################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7296 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 NOESY 1 $sample_1 isotropic 7296 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 1 $software_1 . . 7296 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLN HA H 1 4.406 0.03 . 1 . . . . 1 GLN HA . 7296 1 2 . 1 1 1 1 GLN HB2 H 1 1.448 0.03 . 1 . . . . 1 GLN HB1 . 7296 1 3 . 1 1 1 1 GLN HB3 H 1 1.448 0.03 . 1 . . . . 1 GLN HB2 . 7296 1 4 . 1 1 2 2 ASP H H 1 8.184 0.03 . 1 . . . . 2 ASP HN . 7296 1 5 . 1 1 2 2 ASP HA H 1 4.668 0.03 . 1 . . . . 2 ASP HA . 7296 1 6 . 1 1 2 2 ASP HB2 H 1 2.773 0.03 . 1 . . . . 2 ASP HB1 . 7296 1 7 . 1 1 2 2 ASP HB3 H 1 2.773 0.03 . 1 . . . . 2 ASP HB2 . 7296 1 8 . 1 1 3 3 GLY H H 1 8.988 0.03 . 1 . . . . 3 GLY HN . 7296 1 9 . 1 1 3 3 GLY HA2 H 1 3.365 0.03 . 1 . . . . 3 GLY HA1 . 7296 1 10 . 1 1 3 3 GLY HA3 H 1 3.365 0.03 . 1 . . . . 3 GLY HA2 . 7296 1 11 . 1 1 4 4 GLU H H 1 7.42 0.03 . 1 . . . . 4 GLU HN . 7296 1 12 . 1 1 4 4 GLU HA H 1 2.632 0.03 . 1 . . . . 4 GLU HA . 7296 1 13 . 1 1 4 4 GLU HB2 H 1 1.85 0.03 . 1 . . . . 4 GLU HB1 . 7296 1 14 . 1 1 4 4 GLU HB3 H 1 1.85 0.03 . 1 . . . . 4 GLU HB2 . 7296 1 15 . 1 1 4 4 GLU HG2 H 1 2.157 0.03 . 1 . . . . 4 GLU HG1 . 7296 1 16 . 1 1 4 4 GLU HG3 H 1 2.157 0.03 . 1 . . . . 4 GLU HG2 . 7296 1 17 . 1 1 5 5 ALA H H 1 7.523 0.03 . 1 . . . . 5 ALA HN . 7296 1 18 . 1 1 5 5 ALA HA H 1 3.998 0.03 . 1 . . . . 5 ALA HA . 7296 1 19 . 1 1 5 5 ALA HB1 H 1 1.44 0.03 . 1 . . . . 5 ALA HB1 . 7296 1 20 . 1 1 5 5 ALA HB2 H 1 1.44 0.03 . 1 . . . . 5 ALA HB1 . 7296 1 21 . 1 1 5 5 ALA HB3 H 1 1.44 0.03 . 1 . . . . 5 ALA HB1 . 7296 1 22 . 1 1 6 6 LEU H H 1 7.902 0.03 . 1 . . . . 6 LEU HN . 7296 1 23 . 1 1 6 6 LEU HA H 1 4.187 0.03 . 1 . . . . 6 LEU HA . 7296 1 24 . 1 1 6 6 LEU HB2 H 1 1.454 0.03 . 2 . . . . 6 LEU HB1 . 7296 1 25 . 1 1 6 6 LEU HB3 H 1 1.92 0.03 . 2 . . . . 6 LEU HB2 . 7296 1 26 . 1 1 6 6 LEU HG H 1 1.718 0.03 . 1 . . . . 6 LEU HG . 7296 1 27 . 1 1 6 6 LEU HD11 H 1 0.977 0.03 . 1 . . . . 6 LEU HD11 . 7296 1 28 . 1 1 6 6 LEU HD12 H 1 0.977 0.03 . 1 . . . . 6 LEU HD11 . 7296 1 29 . 1 1 6 6 LEU HD13 H 1 0.977 0.03 . 1 . . . . 6 LEU HD11 . 7296 1 30 . 1 1 6 6 LEU HD21 H 1 0.977 0.03 . 1 . . . . 6 LEU HD21 . 7296 1 31 . 1 1 6 6 LEU HD22 H 1 0.977 0.03 . 1 . . . . 6 LEU HD21 . 7296 1 32 . 1 1 6 6 LEU HD23 H 1 0.977 0.03 . 1 . . . . 6 LEU HD21 . 7296 1 33 . 1 1 7 7 PHE H H 1 8.361 0.03 . 1 . . . . 7 PHE HN . 7296 1 34 . 1 1 7 7 PHE HA H 1 4.07 0.03 . 1 . . . . 7 PHE HA . 7296 1 35 . 1 1 7 7 PHE HB2 H 1 2.669 0.03 . 2 . . . . 7 PHE HB1 . 7296 1 36 . 1 1 7 7 PHE HB3 H 1 2.776 0.03 . 2 . . . . 7 PHE HB2 . 7296 1 37 . 1 1 7 7 PHE HD1 H 1 7.035 0.03 . 1 . . . . 7 PHE HD1 . 7296 1 38 . 1 1 7 7 PHE HD2 H 1 7.035 0.03 . 1 . . . . 7 PHE HD2 . 7296 1 39 . 1 1 7 7 PHE HE1 H 1 6.689 0.03 . 1 . . . . 7 PHE HE1 . 7296 1 40 . 1 1 7 7 PHE HE2 H 1 6.689 0.03 . 1 . . . . 7 PHE HE2 . 7296 1 41 . 1 1 7 7 PHE HZ H 1 6.611 0.03 . 1 . . . . 7 PHE HZ . 7296 1 42 . 1 1 8 8 LYS H H 1 7.657 0.03 . 1 . . . . 8 LYS HN . 7296 1 43 . 1 1 8 8 LYS HA H 1 3.883 0.03 . 1 . . . . 8 LYS HA . 7296 1 44 . 1 1 8 8 LYS HB2 H 1 1.859 0.03 . 1 . . . . 8 LYS HB1 . 7296 1 45 . 1 1 8 8 LYS HB3 H 1 1.859 0.03 . 1 . . . . 8 LYS HB2 . 7296 1 46 . 1 1 8 8 LYS HG2 H 1 1.83 0.03 . 1 . . . . 8 LYS HG1 . 7296 1 47 . 1 1 8 8 LYS HG3 H 1 1.83 0.03 . 1 . . . . 8 LYS HG2 . 7296 1 48 . 1 1 8 8 LYS HD2 H 1 1.8 0.03 . 1 . . . . 8 LYS HD1 . 7296 1 49 . 1 1 8 8 LYS HD3 H 1 1.8 0.03 . 1 . . . . 8 LYS HD2 . 7296 1 50 . 1 1 8 8 LYS HE2 H 1 2.997 0.03 . 1 . . . . 8 LYS HE1 . 7296 1 51 . 1 1 8 8 LYS HE3 H 1 2.997 0.03 . 1 . . . . 8 LYS HE2 . 7296 1 52 . 1 1 9 9 SER H H 1 7.85 0.03 . 1 . . . . 9 SER HN . 7296 1 53 . 1 1 9 9 SER HA H 1 4.57 0.03 . 1 . . . . 9 SER HA . 7296 1 54 . 1 1 9 9 SER HB2 H 1 4.158 0.03 . 2 . . . . 9 SER HB1 . 7296 1 55 . 1 1 9 9 SER HB3 H 1 3.99 0.03 . 2 . . . . 9 SER HB2 . 7296 1 56 . 1 1 10 10 LYS H H 1 7.61 0.03 . 1 . . . . 10 LYS HN . 7296 1 57 . 1 1 10 10 LYS HA H 1 5.107 0.03 . 1 . . . . 10 LYS HA . 7296 1 58 . 1 1 10 10 LYS HB2 H 1 2.696 0.03 . 2 . . . . 10 LYS HB1 . 7296 1 59 . 1 1 10 10 LYS HB3 H 1 2.22 0.03 . 2 . . . . 10 LYS HB2 . 7296 1 60 . 1 1 10 10 LYS HG2 H 1 1.965 0.03 . 4 . . . . 10 LYS HG1 . 7296 1 61 . 1 1 10 10 LYS HG3 H 1 1.965 0.03 . 4 . . . . 10 LYS HG2 . 7296 1 62 . 1 1 10 10 LYS HD2 H 1 1.43 0.03 . 4 . . . . 10 LYS HD1 . 7296 1 63 . 1 1 10 10 LYS HD3 H 1 1.634 0.03 . 4 . . . . 10 LYS HD2 . 7296 1 64 . 1 1 10 10 LYS HE2 H 1 2.96 0.03 . 1 . . . . 10 LYS HE1 . 7296 1 65 . 1 1 10 10 LYS HE3 H 1 2.96 0.03 . 1 . . . . 10 LYS HE2 . 7296 1 66 . 1 1 11 11 PRO HA H 1 4.877 0.03 . 1 . . . . 11 PRO HA . 7296 1 67 . 1 1 11 11 PRO HB2 H 1 2.904 0.03 . 2 . . . . 11 PRO HB1 . 7296 1 68 . 1 1 11 11 PRO HB3 H 1 2.656 0.03 . 2 . . . . 11 PRO HB2 . 7296 1 69 . 1 1 11 11 PRO HG2 H 1 2.308 0.03 . 1 . . . . 11 PRO HG1 . 7296 1 70 . 1 1 11 11 PRO HG3 H 1 2.308 0.03 . 1 . . . . 11 PRO HG2 . 7296 1 71 . 1 1 11 11 PRO HD2 H 1 4.214 0.03 . 2 . . . . 11 PRO HD1 . 7296 1 72 . 1 1 11 11 PRO HD3 H 1 3.924 0.03 . 2 . . . . 11 PRO HD2 . 7296 1 73 . 1 1 12 12 CYS H H 1 8.091 0.03 . 1 . . . . 12 CYS HN . 7296 1 74 . 1 1 12 12 CYS HA H 1 4.89 0.03 . 1 . . . . 12 CYS HA . 7296 1 75 . 1 1 12 12 CYS HB2 H 1 2.689 0.03 . 