0.02 1 90 596 39 HIS CA C 53.47 0.02 1 91 596 39 HIS N N 126.27 0.08 1 92 607 50 GLN H H 8.94 0.02 1 93 607 50 GLN CA C 53.92 0.02 1 94 607 50 GLN N N 124.5 0.02 1 95 608 51 ASP C C 173.41 0.02 1 96 609 52 VAL H H 9.08 0.02 1 97 609 52 VAL CA C 63.27 0.02 1 98 609 52 VAL N N 123.25 0.02 1 99 610 53 SER H H 8.1 0.02 1 100 610 53 SER C C 172.73 0.02 1 101 610 53 SER CA C 55.72 0.02 1 102 610 53 SER N N 125.48 0.02 1 103 611 54 PHE H H 8.52 0.02 1 104 611 54 PHE C C 172.48 0.1 1 105 611 54 PHE CA C 57.02 0.11 1 106 611 54 PHE CB C 38.71 0.02 1 107 611 54 PHE N N 118.95 0.18 1 108 612 55 THR H H 9.11 0.02 1 109 612 55 THR C C 173.3 0.02 1 110 612 55 THR CA C 60.71 0.02 1 111 612 55 THR CB C 71.23 0.02 1 112 612 55 THR N N 118.32 0.16 1 113 613 56 VAL H H 9.85 0.02 1 114 613 56 VAL C C 174.7 0.02 1 115 613 56 VAL CA C 60.69 0.19 1 116 613 56 VAL CB C 32.08 0.02 1 117 613 56 VAL N N 130.02 0.05 1 118 614 57 MET H H 8.37 0.02 1 119 614 57 MET C C 172.71 0.02 1 120 614 57 MET CA C 51.73 0.02 1 121 614 57 MET N N 126.58 0.16 1 122 615 58 PRO C C 176.65 0.02 1 123 616 59 GLY H H 8.49 0.02 1 124 616 59 GLY C C 173.61 0.15 1 125 616 59 GLY CA C 44.37 0.03 1 126 616 59 GLY N N 111.41 0.08 1 127 617 60 GLN H H 8.06 0.02 1 128 617 60 GLN C C 174.24 0.04 1 129 617 60 GLN CA C 55.14 0.04 1 130 617 60 GLN CB C 28.93 0.02 1 131 617 60 GLN N N 121.71 0.04 1 132 618 61 THR H H 9.38 0.02 1 133 618 61 THR C C 173.46 0.02 1 134 618 61 THR CA C 60.96 0.05 1 135 618 61 THR CB C 70.07 0.02 1 136 618 61 THR N N 115.76 0.2 1 137 619 62 LEU H H 9.15 0.03 1 138 619 62 LEU C C 173.25 0.02 1 139 619 62 LEU CA C 51.89 0.17 1 140 619 62 LEU CB C 43.86 0.02 1 141 619 62 LEU N N 132.65 0.21 1 142 620 63 ALA H H 9.03 0.02 1 143 620 63 ALA C C 174.24 0.07 1 144 620 63 ALA CA C 48.39 0.19 1 145 620 63 ALA CB C 21.28 0.02 1 146 620 63 ALA N N 130.06 0.2 1 147 621 64 LEU H H 9.12 0.02 1 148 621 64 LEU C C 174.68 0.02 1 149 621 64 LEU CA C 52.27 0.1 1 150 621 64 LEU CB C 41.93 0.02 1 151 621 64 LEU N N 123.89 0.14 1 152 622 65 VAL H H 8.7 0.02 1 153 622 65 VAL CA C 57.21 0.02 1 154 622 65 VAL N N 116.69 0.02 1 155 640 83 TYR C C 174.44 0.02 1 156 641 84 ASP H H 8.79 0.02 1 157 641 84 ASP C C 176.32 0.02 1 158 641 84 ASP CA C 53.49 0.09 1 159 641 84 ASP N N 121.41 0.16 1 160 642 85 ILE H H 8.26 0.02 1 161 642 85 ILE C C 175.73 0.15 1 162 642 85 ILE CA C 60.86 0.02 1 163 642 85 ILE N N 114.89 0.19 1 164 643 86 SER H H 8.75 0.03 1 165 643 86 SER C C 174.63 0.02 1 166 643 86 SER CA C 59.18 0.02 1 167 643 86 SER N N 118.99 0.11 1 168 644 87 SER H H 7.84 0.02 1 169 644 87 SER C C 171.98 0.02 1 170 644 87 SER