################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15539 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 '3D C(CO)NH' . . . 15539 1 2 '3D HNCO' . . . 15539 1 4 '3D HNCACB' . . . 15539 1 7 '3D HN(COCA)CB' . . . 15539 1 9 '3D 1H-15N TOCSY' . . . 15539 1 11 '2D 1H-15N HSQC' . . . 15539 1 12 '2D 1H-15N HSQC' . . . 15539 1 13 '2D 1H-15N HSQC' . . . 15539 1 14 '2D 1H-15N HSQC' . . . 15539 1 15 '2D 1H-15N HSQC' . . . 15539 1 16 '2D 1H-15N HSQC' . . . 15539 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 $Felix . . 15539 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 4 4 MET C C 13 176.2 0.2 . 1 . . . . 1 MET C . 15539 1 2 . 1 1 4 4 MET CA C 13 55.3 0.2 . 1 . . . . 1 MET CA . 15539 1 3 . 1 1 4 4 MET CB C 13 32.2 0.2 . 1 . . . . 1 MET CB . 15539 1 4 . 1 1 5 5 THR H H 1 8.24 0.02 . 1 . . . . 2 THR H . 15539 1 5 . 1 1 5 5 THR HA H 1 4.42 0.02 . 1 . . . . 2 THR HA . 15539 1 6 . 1 1 5 5 THR C C 13 174.5 0.2 . 1 . . . . 2 THR C . 15539 1 7 . 1 1 5 5 THR CA C 13 61.9 0.2 . 1 . . . . 2 THR CA . 15539 1 8 . 1 1 5 5 THR CB C 13 69.8 0.2 . 1 . . . . 2 THR CB . 15539 1 9 . 1 1 5 5 THR N N 15 117.0 0.2 . 1 . . . . 2 THR N . 15539 1 10 . 1 1 6 6 VAL H H 1 8.14 0.02 . 1 . . . . 3 VAL H . 15539 1 11 . 1 1 6 6 VAL HA H 1 4.19 0.02 . 1 . . . . 3 VAL HA . 15539 1 12 . 1 1 6 6 VAL HB H 1 2.13 0.02 . 1 . . . . 3 VAL HB . 15539 1 13 . 1 1 6 6 VAL HG11 H 1 1.00 0.02 . 2 . . . . 3 VAL HG1 . 15539 1 14 . 1 1 6 6 VAL HG12 H 1 1.00 0.02 . 2 . . . . 3 VAL HG1 . 15539 1 15 . 1 1 6 6 VAL HG13 H 1 1.00 0.02 . 2 . . . . 3 VAL HG1 . 15539 1 16 . 1 1 6 6 VAL HG21 H 1 1.00 0.02 . 2 . . . . 3 VAL HG2 . 15539 1 17 . 1 1 6 6 VAL HG22 H 1 1.00 0.02 . 2 . . . . 3 VAL HG2 . 15539 1 18 . 1 1 6 6 VAL HG23 H 1 1.00 0.02 . 2 . . . . 3 VAL HG2 . 15539 1 19 . 1 1 6 6 VAL C C 13 175.9 0.2 . 1 . . . . 3 VAL C . 15539 1 20 . 1 1 6 6 VAL CA C 13 61.6 0.2 . 1 . . . . 3 VAL CA . 15539 1 21 . 1 1 6 6 VAL CB C 13 32.2 0.2 . 1 . . . . 3 VAL CB . 15539 1 22 . 1 1 6 6 VAL CG1 C 13 20.5 0.2 . 2 . . . . 3 VAL CG1 . 15539 1 23 . 1 1 6 6 VAL CG2 C 13 20.5 0.2 . 2 . . . . 3 VAL CG2 . 15539 1 24 . 1 1 6 6 VAL N N 15 122.9 0.2 . 1 . . . . 3 VAL N . 15539 1 25 . 1 1 7 7 ALA H H 1 8.46 0.02 . 1 . . . . 4 ALA H . 15539 1 26 . 1 1 7 7 ALA HA H 1 4.46 0.02 . 1 . . . . 4 ALA HA . 15539 1 27 . 1 1 7 7 ALA HB1 H 1 1.48 0.02 . 1 . . . . 4 ALA HB . 15539 1 28 . 1 1 7 7 ALA HB2 H 1 1.48 0.02 . 1 . . . . 4 ALA HB . 