1 . . . . 12 CYS HB1 . 7296 1 76 . 1 1 12 12 CYS HB3 H 1 2.279 0.03 . 1 . . . . 12 CYS HB2 . 7296 1 77 . 1 1 13 13 ALA H H 1 8.025 0.03 . 1 . . . . 13 ALA HN . 7296 1 78 . 1 1 13 13 ALA HA H 1 4.175 0.03 . 1 . . . . 13 ALA HA . 7296 1 79 . 1 1 13 13 ALA HB1 H 1 1.132 0.03 . 1 . . . . 13 ALA HB1 . 7296 1 80 . 1 1 13 13 ALA HB2 H 1 1.132 0.03 . 1 . . . . 13 ALA HB1 . 7296 1 81 . 1 1 13 13 ALA HB3 H 1 1.132 0.03 . 1 . . . . 13 ALA HB1 . 7296 1 82 . 1 1 14 14 ALA H H 1 7.903 0.03 . 1 . . . . 14 ALA HN . 7296 1 83 . 1 1 14 14 ALA HA H 1 4.187 0.03 . 1 . . . . 14 ALA HA . 7296 1 84 . 1 1 14 14 ALA HB1 H 1 1.718 0.03 . 1 . . . . 14 ALA HB1 . 7296 1 85 . 1 1 14 14 ALA HB2 H 1 1.718 0.03 . 1 . . . . 14 ALA HB1 . 7296 1 86 . 1 1 14 14 ALA HB3 H 1 1.718 0.03 . 1 . . . . 14 ALA HB1 . 7296 1 87 . 1 1 15 15 CYS H H 1 6.906 0.03 . 1 . . . . 15 CYS HN . 7296 1 88 . 1 1 15 15 CYS HA H 1 4.393 0.03 . 1 . . . . 15 CYS HA . 7296 1 89 . 1 1 15 15 CYS HB2 H 1 1.074 0.03 . 1 . . . . 15 CYS HB1 . 7296 1 90 . 1 1 15 15 CYS HB3 H 1 1.891 0.03 . 1 . . . . 15 CYS HB2 . 7296 1 91 . 1 1 16 16 HIS H H 1 7.017 0.03 . 1 . . . . 16 HIS HN . 7296 1 92 . 1 1 16 16 HIS HA H 1 4.147 0.03 . 1 . . . . 16 HIS HA . 7296 1 93 . 1 1 16 16 HIS HB2 H 1 1.182 0.03 . 1 . . . . 16 HIS HB1 . 7296 1 94 . 1 1 16 16 HIS HB3 H 1 1.182 0.03 . 1 . . . . 16 HIS HB2 . 7296 1 95 . 1 1 16 16 HIS HD1 H 1 8.714 0.03 . 1 . . . . 16 HIS HD1 . 7296 1 96 . 1 1 16 16 HIS HD2 H 1 0.643 0.03 . 1 . . . . 16 HIS HD2 . 7296 1 97 . 1 1 16 16 HIS HE1 H 1 0.79 0.03 . 1 . . . . 16 HIS HE1 . 7296 1 98 . 1 1 17 17 SER H H 1 8.176 0.03 . 1 . . . . 17 SER HN . 7296 1 99 . 1 1 17 17 SER HA H 1 4.482 0.03 . 1 . . . . 17 SER HA . 7296 1 100 . 1 1 17 17 SER HB2 H 1 3.781 0.03 . 1 . . . . 17 SER HB1 . 7296 1 101 . 1 1 17 17 SER HB3 H 1 3.781 0.03 . 1 . . . . 17 SER HB2 . 7296 1 102 . 1 1 18 18 VAL H H 1 8.71 0.03 . 1 . . . . 18 VAL HN . 7296 1 103 . 1 1 18 18 VAL HA H 1 3.184 0.03 . 1 . . . . 18 VAL HA . 7296 1 104 . 1 1 18 18 VAL HB H 1 1.854 0.03 . 1 . . . . 18 VAL HB . 7296 1 105 . 1 1 18 18 VAL HG11 H 1 0.737 0.03 . 2 . . . . 18 VAL HG11 . 7296 1 106 . 1 1 18 18 VAL HG12 H 1 0.737 0.03 . 2 . . . . 18 VAL HG11 . 7296 1 107 . 1 1 18 18 VAL HG13 H 1 0.737 0.03 . 2 . . . . 18 VAL HG11 . 7296 1 108 . 1 1 18 18 VAL HG21 H 1 0.795 0.03 . 2 . . . . 18 VAL HG21 . 7296 1 109 . 1 1 18 18 VAL HG22 H 1 0.795 0.03 . 2 . . . . 18 VAL HG21 . 7296 1 110 . 1 1 18 18 VAL HG23 H 1 0.795 0.03 . 2 . . . . 18 VAL HG21 . 7296 1 111 . 1 1 19 19 ASP H H 1 7.874 0.03 . 1 . . . . 19 ASP HN . 7296 1 112 . 1 1 19 19 ASP HA H 1 4.579 0.03 . 1 . . . . 19 ASP HA . 7296 1 113 . 1 1 19 19 ASP HB2 H 1 2.491 0.03 . 1 . . . . 19 ASP HB1 . 7296 1 114 . 1 1 19 19 ASP HB3 H 1 2.491 0.03 . 1 . . . . 19 ASP HB2 . 7296 1 115 . 1 1 20 20 THR H H 1 7.381 0.03 . 1 . . . . 20 THR HN . 7296 1 116 . 1 1 20 20 THR HA H 1 4.446 0.03 . 1 . . . . 20 THR HA . 7296 1 117 . 1 1 20 20 THR HB H 1 3.81 0.03 . 1 . . . . 20 THR HB . 7296 1 118 . 1 1 20 20 THR HG21 H 1 1.042 0.03 . 1 . . . . 20 THR HG21 . 7296 1 119 . 1 1 20 20 THR HG22 H 1 1.042 0.03 . 1 . . . . 20 THR HG21 . 7296 1 120 . 1 1 20 20 THR HG23 H 1 1.042 0.03 . 1 . . . . 20 THR HG21 . 7296 1 121 . 1 1 21 21 LYS H H 1 8.732 0.03 . 1 . . . . 21 LYS HN . 7296 1 122 . 1 1 21 21 LYS HA H 1 3.568 0.03 . 1 . . . . 21 LYS HA . 7296 1 123 . 1 1 21 21 LYS HB2 H 1 1.631 0.03 . 2 . . . . 21 LYS HB1 . 7296 1 124 . 1 1 21 21 LYS HB3 H 1 1.808 0.03 . 2 . . . . 21 LYS HB2 . 7296 1 125 . 1 1 21 21 LYS HG2 H 1 1.154 0.03 . 4 . . . . 21 LYS HG1 . 7296 1 126 . 1 1 21 21 LYS HG3 H 1 1.154 0.03 . 4 . . . . 21 LYS HG2 . 7296 1 127 . 1 1 21 21 LYS HD2 H 1 1.631 0.03 . 4 . . . . 21 LYS HD1 . 7296 1 128 . 1 1 21 21 LYS HD3 H 1 1.631 0.03 . 4 . . . . 21 LYS HD2 . 7296 1 129 . 1 1 21 21 LYS HE2 H 1 2.884 0.03 . 1 . . . . 21 LYS HE1 . 7296 1 130 . 1 1 21 21 LYS HE3 H 1 2.884 0.03 . 1 . . . . 21 LYS HE2 . 7296 1 131 . 1 1 22 22 MET H H 1 7.345 0.03 . 1 . . . . 22 MET HN . 7296 1 132 . 1 1 22 22 MET HA H 1 4.394 0.03 . 1 . . . . 22 MET HA . 7296 1 133 . 1 1 22 22 MET HB2 H 1 1.732 0.03 . 2 . . . . 22 MET HB1 . 7296 1 134 . 1 1 22 22 MET HB3 H 1 1.386 0.03 . 2 . . . . 22 MET HB2 . 7296 1 135 . 1 1 22 22 MET HG2 H 1 2.038 0.03 . 1 . . . . 22 MET HG1 . 7296 1 136 . 1 1 22 22 MET HG3 H 1 2.038 0.03 . 1 . . . . 22 MET HG2 . 7296 1 137 . 1 1 23 23 VAL H H 1 7.091 0.03 . 1 . . . . 23 VAL HN . 7296 1 138 . 1 1 23 23 VAL HA H 1 3.967 0.03 . 1 . . . . 23 VAL HA . 7296 1 139 . 1 1 23 23 VAL HB H 1 1.935 0.03 . 1 . . . . 23 VAL HB . 7296 1 140 . 1 1 23 23 VAL HG11 H 1 1.222 0.03 . 2 . . . . 23 VAL HG11 . 7296 1 141 . 1 1 23 23 VAL HG12 H 1 1.222 0.03 . 2 . . . . 23 VAL HG11 . 7296 1 142 . 1 1 23 23 VAL HG13 H 1 1.222 0.03 . 2 . . . . 23 VAL HG11 . 7296 1 143 . 1 1 23 23 VAL HG21 H 1 1.654 0.03 . 2 . . . . 23 VAL HG21 . 7296 1 144 . 1 1 23 23 VAL HG22 H 1 1.654 0.03 . 2 . . . . 23 VAL HG21 . 7296 1 145 . 1 1 23 23 VAL HG23 H 1 1.654 0.03 . 2 . . . . 23 VAL HG21 . 7296 1 146 . 1 1 24 24 GLY H H 1 6.595 0.03 . 1 . . . . 24 GLY HN . 7296 1 147 . 1 1 24 24 GLY HA2 H 1 3.773 0.03 . 2 . . . . 24 GLY HA1 . 7296 1 148 . 1 1 24 24 GLY HA3 H 1 0.191 0.03 . 2 . . . . 24 GLY HA2 . 7296 1 149 . 1 1 25 25 PRO HA H 1 3.598 0.03 . 1 . . . . 25 PRO HA . 7296 1 150 . 1 1 25 25 PRO HB2 H 1 0.975 0.03 . 