CA C 57.61 0.21 1 171 644 87 SER CB C 63.37 0.02 1 172 644 87 SER N N 115.58 0.12 1 173 645 88 GLY H H 8.57 0.02 1 174 645 88 GLY C C 173.64 0.04 1 175 645 88 GLY CA C 43.96 0.2 1 176 645 88 GLY N N 111.24 0.06 1 177 646 89 CYS H H 8.44 0.04 1 178 646 89 CYS C C 171.04 0.04 1 179 646 89 CYS CA C 58.61 0.02 1 180 646 89 CYS CB C 29.1 0.02 1 181 646 89 CYS N N 121.63 0.21 1 182 647 90 ILE H H 8.99 0.02 1 183 647 90 ILE C C 173.88 0.11 1 184 647 90 ILE CA C 59.37 0.07 1 185 647 90 ILE N N 131.56 0.13 1 186 648 91 ARG H H 9.25 0.02 1 187 648 91 ARG C C 176.34 0.04 1 188 648 91 ARG CA C 52.61 0.11 1 189 648 91 ARG CB C 34.5 0.02 1 190 648 91 ARG N N 125.16 0.06 1 191 649 92 ILE H H 8.3 0.02 1 192 649 92 ILE C C 175.14 0.1 1 193 649 92 ILE CA C 58.9 0.06 1 194 649 92 ILE CB C 39.87 0.02 1 195 649 92 ILE N N 122.42 0.13 1 196 650 93 ASP H H 9.67 0.02 1 197 650 93 ASP C C 176.79 0.02 1 198 650 93 ASP CA C 55.42 0.17 1 199 650 93 ASP CB C 38.85 0.02 1 200 650 93 ASP N N 129.87 0.07 1 201 651 94 GLY H H 9.39 0.02 1 202 651 94 GLY C C 173.58 0.02 1 203 651 94 GLY CA C 44.44 0.09 1 204 651 94 GLY N N 105.39 0.17 1 205 652 95 GLN H H 8.04 0.02 1 206 652 95 GLN C C 173.8 0.06 1 207 652 95 GLN CA C 54.07 0.14 1 208 652 95 GLN CB C 29.19 0.02 1 209 652 95 GLN N N 125.13 0.07 1 210 653 96 ASP H H 8.55 0.02 1 211 653 96 ASP C C 179.1 0.06 1 212 653 96 ASP CA C 52.44 0.05 1 213 653 96 ASP N N 126.25 0.08 1 214 654 97 ILE H H 8.89 0.02 1 215 654 97 ILE CA C 63.84 0.02 1 216 654 97 ILE CB C 35.87 0.02 1 217 654 97 ILE N N 125.96 0.21 1 218 656 99 GLN H H 7.88 0.02 1 219 656 99 GLN C C 174.52 0.02 1 220 656 99 GLN CA C 54.42 0.02 1 221 656 99 GLN N N 121.74 0.02 1 222 657 100 VAL H H 6.73 0.03 1 223 657 100 VAL C C 177.48 0.05 1 224 657 100 VAL CA C 57.08 0.02 1 225 657 100 VAL CB C 33.69 0.02 1 226 657 100 VAL N N 111.14 0.19 1 227 658 101 THR H H 8.43 0.02 1 228 658 101 THR CA C 60.01 0.15 1 229 658 101 THR N N 117.02 0.06 1 230 659 102 GLN H H 10.58 0.02 1 231 659 102 GLN C C 177.95 0.02 1 232 659 102 GLN CA C 58.58 0.02 1 233 659 102 GLN N N 130.9 0.02 1 234 660 103 ALA H H 9.39 0.02 1 235 660 103 ALA C C 180.61 0.02 1 236 660 103 ALA CA C 53.92 0.02 1 237 660 103 ALA N N 122.11 0.08 1 238 661 104 SER H H 7.46 0.02 1 239 661 104 SER CA C 60.22 0.02 1 240 661 104 SER N N 116 0.02 1 241 662 105 LEU H H 7.72 0.02 1 242 662 105 LEU CA C 57.8 0.02 1 243 662 105 LEU N N 128.5 0.02 1 244 663 106 ARG H H 7.95 0.02 1 245 663 106 ARG CA C 58.41 0.02 1 246 663 106 ARG N N 114.58 0.02 1 247 664 107 SER C C 173.91 0.02 1 248 665 108 HIS H H 7.02 0.02 1 249 665 108 HIS C C 172.36 0.02 1 