15539 1 29 . 1 1 7 7 ALA HB3 H 1 1.48 0.02 . 1 . . . . 4 ALA HB . 15539 1 30 . 1 1 7 7 ALA C C 13 177.9 0.2 . 1 . . . . 4 ALA C . 15539 1 31 . 1 1 7 7 ALA CA C 13 52.5 0.2 . 1 . . . . 4 ALA CA . 15539 1 32 . 1 1 7 7 ALA CB C 13 19.1 0.2 . 1 . . . . 4 ALA CB . 15539 1 33 . 1 1 7 7 ALA N N 15 128.2 0.2 . 1 . . . . 4 ALA N . 15539 1 34 . 1 1 8 8 THR H H 1 8.13 0.02 . 1 . . . . 5 THR H . 15539 1 35 . 1 1 8 8 THR HA H 1 4.39 0.02 . 1 . . . . 5 THR HA . 15539 1 36 . 1 1 8 8 THR C C 13 174.6 0.2 . 1 . . . . 5 THR C . 15539 1 37 . 1 1 8 8 THR CA C 13 61.4 0.2 . 1 . . . . 5 THR CA . 15539 1 38 . 1 1 8 8 THR CB C 13 69.8 0.2 . 1 . . . . 5 THR CB . 15539 1 39 . 1 1 8 8 THR CG2 C 13 21.0 0.2 . 1 . . . . 5 THR CG2 . 15539 1 40 . 1 1 8 8 THR N N 15 113.1 0.2 . 1 . . . . 5 THR N . 15539 1 41 . 1 1 9 9 ASP H H 1 8.34 0.02 . 1 . . . . 6 ASP H . 15539 1 42 . 1 1 9 9 ASP HA H 1 4.69 0.02 . 1 . . . . 6 ASP HA . 15539 1 43 . 1 1 9 9 ASP HB2 H 1 2.75 0.02 . 2 . . . . 6 ASP HB2 . 15539 1 44 . 1 1 9 9 ASP HB3 H 1 2.75 0.02 . 2 . . . . 6 ASP HB3 . 15539 1 45 . 1 1 9 9 ASP C C 13 174.5 0.2 . 1 . . . . 6 ASP C . 15539 1 46 . 1 1 9 9 ASP CA C 13 54.4 0.2 . 1 . . . . 6 ASP CA . 15539 1 47 . 1 1 9 9 ASP CB C 13 41.0 0.2 . 1 . . . . 6 ASP CB . 15539 1 48 . 1 1 9 9 ASP N N 15 122.2 0.2 . 1 . . . . 6 ASP N . 15539 1 49 . 1 1 10 10 ASN H H 1 8.32 0.02 . 1 . . . . 7 ASN H . 15539 1 50 . 1 1 10 10 ASN HA H 1 5.09 0.02 . 1 . . . . 7 ASN HA . 15539 1 51 . 1 1 10 10 ASN HB2 H 1 2.91 0.02 . 2 . . . . 7 ASN HB2 . 15539 1 52 . 1 1 10 10 ASN HB3 H 1 2.75 0.02 . 2 . . . . 7 ASN HB3 . 15539 1 53 . 1 1 10 10 ASN C C 13 174.5 0.2 . 1 . . . . 7 ASN C . 15539 1 54 . 1 1 10 10 ASN CA C 13 52.7 0.2 . 1 . . . . 7 ASN CA . 15539 1 55 . 1 1 10 10 ASN CB C 13 38.5 0.2 . 1 . . . . 7 ASN CB . 15539 1 56 . 1 1 10 10 ASN N N 15 118.4 0.2 . 1 . . . . 7 ASN N . 15539 1 57 . 1 1 11 11 ASN H H 1 8.24 0.02 . 1 . . . . 8 ASN H . 15539 1 58 . 1 1 11 11 ASN HA H 1 4.62 0.02 . 1 . . . . 8 ASN HA . 15539 1 59 . 1 1 11 11 ASN HB2 H 1 2.72 0.02 . 2 . . . . 8 ASN HB2 . 15539 1 60 . 1 1 11 11 ASN HB3 H 1 2.64 0.02 . 2 . . . . 8 ASN HB3 . 15539 1 61 . 1 1 11 11 ASN CA C 13 51.1 0.2 . 1 . . . . 8 ASN CA . 15539 1 62 . 1 1 11 11 ASN CB C 13 38.5 0.2 . 1 . . . . 8 ASN CB . 15539 1 63 . 1 1 11 11 ASN N N 15 119.5 0.2 . 1 . . . . 8 ASN N . 15539 1 64 . 1 1 12 12 PRO C C 13 176.2 0.2 . 1 . . . . 9 PRO C . 15539 1 65 . 1 1 12 12 PRO CA C 13 62.1 0.2 . 1 . . . . 