2 . . . . 25 PRO HB1 . 7296 1 151 . 1 1 25 25 PRO HB3 H 1 0.48 0.03 . 2 . . . . 25 PRO HB2 . 7296 1 152 . 1 1 25 25 PRO HG2 H 1 -0.065 0.03 . 2 . . . . 25 PRO HG1 . 7296 1 153 . 1 1 25 25 PRO HG3 H 1 0.112 0.03 . 2 . . . . 25 PRO HG2 . 7296 1 154 . 1 1 25 25 PRO HD2 H 1 2.906 0.03 . 2 . . . . 25 PRO HD1 . 7296 1 155 . 1 1 25 25 PRO HD3 H 1 2.048 0.03 . 2 . . . . 25 PRO HD2 . 7296 1 156 . 1 1 26 26 ALA H H 1 8.453 0.03 . 1 . . . . 26 ALA HN . 7296 1 157 . 1 1 26 26 ALA HA H 1 3.85 0.03 . 1 . . . . 26 ALA HA . 7296 1 158 . 1 1 26 26 ALA HB1 H 1 0.729 0.03 . 1 . . . . 26 ALA HB1 . 7296 1 159 . 1 1 26 26 ALA HB2 H 1 0.729 0.03 . 1 . . . . 26 ALA HB1 . 7296 1 160 . 1 1 26 26 ALA HB3 H 1 0.729 0.03 . 1 . . . . 26 ALA HB1 . 7296 1 161 . 1 1 27 27 LEU H H 1 8.027 0.03 . 1 . . . . 27 LEU HN . 7296 1 162 . 1 1 27 27 LEU HA H 1 3.356 0.03 . 1 . . . . 27 LEU HA . 7296 1 163 . 1 1 27 27 LEU HB2 H 1 0.87 0.03 . 2 . . . . 27 LEU HB1 . 7296 1 164 . 1 1 27 27 LEU HB3 H 1 1.061 0.03 . 2 . . . . 27 LEU HB2 . 7296 1 165 . 1 1 27 27 LEU HG H 1 0.494 0.03 . 1 . . . . 27 LEU HG . 7296 1 166 . 1 1 27 27 LEU HD11 H 1 -0.819 0.03 . 2 . . . . 27 LEU HD11 . 7296 1 167 . 1 1 27 27 LEU HD12 H 1 -0.819 0.03 . 2 . . . . 27 LEU HD11 . 7296 1 168 . 1 1 27 27 LEU HD13 H 1 -0.819 0.03 . 2 . . . . 27 LEU HD11 . 7296 1 169 . 1 1 27 27 LEU HD21 H 1 -0.05 0.03 . 2 . . . . 27 LEU HD21 . 7296 1 170 . 1 1 27 27 LEU HD22 H 1 -0.05 0.03 . 2 . . . . 27 LEU HD21 . 7296 1 171 . 1 1 27 27 LEU HD23 H 1 -0.05 0.03 . 2 . . . . 27 LEU HD21 . 7296 1 172 . 1 1 28 28 LYS H H 1 8.811 0.03 . 1 . . . . 28 LYS HN . 7296 1 173 . 1 1 28 28 LYS HA H 1 3.81 0.03 . 1 . . . . 28 LYS HA . 7296 1 174 . 1 1 28 28 LYS HB2 H 1 1.683 0.03 . 1 . . . . 28 LYS HB1 . 7296 1 175 . 1 1 28 28 LYS HB3 H 1 1.683 0.03 . 1 . . . . 28 LYS HB2 . 7296 1 176 . 1 1 28 28 LYS HG2 H 1 1.25 0.03 . 4 . . . . 28 LYS HG1 . 7296 1 177 . 1 1 28 28 LYS HG3 H 1 1.25 0.03 . 4 . . . . 28 LYS HG2 . 7296 1 178 . 1 1 28 28 LYS HD2 H 1 1.545 0.03 . 4 . . . . 28 LYS HD1 . 7296 1 179 . 1 1 28 28 LYS HD3 H 1 1.545 0.03 . 4 . . . . 28 LYS HD2 . 7296 1 180 . 1 1 28 28 LYS HE2 H 1 2.744 0.03 . 2 . . . . 28 LYS HE1 . 7296 1 181 . 1 1 28 28 LYS HE3 H 1 2.83 0.03 . 2 . . . . 28 LYS HE2 . 7296 1 182 . 1 1 29 29 GLU H H 1 6.974 0.03 . 1 . . . . 29 GLU HN . 7296 1 183 . 1 1 29 29 GLU HA H 1 4.26 0.03 . 1 . . . . 29 GLU HA . 7296 1 184 . 1 1 29 29 GLU HB2 H 1 2.322 0.03 . 1 . . . . 29 GLU HB1 . 7296 1 185 . 1 1 29 29 GLU HB3 H 1 2.322 0.03 . 1 . . . . 29 GLU HB2 . 7296 1 186 . 1 1 29 29 GLU HG2 H 1 2.064 0.03 . 1 . . . . 29 GLU HG1 . 7296 1 187 . 1 1 29 29 GLU HG3 H 1 2.064 0.03 . 1 . . . . 29 GLU HG2 . 7296 1 188 . 1 1 30 30 VAL H H 1 7.211 0.03 . 1 . . . . 30 VAL HN . 7296 1 189 . 1 1 30 30 VAL HA H 1 3.968 0.03 . 1 . . . . 30 VAL HA . 7296 1 190 . 1 1 30 30 VAL HB H 1 2.267 0.03 . 1 . . . . 30 VAL HB . 7296 1 191 . 1 1 30 30 VAL HG11 H 1 1.507 0.03 . 2 . . . . 30 VAL HG11 . 7296 1 192 . 1 1 30 30 VAL HG12 H 1 1.507 0.03 . 2 . . . . 30 VAL HG11 . 7296 1 193 . 1 1 30 30 VAL HG13 H 1 1.507 0.03 . 2 . . . . 30 VAL HG11 . 7296 1 194 . 1 1 30 30 VAL HG21 H 1 0.597 0.03 . 2 . . . . 30 VAL HG21 . 7296 1 195 . 1 1 30 30 VAL HG22 H 1 0.597 0.03 . 2 . . . . 30 VAL HG21 . 7296 1 196 . 1 1 30 30 VAL HG23 H 1 0.597 0.03 . 2 . . . . 30 VAL HG21 . 7296 1 197 . 1 1 31 31 ALA H H 1 8.033 0.03 . 1 . . . . 31 ALA HN . 7296 1 198 . 1 1 31 31 ALA HA H 1 3.885 0.03 . 1 . . . . 31 ALA HA . 7296 1 199 . 1 1 31 31 ALA HB1 H 1 1.632 0.03 . 1 . . . . 31 ALA HB1 . 7296 1 200 . 1 1 31 31 ALA HB2 H 1 1.632 0.03 . 1 . . . . 31 ALA HB1 . 7296 1 201 . 1 1 31 31 ALA HB3 H 1 1.632 0.03 . 1 . . . . 31 ALA HB1 . 7296 1 202 . 1 1 32 32 ALA H H 1 7.87 0.03 . 1 . . . . 32 ALA HN . 7296 1 203 . 1 1 32 32 ALA HA H 1 4.18 0.03 . 1 . . . . 32 ALA HA . 7296 1 204 . 1 1 32 32 ALA HB1 H 1 1.56 0.03 . 1 . . . . 32 ALA HB1 . 7296 1 205 . 1 1 32 32 ALA HB2 H 1 1.56 0.03 . 1 . . . . 32 ALA HB1 . 7296 1 206 . 1 1 32 32 ALA HB3 H 1 1.56 0.03 . 1 . . . . 32 ALA HB1 . 7296 1 207 . 1 1 33 33 LYS H H 1 7.996 0.03 . 1 . . . . 33 LYS HN . 7296 1 208 . 1 1 33 33 LYS HA H 1 4.223 0.03 . 1 . . . . 33 LYS HA . 7296 1 209 . 1 1 33 33 LYS HB2 H 1 2.342 0.03 . 2 . . . . 33 LYS HB1 . 7296 1 210 . 1 1 33 33 LYS HB3 H 1 2.12 0.03 . 2 . . . . 33 LYS HB2 . 7296 1 211 . 1 1 33 33 LYS HG2 H 1 1.435 0.03 . 4 . . . . 33 LYS HG1 . 7296 1 212 . 1 1 33 33 LYS HG3 H 1 1.435 0.03 . 4 . . . . 33 LYS HG2 . 7296 1 213 . 1 1 33 33 LYS HD2 H 1 1.67 0.03 . 4 . . . . 33 LYS HD1 . 7296 1 214 . 1 1 33 33 LYS HD3 H 1 1.67 0.03 . 4 . . . . 33 LYS HD2 . 7296 1 215 . 1 1 33 33 LYS HE2 H 1 2.877 0.03 . 1 . . . . 33 LYS HE1 . 7296 1 216 . 1 1 33 33 LYS HE3 H 1 2.877 0.03 . 1 . . . . 33 LYS HE2 . 7296 1 217 . 1 1 34 34 ASN H H 1 7.433 0.03 . 1 . . . . 34 ASN HN . 7296 1 218 . 1 1 34 34 ASN HA H 1 4.825 0.03 . 1 . . . . 34 ASN HA . 7296 1 219 . 1 1 34 34 ASN HB2 H 1 2.486 0.03 . 2 . . . . 34 ASN HB1 . 7296 1 220 . 1 1 34 34 ASN HB3 H 1 2.883 0.03 . 2 . . . . 34 ASN HB2 . 7296 1 221 . 1 1 34 34 ASN HD21 H 1 7.857 0.03 . 2 . . . . 34 ASN HD21 . 7296 1 222 . 1 1 34 34 ASN HD22 H 1 8.777 0.03 . 2 . . . . 34 ASN HD22 . 7296 1 223 . 1 1 35 35 ALA H H 1 7.528 0.03 . 1 . . . . 35 ALA HN . 7296 1 224 . 1 1 35 35 ALA HA H 1 4.259 0.03 . 1 . . . . 35 ALA HA . 7296 1 225 . 