250 665 108 HIS CA C 55.87 0.02 1 251 665 108 HIS N N 119.71 0.06 1 252 666 109 ILE H H 7.26 0.02 1 253 666 109 ILE N N 120.12 0.02 1 254 671 114 GLN CA C 58.52 0.02 1 255 672 115 ASP H H 8.26 0.02 1 256 672 115 ASP CA C 51.37 0.02 1 257 672 115 ASP N N 120.36 0.12 1 258 677 120 ASN CA C 52.67 0.02 1 259 678 121 ASP H H 8.08 0.02 1 260 678 121 ASP CA C 51.65 0.06 1 261 678 121 ASP CB C 44.27 0.02 1 262 678 121 ASP N N 129.28 0.02 1 263 679 122 THR H H 10 0.02 1 264 679 122 THR C C 178.21 0.02 1 265 679 122 THR CA C 61.32 0.1 1 266 679 122 THR N N 112.43 0.02 1 267 680 123 ILE H H 8.97 0.02 1 268 680 123 ILE CA C 62.07 0.02 1 269 680 123 ILE N N 123.78 0.1 1 270 682 125 ASP H H 8.41 0.02 1 271 682 125 ASP CA C 57.04 0.02 1 272 682 125 ASP N N 119.21 0.02 1 273 688 131 ARG C C 174.52 0.02 1 274 689 132 VAL H H 8.33 0.02 1 275 689 132 VAL CA C 64.36 0.02 1 276 689 132 VAL N N 124.61 0.02 1 277 690 133 THR H H 7.13 0.02 1 278 690 133 THR CA C 60.94 0.02 1 279 690 133 THR N N 108.91 0.02 1 280 691 134 ALA H H 8.35 0.02 1 281 691 134 ALA CA C 51.93 0.02 1 282 691 134 ALA CB C 18.68 1.2 1 283 691 134 ALA N N 127.62 0.02 1 284 692 135 GLY H H 9.04 0.02 1 285 692 135 GLY CA C 43.04 0.02 1 286 692 135 GLY N N 112.36 0.02 1 287 694 137 ASP C C 178.57 0.02 1 288 694 137 ASP CA C 55.91 0.02 1 289 695 138 GLU H H 7.56 0.02 1 290 695 138 GLU C C 179.13 0.08 1 291 695 138 GLU CA C 58.2 0.02 1 292 695 138 GLU N N 124.65 0.12 1 293 696 139 VAL H H 8 0.02 1 294 696 139 VAL C C 176.43 0.02 1 295 696 139 VAL CA C 66.28 0.02 1 296 696 139 VAL N N 124.28 0.02 1 297 697 140 GLU H H 8 0.02 1 298 697 140 GLU C C 178.51 0.02 1 299 697 140 GLU CA C 54.1 0.02 1 300 697 140 GLU CB C 27.48 0.02 1 301 697 140 GLU N N 120.99 0.17 1 302 698 141 ALA H H 7.89 0.03 1 303 698 141 ALA C C 180.94 0.26 1 304 698 141 ALA CA C 54.1 0.02 1 305 698 141 ALA CB C 16.31 0.02 1 306 698 141 ALA N N 122.55 0.07 1 307 699 142 ALA H H 8.17 0.02 1 308 699 142 ALA C C 178.77 0.09 1 309 699 142 ALA CA C 54.23 0.02 1 310 699 142 ALA CB C 16.36 0.02 1 311 699 142 ALA N N 125.53 0.12 1 312 700 143 ALA H H 8.66 0.03 1 313 700 143 ALA C C 180.65 0.15 1 314 700 143 ALA CA C 54.39 0.02 1 315 700 143 ALA CB C 18.65 0.02 1 316 700 143 ALA N N 122.5 0.14 1 317 701 144 GLN H H 8.9 0.03 1 318 701 144 GLN C C 179.53 0.02 1 319 701 144 GLN CA C 58.03 0.07 1 320 701 144 GLN N N 122.17 0.23 1 321 702 145 ALA H H 8.15 0.02 1 322 702 145 ALA C C 179.12 0.15 1 323 702 145 ALA CA C 53.99 0.02 1 324 702 145 ALA CB C 17.19 0.02 1 325 702 145 ALA N N 126.54 0.09 1 326 703 146 ALA H H 8.24 0.02 1 327 703 146 ALA C C 176.44 0.02 1 328 703 