1 1 35 35 ALA HB1 H 1 1.519 0.03 . 1 . . . . 35 ALA HB1 . 7296 1 226 . 1 1 35 35 ALA HB2 H 1 1.519 0.03 . 1 . . . . 35 ALA HB1 . 7296 1 227 . 1 1 35 35 ALA HB3 H 1 1.519 0.03 . 1 . . . . 35 ALA HB1 . 7296 1 228 . 1 1 36 36 GLY H H 1 8.918 0.03 . 1 . . . . 36 GLY HN . 7296 1 229 . 1 1 36 36 GLY HA2 H 1 4.054 0.03 . 2 . . . . 36 GLY HA1 . 7296 1 230 . 1 1 36 36 GLY HA3 H 1 3.941 0.03 . 2 . . . . 36 GLY HA2 . 7296 1 231 . 1 1 37 37 VAL H H 1 7.63 0.03 . 1 . . . . 37 VAL HN . 7296 1 232 . 1 1 37 37 VAL HA H 1 4.043 0.03 . 1 . . . . 37 VAL HA . 7296 1 233 . 1 1 37 37 VAL HB H 1 2.315 0.03 . 1 . . . . 37 VAL HB . 7296 1 234 . 1 1 37 37 VAL HG11 H 1 1.013 0.03 . 1 . . . . 37 VAL HG11 . 7296 1 235 . 1 1 37 37 VAL HG12 H 1 1.013 0.03 . 1 . . . . 37 VAL HG11 . 7296 1 236 . 1 1 37 37 VAL HG13 H 1 1.013 0.03 . 1 . . . . 37 VAL HG11 . 7296 1 237 . 1 1 37 37 VAL HG21 H 1 1.013 0.03 . 1 . . . . 37 VAL HG21 . 7296 1 238 . 1 1 37 37 VAL HG22 H 1 1.013 0.03 . 1 . . . . 37 VAL HG21 . 7296 1 239 . 1 1 37 37 VAL HG23 H 1 1.013 0.03 . 1 . . . . 37 VAL HG21 . 7296 1 240 . 1 1 38 38 GLU H H 1 9.031 0.03 . 1 . . . . 38 GLU HN . 7296 1 241 . 1 1 38 38 GLU HA H 1 4.197 0.03 . 1 . . . . 38 GLU HA . 7296 1 242 . 1 1 38 38 GLU HB2 H 1 2.082 0.03 . 1 . . . . 38 GLU HB1 . 7296 1 243 . 1 1 38 38 GLU HB3 H 1 2.082 0.03 . 1 . . . . 38 GLU HB2 . 7296 1 244 . 1 1 38 38 GLU HG2 H 1 2.369 0.03 . 1 . . . . 38 GLU HG1 . 7296 1 245 . 1 1 38 38 GLU HG3 H 1 2.369 0.03 . 1 . . . . 38 GLU HG2 . 7296 1 246 . 1 1 39 39 GLY H H 1 9.212 0.03 . 1 . . . . 39 GLY HN . 7296 1 247 . 1 1 39 39 GLY HA2 H 1 4.244 0.03 . 2 . . . . 39 GLY HA1 . 7296 1 248 . 1 1 39 39 GLY HA3 H 1 4.11 0.03 . 2 . . . . 39 GLY HA2 . 7296 1 249 . 1 1 40 40 ALA H H 1 7.753 0.03 . 1 . . . . 40 ALA HN . 7296 1 250 . 1 1 40 40 ALA HA H 1 4.186 0.03 . 1 . . . . 40 ALA HA . 7296 1 251 . 1 1 40 40 ALA HB1 H 1 1.67 0.03 . 1 . . . . 40 ALA HB1 . 7296 1 252 . 1 1 40 40 ALA HB2 H 1 1.67 0.03 . 1 . . . . 40 ALA HB1 . 7296 1 253 . 1 1 40 40 ALA HB3 H 1 1.67 0.03 . 1 . . . . 40 ALA HB1 . 7296 1 254 . 1 1 41 41 ALA H H 1 9.015 0.03 . 1 . . . . 41 ALA HN . 7296 1 255 . 1 1 41 41 ALA HA H 1 3.926 0.03 . 1 . . . . 41 ALA HA . 7296 1 256 . 1 1 41 41 ALA HB1 H 1 1.474 0.03 . 1 . . . . 41 ALA HB1 . 7296 1 257 . 1 1 41 41 ALA HB2 H 1 1.474 0.03 . 1 . . . . 41 ALA HB1 . 7296 1 258 . 1 1 41 41 ALA HB3 H 1 1.474 0.03 . 1 . . . . 41 ALA HB1 . 7296 1 259 . 1 1 42 42 ASP H H 1 7.661 0.03 . 1 . . . . 42 ASP HN . 7296 1 260 . 1 1 42 42 ASP HA H 1 4.445 0.03 . 1 . . . . 42 ASP HA . 7296 1 261 . 1 1 42 42 ASP HB2 H 1 2.76 0.03 . 1 . . . . 42 ASP HB1 . 7296 1 262 . 1 1 42 42 ASP HB3 H 1 2.76 0.03 . 1 . . . . 42 ASP HB2 . 7296 1 263 . 1 1 43 43 THR H H 1 8.0 0.03 . 1 . . . . 43 THR HN . 7296 1 264 . 1 1 43 43 THR HA H 1 3.923 0.03 . 1 . . . . 43 THR HA . 7296 1 265 . 1 1 43 43 THR HB H 1 4.351 0.03 . 1 . . . . 43 THR HB . 7296 1 266 . 1 1 43 43 THR HG21 H 1 1.323 0.03 . 1 . . . . 43 THR HG21 . 7296 1 267 . 1 1 43 43 THR HG22 H 1 1.323 0.03 . 1 . . . . 43 THR HG21 . 7296 1 268 . 1 1 43 43 THR HG23 H 1 1.323 0.03 . 1 . . . . 43 THR HG21 . 7296 1 269 . 1 1 44 44 LEU H H 1 9.099 0.03 . 1 . . . . 44 LEU HN . 7296 1 270 . 1 1 44 44 LEU HA H 1 4.254 0.03 . 1 . . . . 44 LEU HA . 7296 1 271 . 1 1 44 44 LEU HB2 H 1 1.506 0.03 . 2 . . . . 44 LEU HB1 . 7296 1 272 . 1 1 44 44 LEU HB3 H 1 2.203 0.03 . 2 . . . . 44 LEU HB2 . 7296 1 273 . 1 1 44 44 LEU HG H 1 2.203 0.03 . 1 . . . . 44 LEU HG . 7296 1 274 . 1 1 44 44 LEU HD11 H 1 1.054 0.03 . 2 . . . . 44 LEU HD11 . 7296 1 275 . 1 1 44 44 LEU HD12 H 1 1.054 0.03 . 2 . . . . 44 LEU HD11 . 7296 1 276 . 1 1 44 44 LEU HD13 H 1 1.054 0.03 . 2 . . . . 44 LEU HD11 . 7296 1 277 . 1 1 44 44 LEU HD21 H 1 1.294 0.03 . 2 . . . . 44 LEU HD21 . 7296 1 278 . 1 1 44 44 LEU HD22 H 1 1.294 0.03 . 2 . . . . 44 LEU HD21 . 7296 1 279 . 1 1 44 44 LEU HD23 H 1 1.294 0.03 . 2 . . . . 44 LEU HD21 . 7296 1 280 . 1 1 45 45 ALA H H 1 8.253 0.03 . 1 . . . . 45 ALA HN . 7296 1 281 . 1 1 45 45 ALA HA H 1 3.924 0.03 . 1 . . . . 45 ALA HA . 7296 1 282 . 1 1 45 45 ALA HB1 H 1 1.49 0.03 . 1 . . . . 45 ALA HB1 . 7296 1 283 . 1 1 45 45 ALA HB2 H 1 1.49 0.03 . 1 . . . . 45 ALA HB1 . 7296 1 284 . 1 1 45 45 ALA HB3 H 1 1.49 0.03 . 1 . . . . 45 ALA HB1 . 7296 1 285 . 1 1 46 46 LEU H H 1 7.488 0.03 . 1 . . . . 46 LEU HN . 7296 1 286 . 1 1 46 46 LEU HA H 1 3.882 0.03 . 1 . . . . 46 LEU HA . 7296 1 287 . 1 1 46 46 LEU HB2 H 1 1.602 0.03 . 2 . . . . 46 LEU HB1 . 7296 1 288 . 1 1 46 46 LEU HB3 H 1 1.854 0.03 . 2 . . . . 46 LEU HB2 . 7296 1 289 . 1 1 46 46 LEU HG H 1 1.746 0.03 . 1 . . . . 46 LEU HG . 7296 1 290 . 1 1 46 46 LEU HD11 H 1 0.883 0.03 . 2 . . . . 46 LEU HD11 . 7296 1 291 . 1 1 46 46 LEU HD12 H 1 0.883 0.03 . 2 . . . . 46 LEU HD11 . 7296 1 292 . 1 1 46 46 LEU HD13 H 1 0.883 0.03 . 2 . . . . 46 LEU HD11 . 7296 1 293 . 1 1 46 46 LEU HD21 H 1 0.83 0.03 . 2 . . . . 46 LEU HD21 . 7296 1 294 . 1 1 46 46 LEU HD22 H 1 0.83 0.03 . 2 . . . . 46 LEU HD21 . 7296 1 295 . 1 1 46 46 LEU HD23 H 1 0.83 0.03 . 2 . . . . 46 LEU HD21 . 7296 1 296 . 1 1 47 47 ALA H H 1 7.4 0.03 . 1 . . . . 47 ALA HN . 7296 1 297 . 1 1 47 47 ALA HA H 1 3.642 0.03 . 1 . . . . 47 ALA HA . 7296 1 298 . 1 1 47 47 ALA HB1 H 1 1.105 0.03 . 1 . . . . 47 ALA HB1 . 7296 1 299 . 1 1 47 47 ALA HB2 H 1 1.105 0.03 . 1 . . . . 47 ALA HB1 . 