146 ALA CA C 51.45 0.02 1 329 703 146 ALA N N 120.36 0.02 1 330 704 147 GLY H H 7.77 0.02 1 331 704 147 GLY C C 174.6 0.11 1 332 704 147 GLY CA C 45.59 0.02 1 333 704 147 GLY N N 107.46 0.05 1 334 705 148 ILE H H 8.44 0.04 1 335 705 148 ILE C C 173.22 0.02 1 336 705 148 ILE CA C 56.96 0.1 1 337 705 148 ILE N N 118.05 0.02 1 338 706 149 HIS H H 7.12 0.02 1 339 706 149 HIS CA C 59.31 0.07 1 340 706 149 HIS N N 126.7 0.18 1 341 707 150 ASP H H 8.53 0.02 1 342 707 150 ASP C C 178.49 0.02 1 343 707 150 ASP CA C 56.8 0.18 1 344 707 150 ASP N N 119.16 0.02 1 345 708 151 ALA H H 7.79 0.02 1 346 708 151 ALA C C 179.14 0.04 1 347 708 151 ALA CA C 53.56 0.09 1 348 708 151 ALA CB C 16.36 0.02 1 349 708 151 ALA N N 124.96 0.23 1 350 709 152 ILE H H 7.33 0.02 1 351 709 152 ILE C C 178.14 0.04 1 352 709 152 ILE CA C 62.56 0.04 1 353 709 152 ILE N N 120.25 0.23 1 354 710 153 MET H H 7.76 0.02 1 355 710 153 MET C C 177.51 0.02 1 356 710 153 MET CA C 54.23 0.22 1 357 710 153 MET N N 116.56 0.04 1 358 711 154 ALA H H 7.02 0.02 1 359 711 154 ALA C C 178.41 0.1 1 360 711 154 ALA CA C 50.92 0.02 1 361 711 154 ALA CB C 17.56 0.02 1 362 711 154 ALA N N 122 0.16 1 363 712 155 PHE H H 7.78 0.02 1 364 712 155 PHE C C 176.64 0.02 1 365 712 155 PHE CA C 52.46 0.02 1 366 712 155 PHE CB C 35.09 0.02 1 367 712 155 PHE N N 124.63 0.17 1 368 713 156 PRO C C 177.55 0.02 1 369 714 157 GLU H H 7.75 0.02 1 370 714 157 GLU C C 177.35 0.07 1 371 714 157 GLU CA C 53.68 0.02 1 372 714 157 GLU N N 114.16 0.04 1 373 715 158 GLY H H 7.71 0.02 1 374 715 158 GLY C C 177.94 0.11 1 375 715 158 GLY CA C 45.59 0.14 1 376 715 158 GLY N N 110.86 0.02 1 377 716 159 TYR H H 9.59 0.02 1 378 716 159 TYR C C 175.46 0.02 1 379 716 159 TYR CA C 61.97 0.09 1 380 716 159 TYR N N 128.71 0.03 1 381 717 160 ARG H H 7.99 0.02 1 382 717 160 ARG C C 174.93 0.02 1 383 717 160 ARG CA C 54.88 0.02 1 384 717 160 ARG N N 117.99 0.03 1 385 718 161 THR H H 7.56 0.02 1 386 718 161 THR C C 174.13 0.02 1 387 718 161 THR CA C 64.17 0.1 1 388 718 161 THR N N 119.38 0.02 1 389 719 162 GLN H H 9.04 0.02 1 390 719 162 GLN C C 176.16 0.02 1 391 719 162 GLN CA C 55.39 0.18 1 392 719 162 GLN CB C 26.36 0.02 1 393 719 162 GLN N N 129.44 0.06 1 394 720 163 VAL H H 8.31 0.02 1 395 720 163 VAL C C 174.06 0.02 1 396 720 163 VAL CA C 59.06 0.2 1 397 720 163 VAL CB C 32.04 0.02 1 398 720 163 VAL N N 120.99 0.15 1 399 721 164 GLY H H 8.11 0.02 1 400 721 164 GLY C C 173.91 0.02 1 401 721 164 GLY CA C 43.09 0.11 1 402 721 164 GLY N N 107.78 0.25 1 403 722 165 GLU H H 8.45 0.02 1 404 722 165 GLU CA C 58.23 0.02 1 405 722 165 GLU N N 123.26 0.03 1 406 723 