7296 1 300 . 1 1 47 47 ALA HB3 H 1 1.105 0.03 . 1 . . . . 47 ALA HB1 . 7296 1 301 . 1 1 48 48 ILE H H 1 8.0 0.03 . 1 . . . . 48 ILE HN . 7296 1 302 . 1 1 48 48 ILE HA H 1 1.407 0.03 . 1 . . . . 48 ILE HA . 7296 1 303 . 1 1 48 48 ILE HB H 1 1.626 0.03 . 1 . . . . 48 ILE HB . 7296 1 304 . 1 1 48 48 ILE HG12 H 1 0.943 0.03 . 1 . . . . 48 ILE HG11 . 7296 1 305 . 1 1 48 48 ILE HG13 H 1 0.943 0.03 . 1 . . . . 48 ILE HG12 . 7296 1 306 . 1 1 48 48 ILE HG21 H 1 0.741 0.03 . 1 . . . . 48 ILE HG21 . 7296 1 307 . 1 1 48 48 ILE HG22 H 1 0.741 0.03 . 1 . . . . 48 ILE HG21 . 7296 1 308 . 1 1 48 48 ILE HG23 H 1 0.741 0.03 . 1 . . . . 48 ILE HG21 . 7296 1 309 . 1 1 48 48 ILE HD11 H 1 1.42 0.03 . 1 . . . . 48 ILE HD11 . 7296 1 310 . 1 1 48 48 ILE HD12 H 1 1.42 0.03 . 1 . . . . 48 ILE HD11 . 7296 1 311 . 1 1 48 48 ILE HD13 H 1 1.42 0.03 . 1 . . . . 48 ILE HD11 . 7296 1 312 . 1 1 49 49 LYS H H 1 7.287 0.03 . 1 . . . . 49 LYS HN . 7296 1 313 . 1 1 49 49 LYS HA H 1 3.814 0.03 . 1 . . . . 49 LYS HA . 7296 1 314 . 1 1 49 49 LYS HB2 H 1 1.65 0.03 . 1 . . . . 49 LYS HB1 . 7296 1 315 . 1 1 49 49 LYS HB3 H 1 1.65 0.03 . 1 . . . . 49 LYS HB2 . 7296 1 316 . 1 1 49 49 LYS HG2 H 1 1.331 0.03 . 4 . . . . 49 LYS HG1 . 7296 1 317 . 1 1 49 49 LYS HG3 H 1 1.331 0.03 . 4 . . . . 49 LYS HG2 . 7296 1 318 . 1 1 49 49 LYS HD2 H 1 1.506 0.03 . 4 . . . . 49 LYS HD1 . 7296 1 319 . 1 1 49 49 LYS HD3 H 1 1.506 0.03 . 4 . . . . 49 LYS HD2 . 7296 1 320 . 1 1 49 49 LYS HE2 H 1 3.008 0.03 . 2 . . . . 49 LYS HE1 . 7296 1 321 . 1 1 49 49 LYS HE3 H 1 3.108 0.03 . 2 . . . . 49 LYS HE2 . 7296 1 322 . 1 1 50 50 ASN H H 1 8.32 0.03 . 1 . . . . 50 ASN HN . 7296 1 323 . 1 1 50 50 ASN HA H 1 4.519 0.03 . 1 . . . . 50 ASN HA . 7296 1 324 . 1 1 50 50 ASN HB2 H 1 2.726 0.03 . 2 . . . . 50 ASN HB1 . 7296 1 325 . 1 1 50 50 ASN HB3 H 1 2.635 0.03 . 2 . . . . 50 ASN HB2 . 7296 1 326 . 1 1 50 50 ASN HD21 H 1 7.121 0.03 . 2 . . . . 50 ASN HD21 . 7296 1 327 . 1 1 50 50 ASN HD22 H 1 7.342 0.03 . 2 . . . . 50 ASN HD22 . 7296 1 328 . 1 1 51 51 GLY H H 1 7.496 0.03 . 1 . . . . 51 GLY HN . 7296 1 329 . 1 1 51 51 GLY HA2 H 1 3.62 0.03 . 2 . . . . 51 GLY HA1 . 7296 1 330 . 1 1 51 51 GLY HA3 H 1 2.045 0.03 . 2 . . . . 51 GLY HA2 . 7296 1 331 . 1 1 52 52 SER H H 1 7.167 0.03 . 1 . . . . 52 SER HN . 7296 1 332 . 1 1 52 52 SER HA H 1 4.293 0.03 . 1 . . . . 52 SER HA . 7296 1 333 . 1 1 52 52 SER HB2 H 1 2.733 0.03 . 2 . . . . 52 SER HB1 . 7296 1 334 . 1 1 52 52 SER HB3 H 1 2.92 0.03 . 2 . . . . 52 SER HB2 . 7296 1 335 . 1 1 53 53 GLN H H 1 8.114 0.03 . 1 . . . . 53 GLN HN . 7296 1 336 . 1 1 53 53 GLN HA H 1 4.315 0.03 . 1 . . . . 53 GLN HA . 7296 1 337 . 1 1 53 53 GLN HB2 H 1 1.951 0.03 . 1 . . . . 53 GLN HB1 . 7296 1 338 . 1 1 53 53 GLN HB3 H 1 1.951 0.03 . 1 . . . . 53 GLN HB2 . 7296 1 339 . 1 1 53 53 GLN HG2 H 1 2.272 0.03 . 2 . . . . 53 GLN HG1 . 7296 1 340 . 1 1 53 53 GLN HG3 H 1 2.097 0.03 . 2 . . . . 53 GLN HG2 . 7296 1 341 . 1 1 53 53 GLN HE21 H 1 7.474 0.03 . 2 . . . . 53 GLN HE21 . 7296 1 342 . 1 1 53 53 GLN HE22 H 1 6.829 0.03 . 2 . . . . 53 GLN HE22 . 7296 1 343 . 1 1 54 54 GLY H H 1 8.255 0.03 . 1 . . . . 54 GLY HN . 7296 1 344 . 1 1 54 54 GLY HA2 H 1 3.924 0.03 . 2 . . . . 54 GLY HA1 . 7296 1 345 . 1 1 54 54 GLY HA3 H 1 4.219 0.03 . 2 . . . . 54 GLY HA2 . 7296 1 346 . 1 1 55 55 VAL H H 1 10.573 0.03 . 1 . . . . 55 VAL HN . 7296 1 347 . 1 1 55 55 VAL HA H 1 3.762 0.03 . 1 . . . . 55 VAL HA . 7296 1 348 . 1 1 55 55 VAL HB H 1 2.433 0.03 . 1 . . . . 55 VAL HB . 7296 1 349 . 1 1 55 55 VAL HG11 H 1 0.634 0.03 . 2 . . . . 55 VAL HG11 . 7296 1 350 . 1 1 55 55 VAL HG12 H 1 0.634 0.03 . 2 . . . . 55 VAL HG11 . 7296 1 351 . 1 1 55 55 VAL HG13 H 1 0.634 0.03 . 2 . . . . 55 VAL HG11 . 7296 1 352 . 1 1 55 55 VAL HG21 H 1 1.048 0.03 . 2 . . . . 55 VAL HG21 . 7296 1 353 . 1 1 55 55 VAL HG22 H 1 1.048 0.03 . 2 . . . . 55 VAL HG21 . 7296 1 354 . 1 1 55 55 VAL HG23 H 1 1.048 0.03 . 2 . . . . 55 VAL HG21 . 7296 1 355 . 1 1 56 56 TRP H H 1 10.724 0.03 . 1 . . . . 56 TRP HN . 7296 1 356 . 1 1 56 56 TRP HA H 1 4.634 0.03 . 1 . . . . 56 TRP HA . 7296 1 357 . 1 1 56 56 TRP HB2 H 1 3.635 0.03 . 2 . . . . 56 TRP HB1 . 7296 1 358 . 1 1 56 56 TRP HB3 H 1 3.841 0.03 . 2 . . . . 56 TRP HB2 . 7296 1 359 . 1 1 56 56 TRP HD1 H 1 7.663 0.03 . 1 . . . . 56 TRP HD1 . 7296 1 360 . 1 1 56 56 TRP HE1 H 1 12.518 0.03 . 1 . . . . 56 TRP HE1 . 7296 1 361 . 1 1 56 56 TRP HE3 H 1 7.992 0.03 . 1 . . . . 56 TRP HE3 . 7296 1 362 . 1 1 56 56 TRP HZ2 H 1 7.564 0.03 . 1 . . . . 56 TRP HZ2 . 7296 1 363 . 1 1 56 56 TRP HZ3 H 1 7.28 0.03 . 1 . . . . 56 TRP HZ3 . 7296 1 364 . 1 1 56 56 TRP HH2 H 1 7.066 0.03 . 1 . . . . 56 TRP HH2 . 7296 1 365 . 1 1 57 57 GLY H H 1 8.067 0.03 . 1 . . . . 57 GLY HN . 7296 1 366 . 1 1 57 57 GLY HA2 H 1 4.608 0.03 . 2 . . . . 57 GLY HA1 . 7296 1 367 . 1 1 57 57 GLY HA3 H 1 4.196 0.03 . 2 . . . . 57 GLY HA2 . 7296 1 368 . 1 1 58 58 PRO HA H 1 4.832 0.03 . 1 . . . . 58 PRO HA . 7296 1 369 . 1 1 58 58 PRO HB2 H 1 2.272 0.03 . 1 . . . . 58 PRO HB1 . 7296 1 370 . 1 1 58 58 PRO HB3 H 1 2.272 0.03 . 1 . . . . 58 PRO HB2 . 7296 1 371 . 1 1 58 58 PRO HG2 H 1 2.272 0.03 . 2 . . . . 58 PRO HG1 . 7296 1 372 . 1 1 58 58 PRO HG3 H 1 2.072 0.03 . 2 . . . . 58 PRO HG2 . 7296 1 373 . 1 1 58 58 PRO HD2 H 1 4.01 0.03 . 2 . . . . 58 PRO HD1 . 7296 1 374 . 1 1 58 58 PRO HD3 H 1 3.683 0.03 . 2 . . . . 58 PRO HD2 . 7296 1 375 . 1 1 59 59 ILE H H 1 7.527 0.03 . 1 . . . . 59 ILE HN . 7296 1 376 . 1 1 59 59 ILE HA H 1 4.707 0.03 . 1 . . . . 59 ILE HA . 7296 1 377 . 1 1 59 59 ILE HB H 1 2.23 0.03 . 1 . . . . 59 ILE HB . 7296 1 378 . 1 1 59 59 ILE HG12 H 1 1.848 0.03 . 2 . . . . 59 ILE HG11 . 7296 1 379 . 1 1 59 59 ILE HG13 H 1 1.562 0.03 . 2 . . . . 59 ILE HG12 . 7296 1 380 . 1 1 59 59 ILE HG21 H 1 1.414 0.03 . 1 . . . . 59 ILE HG21 . 7296 1 381 . 1 1 59 59 ILE HG22 H 1 1.414 0.03 . 1 . . . . 59 ILE HG21 . 7296 1 382 . 1 1 59 59 ILE HG23 H 1 1.414 0.03 . 1 . . . . 59 ILE HG21 . 7296 1 383 . 1 1 59 59 ILE HD11 H 1 1.142 0.03 . 1 . . . . 59 ILE HD11 . 7296 1 384 . 1 1 59 59 ILE HD12 H 1 1.142 0.03 . 1 . . . . 59 ILE HD11 . 7296 1 385 . 1 1 59 59 ILE HD13 H 1 1.142 0.03 . 1 . . . . 59 ILE HD11 . 7296 1 386 . 1 1 60 60 PRO HA H 1 4.919 0.03 . 1 . . . . 60 PRO HA . 7296 1 387 . 1 1 60 60 PRO HB2 H 1 2.028 0.03 . 2 . . . . 60 PRO HB1 . 7296 1 388 . 1 1 60 60 PRO HB3 H 1 1.538 0.03 . 2 . . . . 60 PRO HB2 . 7296 1 389 . 1 1 60 60 PRO HG2 H 1 2.14 0.03 . 1 . . . . 60 PRO HG1 . 7296 1 390 . 1 1 60 60 PRO HG3 H 1 2.14 0.03 . 1 . . . . 60 PRO HG2 . 7296 1 391 . 1 1 60 60 PRO HD2 H 1 4.138 0.03 . 2 . . . . 60 PRO HD1 . 7296 1 392 . 1 1 60 60 PRO HD3 H 1 3.98 0.03 . 2 . . . . 60 PRO HD2 . 7296 1 393 . 1 1 61 61 MET H H 1 8.77 0.03 . 1 . . . . 61 MET HN . 7296 1 394 . 1 1 61 61 MET HA H 1 3.697 0.03 . 1 . . . . 61 MET HA . 7296 1 395 . 1 1 61 61 MET HB2 H 1 -2.762 0.03 . 2 . . . . 61 MET HB1 . 7296 1 396 . 1 1 61 61 MET HB3 H 1 -0.904 0.03 . 2 . . . . 61 MET HB2 . 7296 1 397 . 1 1 61 61 MET HG2 H 1 -3.667 0.03 . 2 . . . . 61 MET HG1 . 7296 1 398 . 1 1 61 61 MET HG3 H 1 -0.535 0.03 . 2 . . . . 61 MET HG2 . 7296 1 399 . 1 1 61 61 MET HE1 H 1 -2.907 0.03 . 1 . . . . 61 MET HE1 . 7296 1 400 . 1 1 61 61 MET HE2 H 1 -2.907 0.03 . 1 . . . . 61 MET HE1 . 7296 1 401 . 1 1 61 61 MET HE3 H 1 -2.907 0.03 . 1 . . . . 61 MET HE1 . 7296 1 402 . 1 1 62 62 PRO HA H 1 4.275 0.03 . 1 . . . . 62 PRO HA . 7296 1 403 . 1 1 62 62 PRO HB2 H 1 2.141 0.03 . 1 . . . . 62 PRO HB1 . 7296 1 404 . 1 1 62 62 PRO HB3 H 1 2.141 0.03 . 1 . . . . 62 PRO HB2 . 7296 1 405 . 1 1 62 62 PRO HG2 H 1 1.85 0.03 . 1 . . . . 62 PRO HG1 . 7296 1 406 . 1 1 62 62 PRO HG3 H 1 1.85 0.03 . 1 . . . . 62 PRO HG2 . 7296 1 407 . 1 1 62 62 PRO HD2 H 1 3.768 0.03 . 2 . . . . 62 PRO HD1 . 7296 1 408 . 1 1 62 62 PRO HD3 H 1 2.999 0.03 . 2 . . . . 62 PRO HD2 . 7296 1 409 . 1 1 63 63 PRO HA H 1 3.311 0.03 . 1 . . . . 63 PRO HA . 7296 1 410 . 1 1 63 63 PRO HB2 H 1 2.128 0.03 . 2 . . . . 63 PRO HB1 . 7296 1 411 . 1 1 63 63 PRO HB3 H 1 1.546 0.03 . 2 . . . . 63 PRO HB2 . 7296 1 412 . 1 1 63 63 PRO HG2 H 1 1.806 0.03 . 2 . . . . 63 PRO HG1 . 7296 1 413 . 1 1 63 63 PRO HG3 H 1 1.686 0.03 . 2 . . . . 63 PRO HG2 . 7296 1 414 . 1 1 63 63 PRO HD2 H 1 2.97 0.03 . 2 . . . . 63 PRO HD1 . 7296 1 415 . 1 1 63 63 PRO HD3 H 1 2.873 0.03 . 2 . . . . 63 PRO HD2 . 7296 1 416 . 1 1 64 64 ASN H H 1 7.012 0.03 . 1 . . . . 64 ASN HN . 7296 1 417 . 1 1 64 64 ASN HA H 1 5.101 0.03 . 1 . . . . 64 ASN HA . 7296 1 418 . 1 1 64 64 ASN HB2 H 1 2.64 0.03 . 2 . . . . 64 ASN HB1 . 7296 1 419 . 1 1 64 64 ASN HB3 H 1 1.95 0.03 . 2 . . . . 64 ASN HB2 . 7296 1 420 . 1 1 64 64 ASN HD21 H 1 3.19 0.03 . 2 . . . . 64 ASN HD21 . 7296 1 421 . 1 1 64 64 ASN HD22 H 1 7.277 0.03 . 2 . . . . 64 ASN HD22 . 7296 1 422 . 1 1 65 65 PRO HA H 1 4.888 0.03 . 1 . . . . 65 PRO HA . 7296 1 423 . 1 1 65 65 PRO HB2 H 1 2.486 0.03 . 2 . . . . 65 PRO HB1 . 7296 1 424 . 1 1 65 65 PRO HB3 H 1 1.92 0.03 . 2 . . . . 65 PRO HB2 . 7296 1 425 . 1 1 65 65 PRO HG2 H 1 2.137 0.03 . 2 . . . . 65 PRO HG1 . 7296 1 426 . 1 1 65 65 PRO HG3 H 1 2.34 0.03 . 2 . . . . 65 PRO HG2 . 7296 1 427 . 1 1 65 65 PRO HD2 H 1 3.89 0.03 . 1 . . . . 65 PRO HD1 . 7296 1 428 . 1 1 65 65 PRO HD3 H 1 3.89 0.03 . 1 . . . . 65 PRO HD2 . 7296 1 429 . 1 1 66 66 VAL H H 1 8.064 0.03 . 1 . . . . 66 VAL HN . 7296 1 430 . 1 1 66 66 VAL HA H 1 5.081 0.03 . 1 . . . . 66 VAL HA . 7296 1 431 . 1 1 66 66 VAL HB H 1 2.485 0.03 . 1 . . . . 66 VAL HB . 7296 1 432 . 1 1 66 66 VAL HG11 H 1 0.738 0.03 . 1 . . . . 66 VAL HG11 . 7296 1 433 . 1 1 66 66 VAL HG12 H 1 0.738 0.03 . 1 . . . . 66 VAL HG11 . 7296 1 434 . 1 1 66 66 VAL HG13 H 1 0.738 0.03 . 1 . . . . 66 VAL HG11 . 7296 1 435 . 1 1 66 66 VAL HG21 H 1 0.635 0.03 . 1 . . . . 66 VAL HG21 . 7296 1 436 . 1 1 66 66 VAL HG22 H 1 0.635 0.03 . 1 . . . . 66 VAL HG21 . 7296 1 437 . 1 1 66 66 VAL HG23 H 1 0.635 0.03 . 1 . . . . 66 VAL HG21 . 7296 1 438 . 1 1 67 67 THR H H 1 9.006 0.03 . 1 . . . . 67 THR HN . 7296 1 439 . 1 1 67 67 THR HA H 1 4.527 0.03 . 1 . . . . 67 THR HA . 7296 1 440 . 1 1 67 67 THR HB H 1 5.08 0.03 . 1 . . . . 67 THR HB . 7296 1 441 . 1 1 67 67 THR HG21 H 1 1.336 0.03 . 1 . . . . 67 THR HG21 . 7296 1 442 . 1 1 67 67 THR HG22 H 1 1.336 0.03 . 1 . . . . 67 THR HG21 . 7296 1 443 . 1 1 67 67 THR HG23 H 1 1.336 0.03 . 1 . . . . 67 THR HG21 . 7296 1 444 . 1 1 68 68 GLU H H 1 9.221 0.03 . 1 . . . . 68 GLU HN . 7296 1 445 . 1 1 68 68 GLU HA H 1 3.893 0.03 . 1 . . . . 68 GLU HA . 7296 1 446 . 1 1 68 68 GLU HB2 H 1 2.072 0.03 . 1 . . . . 68 GLU HB1 . 7296 1 447 . 1 1 68 68 GLU HB3 H 1 2.072 0.03 . 1 . . . . 68 GLU HB2 . 7296 1 448 . 1 1 68 68 GLU HG2 H 1 2.344 0.03 . 