166 ARG C C 175.68 0.02 1 407 723 166 ARG CA C 54.86 0.02 1 408 724 167 GLY H H 7.4 0.02 1 409 724 167 GLY C C 172.11 0.1 1 410 724 167 GLY CA C 42.77 0.27 1 411 724 167 GLY N N 111.1 0.09 1 412 725 168 LEU H H 8.31 0.02 1 413 725 168 LEU C C 175.79 0.07 1 414 725 168 LEU CA C 54.74 0.02 1 415 725 168 LEU CB C 40.81 0.02 1 416 725 168 LEU N N 128.03 0.15 1 417 726 169 LYS H H 8.4 0.02 1 418 726 169 LYS C C 175.68 0.02 1 419 726 169 LYS CA C 54.83 0.02 1 420 726 169 LYS N N 127.97 0.17 1 421 727 170 LEU H H 8.14 0.02 1 422 727 170 LEU C C 176.81 0.02 1 423 727 170 LEU CA C 53.22 0.22 1 424 727 170 LEU N N 129.43 0.02 1 425 728 171 SER H H 9.39 0.02 1 426 728 171 SER CA C 56.51 0.02 1 427 728 171 SER N N 120.89 0.07 1 428 731 174 GLU C C 178.63 0.02 1 429 732 175 LYS H H 8.76 0.03 1 430 732 175 LYS C C 178.61 0.02 1 431 732 175 LYS CA C 60.63 0.02 1 432 732 175 LYS N N 120.26 0.16 1 433 733 176 GLN C C 178.83 0.02 1 434 734 177 ARG H H 7.91 0.02 1 435 734 177 ARG CA C 59.29 0.02 1 436 734 177 ARG N N 120.07 0.02 1 437 735 178 VAL H H 8.3 0.02 1 438 735 178 VAL C C 177.18 0.02 1 439 735 178 VAL CA C 66.71 0.02 1 440 735 178 VAL N N 123.76 0.02 1 441 736 179 ALA H H 7.91 0.02 1 442 736 179 ALA CA C 55 0.02 1 443 736 179 ALA N N 124.1 0.03 1 444 737 180 ILE C C 176.59 0.02 1 445 738 181 ALA H H 8.73 0.02 1 446 738 181 ALA C C 178.47 0.02 1 447 738 181 ALA CA C 54.82 0.02 1 448 738 181 ALA N N 125.43 0.06 1 449 739 182 ARG H H 8.74 0.03 1 450 739 182 ARG CA C 58.89 0.02 1 451 739 182 ARG N N 117.87 0.13 1 452 743 186 LYS C C 175.36 0.02 1 453 744 187 ALA H H 8.27 0.02 1 454 744 187 ALA C C 173.5 0.02 1 455 744 187 ALA CA C 51.38 0.02 1 456 744 187 ALA N N 120.06 0.02 1 457 746 189 GLY C C 173.28 0.02 1 458 746 189 GLY CA C 44.9 0.02 1 459 747 190 ILE H H 7.97 0.02 1 460 747 190 ILE CA C 58.64 0.02 1 461 747 190 ILE N N 122.57 0.13 1 462 748 191 ILE H H 9.27 0.02 1 463 748 191 ILE C C 172.95 0.02 1 464 748 191 ILE CA C 57.68 0.02 1 465 748 191 ILE N N 129.57 0.02 1 466 749 192 LEU H H 8.87 0.02 1 467 749 192 LEU C C 174.39 0.02 1 468 749 192 LEU CA C 51.41 0.02 1 469 749 192 LEU N N 126.56 0.02 1 470 750 193 LEU H H 9.12 0.02 1 471 750 193 LEU CA C 52.46 0.02 1 472 750 193 LEU N N 126.26 0.02 1 473 766 209 GLN C C 178.48 0.02 1 474 767 210 ALA H H 8.05 0.02 1 475 767 210 ALA CA C 54.15 0.02 1 476 767 210 ALA N N 124.01 0.02 1 477 768 211 SER H H 7.97 0.02 1 478 768 211 SER CA C 61.32 0.02 1 479 768 211 SER N N 118.4 0.02 1 480 771 214 LYS C C 177.24 0.02 1 481 771 214 LYS CA C 56.8 0.02 1 482 772 215 VAL H H 8.16 0.02 1 483 772 215 VAL C C 177.11 0.02 1 484 772 215 VAL CA C 62.92 0.02 1 485 772 215 VAL CB C 31.02 0.02 1 486 772 215 VAL N N 123.88 0.14 1 487 774 217 ALA C C 177.58 0.02 1 488 775 218 ASN H H 9.08 0.02 1 489 775 218 ASN CA C 53.89 0.02 1 490 775 218 ASN N N 116.76 0.02 1 491 777 220 THR C C 172.68 0.02 1 492 777 220 THR CA C 63.14 0.02 1 493 778 221 THR H H 9.04 0.02 1 494 778 221 THR C C 173.23 0.02 1 495 778 221 THR CA C 61.13 0.02 1 496 778 221 THR N N 127.81 0.04 1 497 779 222 ILE H H 8.75 0.02 1 498 779 222 ILE CA C 59.13 0.02 1 499 779 222 ILE N N 126.17 0.17 1 500 780 223 VAL H H 9.22 0.02 1 501 780 223 VAL CA C 57.62 0.02 1 502 780 223 VAL N N 127.55 0.02 1 503 781 224 VAL CA C 60.83 0.02 1 504 782 225 ALA H H 8 0.02 1 505 782 225 ALA CA C 49.94 0.02 1 506 782 225 ALA N N 130.42 0.02 1 507 790 233 ASN C C 175.09 0.02 1 508 790 233 ASN CA C 51.67 0.02 1 509 791 234 ALA H H 7.93 0.02 1 510 791 234 ALA CA C 52.59 0.02 1 511 791 234 ALA N N 126.77 0.06 1 512 792 235 ASP C C 175.39 0.02 1 513 792 235 ASP CA C 56.79 0.02 1 514 793 236 GLN H H 7.59 0.02 1 515 793 236 GLN C C 171.14 0.02 1 516 793 236 GLN CA C 55.05 0.08 1 517 793 236 GLN CB C 31.72 0.02 1 518 793 236 GLN N N 116 0.06 1 519 794 237 ILE H H 8.67 0.02 1 520 794 237 ILE CA C 59.66 0.08 1 521 794 237 ILE CB C 37.7 0.02 1 522 794 237 ILE N N 128.86 0.22 1 523 795 238 LEU H H 9 0.02 1 524 795 238 LEU CA C 52.05 0.15 1 525 795 238 LEU N N 126.26 0.02 1 526 796 239 VAL H H 8.51 0.02 1 527 796 239 VAL C C 174.46 0.1 1 528 796 239 VAL CA C 59.51 0.04 1 529 796 239 VAL CB C 29.17 0.02 1 530 796 239 VAL N N 124.68 0.02 1 531 797 240 ILE H H 9.38 0.02 1 532 797 240 ILE CA C 57.23 0.02 1 533 797 240 ILE CB C 37.13 0.02 1 534 797 240 ILE N N 131.57 0.06 1 535 799 242 ASP H H 9.65 0.02 1 536 799 242 ASP CA C 54.96 0.02 1 537 799 242 ASP N N 129.62 0.02 1 538 800 243 GLY C C 172.04 0.02 1 539 801 244 CYS H H 7.62 0.02 1 540 801 244 CYS C C 173.79 0.14 1 541 801 244 CYS CA C 55.43 0.12 1 542 801 244 CYS CB C 30.39 0.02 1 543 801 244 CYS N N 116.59 0.07 1 544 802 245 ILE H H 9.17 0.02 1 545 802 245 ILE C C 176.96 0.02 1 546 802 245 ILE CA C 60.25 0.09 1 547 802 245 ILE N N 124.05 0.09 1 548 803 246 VAL H H 9.18 0.02 1 549 803 246 VAL C C 175.88 0.02 1 550 803 246 VAL CA C 61.45 0.17 1 551 803 246 VAL N N 126.19 0.2 1 552 804 247 GLU H H 7.64 0.03 1 553 804 247 GLU C C 173.12 0.12 1 554 804 247 GLU CA C 54.66 0.11 1 555 804 247 GLU CB C 33.52 0.02 1 556 804 247 GLU N N 120.9 0.35 1 557 805 248 ARG H H 8.49 0.02 1 558 805 248 ARG C C 174.22 0.03 1 559 805 248 ARG CA C 53.48 0.04 1 560 805 248 ARG CB C 33.23 0.02 1 561 805 248 ARG N N 118.57 0.06 1 562 806 249 