1 . . . . 68 GLU HG1 . 7296 1 449 . 1 1 68 68 GLU HG3 H 1 2.344 0.03 . 1 . . . . 68 GLU HG2 . 7296 1 450 . 1 1 69 69 GLU H H 1 8.652 0.03 . 1 . . . . 69 GLU HN . 7296 1 451 . 1 1 69 69 GLU HA H 1 4.075 0.03 . 1 . . . . 69 GLU HA . 7296 1 452 . 1 1 69 69 GLU HB2 H 1 1.974 0.03 . 1 . . . . 69 GLU HB1 . 7296 1 453 . 1 1 69 69 GLU HB3 H 1 1.974 0.03 . 1 . . . . 69 GLU HB2 . 7296 1 454 . 1 1 69 69 GLU HG2 H 1 2.14 0.03 . 2 . . . . 69 GLU HG1 . 7296 1 455 . 1 1 69 69 GLU HG3 H 1 2.365 0.03 . 2 . . . . 69 GLU HG2 . 7296 1 456 . 1 1 70 70 GLU H H 1 7.954 0.03 . 1 . . . . 70 GLU HN . 7296 1 457 . 1 1 70 70 GLU HA H 1 3.854 0.03 . 1 . . . . 70 GLU HA . 7296 1 458 . 1 1 70 70 GLU HB2 H 1 2.558 0.03 . 1 . . . . 70 GLU HB1 . 7296 1 459 . 1 1 70 70 GLU HB3 H 1 2.558 0.03 . 1 . . . . 70 GLU HB2 . 7296 1 460 . 1 1 70 70 GLU HG2 H 1 1.765 0.03 . 1 . . . . 70 GLU HG1 . 7296 1 461 . 1 1 70 70 GLU HG3 H 1 1.765 0.03 . 1 . . . . 70 GLU HG2 . 7296 1 462 . 1 1 71 71 ALA H H 1 8.741 0.03 . 1 . . . . 71 ALA HN . 7296 1 463 . 1 1 71 71 ALA HA H 1 4.014 0.03 . 1 . . . . 71 ALA HA . 7296 1 464 . 1 1 71 71 ALA HB1 H 1 1.625 0.03 . 1 . . . . 71 ALA HB1 . 7296 1 465 . 1 1 71 71 ALA HB2 H 1 1.625 0.03 . 1 . . . . 71 ALA HB1 . 7296 1 466 . 1 1 71 71 ALA HB3 H 1 1.625 0.03 . 1 . . . . 71 ALA HB1 . 7296 1 467 . 1 1 72 72 LYS H H 1 7.755 0.03 . 1 . . . . 72 LYS HN . 7296 1 468 . 1 1 72 72 LYS HA H 1 4.186 0.03 . 1 . . . . 72 LYS HA . 7296 1 469 . 1 1 72 72 LYS HB2 H 1 1.943 0.03 . 2 . . . . 72 LYS HB1 . 7296 1 470 . 1 1 72 72 LYS HB3 H 1 2.126 0.03 . 2 . . . . 72 LYS HB2 . 7296 1 471 . 1 1 72 72 LYS HG2 H 1 1.778 0.03 . 4 . . . . 72 LYS HG1 . 7296 1 472 . 1 1 72 72 LYS HG3 H 1 1.778 0.03 . 4 . . . . 72 LYS HG2 . 7296 1 473 . 1 1 72 72 LYS HD2 H 1 1.58 0.03 . 4 . . . . 72 LYS HD1 . 7296 1 474 . 1 1 72 72 LYS HD3 H 1 1.58 0.03 . 4 . . . . 72 LYS HD2 . 7296 1 475 . 1 1 72 72 LYS HE2 H 1 2.972 0.03 . 1 . . . . 72 LYS HE1 . 7296 1 476 . 1 1 72 72 LYS HE3 H 1 2.972 0.03 . 1 . . . . 72 LYS HE2 . 7296 1 477 . 1 1 73 73 ILE H H 1 8.044 0.03 . 1 . . . . 73 ILE HN . 7296 1 478 . 1 1 73 73 ILE HA H 1 3.885 0.03 . 1 . . . . 73 ILE HA . 7296 1 479 . 1 1 73 73 ILE HB H 1 1.941 0.03 . 1 . . . . 73 ILE HB . 7296 1 480 . 1 1 73 73 ILE HG12 H 1 1.184 0.03 . 1 . . . . 73 ILE HG11 . 7296 1 481 . 1 1 73 73 ILE HG13 H 1 1.184 0.03 . 1 . . . . 73 ILE HG12 . 7296 1 482 . 1 1 73 73 ILE HG21 H 1 0.932 0.03 . 1 . . . . 73 ILE HG21 . 7296 1 483 . 1 1 73 73 ILE HG22 H 1 0.932 0.03 . 1 . . . . 73 ILE HG21 . 7296 1 484 . 1 1 73 73 ILE HG23 H 1 0.932 0.03 . 1 . . . . 73 ILE HG21 . 7296 1 485 . 1 1 73 73 ILE HD11 H 1 0.89 0.03 . 1 . . . . 73 ILE HD11 . 7296 1 486 . 1 1 73 73 ILE HD12 H 1 0.89 0.03 . 1 . . . . 73 ILE HD11 . 7296 1 487 . 1 1 73 73 ILE HD13 H 1 0.89 0.03 . 1 . . . . 73 ILE HD11 . 7296 1 488 . 1 1 74 74 LEU H H 1 8.857 0.03 . 1 . . . . 74 LEU HN . 7296 1 489 . 1 1 74 74 LEU HA H 1 4.463 0.03 . 1 . . . . 74 LEU HA . 7296 1 490 . 1 1 74 74 LEU HB2 H 1 2.559 0.03 . 2 . . . . 74 LEU HB1 . 7296 1 491 . 1 1 74 74 LEU HB3 H 1 1.85 0.03 . 2 . . . . 74 LEU HB2 . 7296 1 492 . 1 1 74 74 LEU HG H 1 2.021 0.03 . 1 . . . . 74 LEU HG . 7296 1 493 . 1 1 74 74 LEU HD11 H 1 1.256 0.03 . 2 . . . . 74 LEU HD11 . 7296 1 494 . 1 1 74 74 LEU HD12 H 1 1.256 0.03 . 2 . . . . 74 LEU HD11 . 7296 1 495 . 1 1 74 74 LEU HD13 H 1 1.256 0.03 . 2 . . . . 74 LEU HD11 . 7296 1 496 . 1 1 74 74 LEU HD21 H 1 1.381 0.03 . 2 . . . . 74 LEU HD21 . 7296 1 497 . 1 1 74 74 LEU HD22 H 1 1.381 0.03 . 2 . . . . 74 LEU HD21 . 7296 1 498 . 1 1 74 74 LEU HD23 H 1 1.381 0.03 . 2 . . . . 74 LEU HD21 . 7296 1 499 . 1 1 75 75 ALA H H 1 8.873 0.03 . 1 . . . . 75 ALA HN . 7296 1 500 . 1 1 75 75 ALA HA H 1 4.082 0.03 . 1 . . . . 75 ALA HA . 7296 1 501 . 1 1 75 75 ALA HB1 H 1 1.799 0.03 . 1 . . . . 75 ALA HB1 . 7296 1 502 . 1 1 75 75 ALA HB2 H 1 1.799 0.03 . 1 . . . . 75 ALA HB1 . 7296 1 503 . 1 1 75 75 ALA HB3 H 1 1.799 0.03 . 1 . . . . 75 ALA HB1 . 7296 1 504 . 1 1 76 76 GLU H H 1 8.517 0.03 . 1 . . . . 76 GLU HN . 7296 1 505 . 1 1 76 76 GLU HA H 1 4.051 0.03 . 1 . . . . 76 GLU HA . 7296 1 506 . 1 1 76 76 GLU HB2 H 1 2.261 0.03 . 1 . . . . 76 GLU HB1 . 7296 1 507 . 1 1 76 76 GLU HB3 H 1 2.261 0.03 . 1 . . . . 76 GLU HB2 . 7296 1 508 . 1 1 76 76 GLU HG2 H 1 2.643 0.03 . 1 . . . . 76 GLU HG1 . 7296 1 509 . 1 1 76 76 GLU HG3 H 1 2.643 0.03 . 1 . . . . 76 GLU HG2 . 7296 1 510 . 1 1 77 77 TRP H H 1 8.489 0.03 . 1 . . . . 77 TRP HN . 7296 1 511 . 1 1 77 77 TRP HA H 1 4.432 0.03 . 1 . . . . 77 TRP HA . 7296 1 512 . 1 1 77 77 TRP HB2 H 1 3.412 0.03 . 2 . . . . 77 TRP HB1 . 7296 1 513 . 1 1 77 77 TRP HB3 H 1 3.812 0.03 . 2 . . . . 77 TRP HB2 . 7296 1 514 . 1 1 77 77 TRP HD1 H 1 7.328 0.03 . 1 . . . . 77 TRP HD1 . 7296 1 515 . 1 1 77 77 TRP HE1 H 1 10.327 0.03 . 1 . . . . 77 TRP HE1 . 7296 1 516 . 1 1 77 77 TRP HE3 H 1 7.648 0.03 . 1 . . . . 77 TRP HE3 . 7296 1 517 . 1 1 77 77 TRP HZ2 H 1 7.03 0.03 . 1 . . . . 77 TRP HZ2 . 7296 1 518 . 1 1 77 77 TRP HZ3 H 1 6.182 0.03 . 1 . . . . 77 TRP HZ3 . 7296 1 519 . 1 1 77 77 TRP HH2 H 1 5.643 0.03 . 1 . . . . 77 TRP HH2 . 7296 1 520 . 1 1 78 78 VAL H H 1 9.225 0.03 . 1 . . . . 78 VAL HN . 7296 1 521 . 1 1 78 78 VAL HA H 1 2.732 0.03 . 1 . . . . 78 VAL HA . 7296 1 522 . 1 1 78 78 VAL HB H 1 2.524 0.03 . 1 . . . . 78 VAL HB . 7296 1 523 . 