GLY H H 8.69 0.02 1 563 806 249 GLY C C 171.1 0.09 1 564 806 249 GLY CA C 44.21 0.08 1 565 806 249 GLY N N 111.29 0.19 1 566 807 250 ARG H H 8.04 0.02 1 567 807 250 ARG C C 175.76 0.02 1 568 807 250 ARG CA C 54.91 0.02 1 569 807 250 ARG CB C 30.3 0.02 1 570 807 250 ARG N N 120.46 0.15 1 571 808 251 HIS H H 8.84 0.02 1 572 808 251 HIS C C 175.33 0.02 1 573 808 251 HIS CA C 59.99 0.34 1 574 808 251 HIS N N 123.14 0.02 1 575 809 252 GLU H H 9.06 0.02 1 576 809 252 GLU C C 178.85 0.07 1 577 809 252 GLU CA C 59.29 0.07 1 578 809 252 GLU CB C 26.8 0.02 1 579 809 252 GLU N N 116.98 0.05 1 580 810 253 ALA H H 7.05 0.02 1 581 810 253 ALA C C 180.47 0.02 1 582 810 253 ALA CA C 53.31 0.02 1 583 810 253 ALA CB C 17.16 0.02 1 584 810 253 ALA N N 124.2 0.25 1 585 811 254 LEU H H 8.24 0.02 1 586 811 254 LEU C C 180.5 0.02 1 587 811 254 LEU CA C 56.71 0.02 1 588 811 254 LEU N N 122.31 0.02 1 589 812 255 LEU H H 8.32 0.02 1 590 812 255 LEU C C 180 0.04 1 591 812 255 LEU CA C 57.05 0.1 1 592 812 255 LEU CB C 39.79 0.02 1 593 812 255 LEU N N 122.36 0.15 1 594 813 256 SER H H 7.64 0.02 1 595 813 256 SER C C 175.09 0.04 1 596 813 256 SER CA C 60 0.15 1 597 813 256 SER CB C 62.41 0.02 1 598 813 256 SER N N 116.6 0.13 1 599 814 257 ARG H H 7.48 0.02 1 600 814 257 ARG C C 178.33 0.17 1 601 814 257 ARG CA C 56.52 0.03 1 602 814 257 ARG CB C 29.46 0.02 1 603 814 257 ARG N N 121.34 0.07 1 604 815 258 GLY H H 7.38 0.02 1 605 815 258 GLY C C 173.71 0.09 1 606 815 258 GLY CA C 46.18 0.06 1 607 815 258 GLY N N 106.11 0.02 1 608 816 259 GLY H H 8.5 0.02 1 609 816 259 GLY C C 173.47 0.02 1 610 816 259 GLY CA C 43.4 0.02 1 611 816 259 GLY N N 113.43 0.17 1 612 817 260 VAL H H 9.77 0.02 1 613 817 260 VAL N N 129.44 0.02 1 614 818 261 TYR H H 9.39 0.02 1 615 818 261 TYR CA C 61.57 0.02 1 616 818 261 TYR N N 124.37 0.02 1 617 819 262 ALA C C 179.71 0.02 1 618 819 262 ALA CA C 54.21 0.02 1 619 820 263 ASP H H 8.32 0.02 1 620 820 263 ASP C C 178.78 0.02 1 621 820 263 ASP CA C 56.56 0.02 1 622 820 263 ASP N N 121.34 0.02 1 623 821 264 MET H H 8.17 0.02 1 624 821 264 MET CA C 58.96 0.02 1 625 821 264 MET N N 122.92 0.02 1 626 822 265 TRP C C 177.97 0.02 1 627 823 266 GLN H H 8.25 0.02 1 628 823 266 GLN C C 178.73 0.02 1 629 823 266 GLN CA C 57.72 0.02 1 630 823 266 GLN N N 119.68 0.03 1 631 824 267 LEU H H 7.74 0.02 1 632 824 267 LEU CA C 56.62 0.02 1 633 824 267 LEU N N 121.86 0.12 1 634 825 268 GLN H H 7.8 0.02 1 635 825 268 GLN C C 177.33 0.02 1 636 825 268 GLN CA C 56.91 0.05 1 637 825 268 GLN N N 118.83 0.02 1 638 826 269 GLN H H 7.95 0.02 1 639 826 269 GLN C C 177.11 0.07 1 640 826 269 GLN CA C 55.54 0.04 1 641 826 269 GLN CB C 27.49 0.02 1 642 826 269 GLN N N 120.23 0.15 1 643 827 270 GLY H H 7.91 0.02 1 644 827 270 GLY C C 174.07 0.08 1 645 827 270 GLY CA C 44.74 0.13 1 646 827 270 GLY N N 109.64 0.03 1 647 828 271 GLN H H 7.96 0.02 1 648 828 271 GLN C C 175.87 0.06 1 649 828 271 GLN CA C 54.89 0.02 1 650 828 271 GLN CB C 28.13 0.02 1 651 828 271 GLN N N 121.32 0.03 1 652 829 272 GLU H H 8.36 0.02 1 653 829 272 GLU C C 176.29 0.02 1 654 829 272 GLU CA C 55.79 0.05 1 655 829 272 GLU CB C 28.75 0.02 1 656 829 272 GLU N N 123.81 0.03 1 657 830 273 GLU H H 8.55 0.02 1 658 830 273 GLU C C 176.37 0.05 1 659 830 273 GLU CA C 55.7 0.02 1 660 830 273 GLU CB C 28.98 0.02 1 661 830 273 GLU N N 124.41 0.06 1 662 831 274 THR H H 8.4 0.02 1 663 831 274 THR C C 174.2 0.02 1 664 831 274 THR CA C 60.77 0.12 1 665 831 274 THR CB C 69.01 0.08 1 666 831 274 THR N N 117.91 0.07 1 667 832 275 SER H H 8.53 0.02 1 668 832 275 SER C C 174.37 0.03 1 669 832 275 SER CA C 57.52 0.02 1 670 832 275 SER CB C 63.13 0.02 1 671 832 275 SER N N 120.73 0.02 1 672 833 276 GLU H H 8.66 0.02 1 673 833 276 GLU C C 175.99 0.02 1 674 833 276 GLU CA C 55.82 0.17 1 675 833 276 GLU CB C 28.94 0.09 1 676 833 276 GLU N N 125.21 0.06 1 677 834 277 ASP H H 8.48 0.02 1 678 834 277 ASP C C 176.07 0.05 1 679 834 277 ASP CA C 53.67 0.02 1 680 834 277 ASP CB C 39.95 0.02 1 681 834 277 ASP N N 123.28 0.02 1 682 835 278 THR H H 8.15 0.02 1 683 835 278 THR C C 174.12 0.02 1 684 835 278 THR CA C 60.98 0.05 1 685 835 278 THR CB C 68.67 0.02 1 686 835 278 THR N N 116.89 0.03 1 687 836 279 LYS H H 8.39 0.02 1 688 836 279 LYS CA C 53.6 0.02 1 689 836 279 LYS CB C 30.86 0.02 1 690 836 279 LYS N N 127.76 0.03 1 691 837 280 PRO C C 176.65 0.02 1 692 837 280 PRO CA C 62.16 0.02 1 693 837 280 PRO CB C 30.88 0.02 1 694 838 281 GLN H H 8.73 0.02 1 695 838 281 GLN C C 175.93 0.04 1 696 838 281 GLN CA C 54.87 0.03 1 697 838 281 GLN CB C 28.2 0.05 1 698 838 281 GLN N N 123.48 0.02 1 699 839 282 THR H H 8.38 0.02 1 700 839 282 THR C C 173.94 0.04 1 701 839 282 THR CA C 60.98 0.06 1 702 839 282 THR CB C 68.82 0.09 1 703 839 282 THR N N 118.49 0.06 1 704 840 283 MET H H 8.56 0.02 1 705 840 283 MET C C 175.66 0.02 1 706 840 283 MET CA C 54.36 0.04 1 707 840 283 MET N N 125.24 0.04 1 708 841 284 GLU H H 8.56 0.02 1 709 841 284 GLU C C 175.13 0.02 1 710 841 284 GLU CA C 55.73 0.03 1 711 841 284 GLU CB C 31.71 0.02 1 712 841 284 GLU N N 125.31 0.06 1 713 842 285 ARG H H 8.14 0.02 1 714 842 285 ARG C C 180.68 0.02 1 715 842 285 ARG CA C 56.5 0.02 1 716 842 285 ARG CB C 29.9 0.02 1 717 842 285 ARG N N 129.59 0.02 1 stop_ save_