1 1 78 78 VAL HG11 H 1 1.478 0.03 . 2 . . . . 78 VAL HG11 . 7296 1 524 . 1 1 78 78 VAL HG12 H 1 1.478 0.03 . 2 . . . . 78 VAL HG11 . 7296 1 525 . 1 1 78 78 VAL HG13 H 1 1.478 0.03 . 2 . . . . 78 VAL HG11 . 7296 1 526 . 1 1 78 78 VAL HG21 H 1 0.893 0.03 . 2 . . . . 78 VAL HG21 . 7296 1 527 . 1 1 78 78 VAL HG22 H 1 0.893 0.03 . 2 . . . . 78 VAL HG21 . 7296 1 528 . 1 1 78 78 VAL HG23 H 1 0.893 0.03 . 2 . . . . 78 VAL HG21 . 7296 1 529 . 1 1 79 79 LEU H H 1 7.776 0.03 . 1 . . . . 79 LEU HN . 7296 1 530 . 1 1 79 79 LEU HA H 1 3.846 0.03 . 1 . . . . 79 LEU HA . 7296 1 531 . 1 1 79 79 LEU HB2 H 1 1.6 0.03 . 2 . . . . 79 LEU HB1 . 7296 1 532 . 1 1 79 79 LEU HB3 H 1 1.955 0.03 . 2 . . . . 79 LEU HB2 . 7296 1 533 . 1 1 79 79 LEU HG H 1 1.955 0.03 . 1 . . . . 79 LEU HG . 7296 1 534 . 1 1 79 79 LEU HD11 H 1 0.902 0.03 . 2 . . . . 79 LEU HD11 . 7296 1 535 . 1 1 79 79 LEU HD12 H 1 0.902 0.03 . 2 . . . . 79 LEU HD11 . 7296 1 536 . 1 1 79 79 LEU HD13 H 1 0.902 0.03 . 2 . . . . 79 LEU HD11 . 7296 1 537 . 1 1 79 79 LEU HD21 H 1 0.943 0.03 . 2 . . . . 79 LEU HD21 . 7296 1 538 . 1 1 79 79 LEU HD22 H 1 0.943 0.03 . 2 . . . . 79 LEU HD21 . 7296 1 539 . 1 1 79 79 LEU HD23 H 1 0.943 0.03 . 2 . . . . 79 LEU HD21 . 7296 1 540 . 1 1 80 80 SER H H 1 7.706 0.03 . 1 . . . . 80 SER HN . 7296 1 541 . 1 1 80 80 SER HA H 1 4.417 0.03 . 1 . . . . 80 SER HA . 7296 1 542 . 1 1 80 80 SER HB2 H 1 4.009 0.03 . 2 . . . . 80 SER HB1 . 7296 1 543 . 1 1 80 80 SER HB3 H 1 4.108 0.03 . 2 . . . . 80 SER HB2 . 7296 1 544 . 1 1 81 81 LEU H H 1 7.25 0.03 . 1 . . . . 81 LEU HN . 7296 1 545 . 1 1 81 81 LEU HA H 1 3.97 0.03 . 1 . . . . 81 LEU HA . 7296 1 546 . 1 1 81 81 LEU HB2 H 1 0.875 0.03 . 2 . . . . 81 LEU HB1 . 7296 1 547 . 1 1 81 81 LEU HB3 H 1 1.5 0.03 . 2 . . . . 81 LEU HB2 . 7296 1 548 . 1 1 81 81 LEU HG H 1 1.254 0.03 . 1 . . . . 81 LEU HG . 7296 1 549 . 1 1 81 81 LEU HD11 H 1 0.17 0.03 . 2 . . . . 81 LEU HD11 . 7296 1 550 . 1 1 81 81 LEU HD12 H 1 0.17 0.03 . 2 . . . . 81 LEU HD11 . 7296 1 551 . 1 1 81 81 LEU HD13 H 1 0.17 0.03 . 2 . . . . 81 LEU HD11 . 7296 1 552 . 1 1 81 81 LEU HD21 H 1 -0.167 0.03 . 2 . . . . 81 LEU HD21 . 7296 1 553 . 1 1 81 81 LEU HD22 H 1 -0.167 0.03 . 2 . . . . 81 LEU HD21 . 7296 1 554 . 1 1 81 81 LEU HD23 H 1 -0.167 0.03 . 2 . . . . 81 LEU HD21 . 7296 1 555 . 1 1 82 82 LYS H H 1 7.406 0.03 . 1 . . . . 82 LYS HN . 7296 1 556 . 1 1 82 82 LYS HA H 1 4.049 0.03 . 1 . . . . 82 LYS HA . 7296 1 557 . 1 1 82 82 LYS HB2 H 1 1.677 0.03 . 1 . . . . 82 LYS HB1 . 7296 1 558 . 1 1 82 82 LYS HB3 H 1 1.765 0.03 . 1 . . . . 82 LYS HB2 . 7296 1 559 . 1 1 82 82 LYS HG2 H 1 1.366 0.03 . 4 . . . . 82 LYS HG1 . 7296 1 560 . 1 1 82 82 LYS HG3 H 1 1.366 0.03 . 4 . . . . 82 LYS HG2 . 7296 1 561 . 1 1 82 82 LYS HD2 H 1 1.677 0.03 . 4 . . . . 82 LYS HD1 . 7296 1 562 . 1 1 82 82 LYS HD3 H 1 1.677 0.03 . 4 . . . . 82 LYS HD2 . 7296 1 563 . 1 1 82 82 LYS HE2 H 1 3.007 0.03 . 1 . . . . 82 LYS HE1 . 7296 1 564 . 1 1 82 82 LYS HE3 H 1 3.007 0.03 . 1 . . . . 82 LYS HE2 . 7296 1 565 . 2 2 1 1 HEM HAA1 H 1 3.927 0.03 . 2 . . . . 83 HEC HAA1 . 7296 1 566 . 2 2 1 1 HEM HAA2 H 1 4.436 0.03 . 2 . . . . 83 HEC HAA2 . 7296 1 567 . 2 2 1 1 HEM HAB1 H 1 5.992 0.03 . 1 . . . . 83 HEC HAB1 . 7296 1 568 . 2 2 1 1 HEM HAC1 H 1 6.210 0.03 . 1 . . . . 83 HEC HAC1 . 7296 1 569 . 2 2 1 1 HEM HAD1 H 1 4.242 0.03 . 2 . . . . 83 HEC HAD1 . 7296 1 570 . 2 2 1 1 HEM HAD2 H 1 4.597 0.03 . 2 . . . . 83 HEC HAD2 . 7296 1 571 . 2 2 1 1 HEM HBA1 H 1 2.637 0.03 . 2 . . . . 83 HEC HBA1 . 7296 1 572 . 2 2 1 1 HEM HBA2 H 1 3.231 0.03 . 2 . . . . 83 HEC HBA2 . 7296 1 573 . 2 2 1 1 HEM HBB1 H 1 1.908 0.03 . 1 . . . . 83 HEC HBB1 . 7296 1 574 . 2 2 1 1 HEM HBB2 H 1 1.908 0.03 . 1 . . . . 83 HEC HBB2 . 7296 1 575 . 2 2 1 1 HEM HBB3 H 1 1.908 0.03 . 1 . . . . 83 HEC HBB3 . 7296 1 576 . 2 2 1 1 HEM HBC1 H 1 2.446 0.03 . 1 . . . . 83 HEC HBC1 . 7296 1 577 . 2 2 1 1 HEM HBC2 H 1 2.446 0.03 . 1 . . . . 83 HEC HBC2 . 7296 1 578 . 2 2 1 1 HEM HBC3 H 1 2.446 0.03 . 1 . . . . 83 HEC HBC3 . 7296 1 579 . 2 2 1 1 HEM HBD1 H 1 2.637 0.03 . 2 . . . . 83 HEC HBD1 . 7296 1 580 . 2 2 1 1 HEM HBD2 H 1 3.419 0.03 . 2 . . . . 83 HEC HBD2 . 7296 1 581 . 2 2 1 1 HEM HHA1 H 1 9.277 0.03 . 1 . . . . 83 HEC HHA1 . 7296 1 582 . 2 2 1 1 HEM HHB1 H 1 9.178 0.03 . 1 . . . . 83 HEC HHB1 . 7296 1 583 . 2 2 1 1 HEM HHC1 H 1 9.776 0.03 . 1 . . . . 83 HEC HHC1 . 7296 1 584 . 2 2 1 1 HEM HHD1 H 1 9.311 0.03 . 1 . . . . 83 HEC HHD1 . 7296 1 585 . 2 2 1 1 HEM HMA1 H 1 3.424 0.03 . 1 . . . . 83 HEC HMA1 . 7296 1 586 . 2 2 1 1 HEM HMA2 H 1 3.424 0.03 . 1 . . . . 83 HEC HMA2 . 7296 1 587 . 2 2 1 1 HEM HMA3 H 1 3.424 0.03 . 1 . . . . 83 HEC HMA3 . 7296 1 588 . 2 2 1 1 HEM HMB1 H 1 3.770 0.03 . 1 . . . . 83 HEC HMB1 . 7296 1 589 . 2 2 1 1 HEM HMB2 H 1 3.770 0.03 . 1 . . . . 83 HEC HMB2 . 7296 1 590 . 2 2 1 1 HEM HMB3 H 1 3.770 0.03 . 1 . . . . 83 HEC HMB3 . 7296 1 591 . 2 2 1 1 HEM HMC1 H 1 3.709 0.03 . 1 . . . . 83 HEC HMC1 . 7296 1 592 . 2 2 1 1 HEM HMC2 H 1 3.709 0.03 . 1 . . . . 83 HEC HMC2 . 7296 1 593 . 2 2 1 1 HEM HMC3 H 1 3.709 0.03 . 1 . . . . 83 HEC HMC3 . 7296 1 594 . 2 2 1 1 HEM HMD1 H 1 3.308 0.03 . 1 . . . . 83 HEC HMD1 . 7296 1 595 . 2 2 1 1 HEM HMD2 H 1 3.308 0.03 . 1 . . . . 83 HEC HMD2 . 7296 1 596 . 2 2 1 1 HEM HMD3 H 1 3.308 0.03 . 1 . . . . 83 HEC HMD3 . 7296 1 stop_ save_