9 PRO CA . 15539 1 66 . 1 1 12 12 PRO CB C 13 30.4 0.2 . 1 . . . . 9 PRO CB . 15539 1 67 . 1 1 12 12 PRO CG C 13 26.0 0.2 . 1 . . . . 9 PRO CG . 15539 1 68 . 1 1 13 13 THR H H 1 7.25 0.02 . 1 . . . . 10 THR H . 15539 1 69 . 1 1 13 13 THR HA H 1 4.60 0.02 . 1 . . . . 10 THR HA . 15539 1 70 . 1 1 13 13 THR HB H 1 4.69 0.02 . 1 . . . . 10 THR HB . 15539 1 71 . 1 1 13 13 THR HG21 H 1 1.32 0.02 . 1 . . . . 10 THR HG2 . 15539 1 72 . 1 1 13 13 THR HG22 H 1 1.32 0.02 . 1 . . . . 10 THR HG2 . 15539 1 73 . 1 1 13 13 THR HG23 H 1 1.32 0.02 . 1 . . . . 10 THR HG2 . 15539 1 74 . 1 1 13 13 THR CA C 13 58.8 0.2 . 1 . . . . 10 THR CA . 15539 1 75 . 1 1 13 13 THR CB C 13 68.5 0.2 . 1 . . . . 10 THR CB . 15539 1 76 . 1 1 13 13 THR CG2 C 13 22.2 0.2 . 1 . . . . 10 THR CG2 . 15539 1 77 . 1 1 13 13 THR N N 15 111.5 0.2 . 1 . . . . 10 THR N . 15539 1 78 . 1 1 14 14 PRO C C 13 179.8 0.2 . 1 . . . . 11 PRO C . 15539 1 79 . 1 1 14 14 PRO CA C 13 65.1 0.2 . 1 . . . . 11 PRO CA . 15539 1 80 . 1 1 14 14 PRO CB C 13 31.0 0.2 . 1 . . . . 11 PRO CB . 15539 1 81 . 1 1 15 15 GLU H H 1 8.83 0.02 . 1 . . . . 12 GLU H . 15539 1 82 . 1 1 15 15 GLU HA H 1 4.10 0.02 . 1 . . . . 12 GLU HA . 15539 1 83 . 1 1 15 15 GLU C C 13 181.7 0.2 . 1 . . . . 12 GLU C . 15539 1 84 . 1 1 15 15 GLU CA C 13 59.8 0.2 . 1 . . . . 12 GLU CA . 15539 1 85 . 1 1 15 15 GLU CB C 13 27.9 0.2 . 1 . . . . 12 GLU CB . 15539 1 86 . 1 1 15 15 GLU CG C 13 36.6 0.2 . 1 . . . . 12 GLU CG . 15539 1 87 . 1 1 15 15 GLU N N 15 118.9 0.2 . 1 . . . . 12 GLU N . 15539 1 88 . 1 1 16 16 ALA H H 1 7.99 0.02 . 1 . . . . 13 ALA H . 15539 1 89 . 1 1 16 16 ALA HA H 1 4.32 0.02 . 1 . . . . 13 ALA HA . 15539 1 90 . 1 1 16 16 ALA HB1 H 1 1.54 0.02 . 1 . . . . 13 ALA HB . 15539 1 91 . 1 1 16 16 ALA HB2 H 1 1.54 0.02 . 1 . . . . 13 ALA HB . 15539 1 92 . 1 1 16 16 ALA HB3 H 1 1.54 0.02 . 1 . . . . 13 ALA HB . 15539 1 93 . 1 1 16 16 ALA C C 13 177.3 0.2 . 1 . . . . 13 ALA C . 15539 1 94 . 1 1 16 16 ALA CA C 13 54.6 0.2 . 1 . . . . 13 ALA CA . 15539 1 95 . 1 1 16 16 ALA CB C 13 17.9 0.2 . 1 . . . . 13 ALA CB . 15539 1 96 . 1 1 16 16 ALA N N 15 124.2 0.2 . 1 . . . . 13 ALA N . 15539 1 97 . 1 1 17 17 VAL H H 1 8.13 0.02 . 1 . . . . 14 VAL H . 15539 1 98 . 1 1 17 17 VAL HA H 1 4.50 0.02 . 1 . . . . 14 VAL HA . 15539 1 99 . 1 1 17 17 VAL C C 13 179.0 0.2 . 1 . . . . 14 VAL C . 15539 1 100 . 1 1 17 17 VAL CA C 13 66.8 0.2 . 1 . . . . 14 VAL CA . 15539 1 101 . 1 1 17 17 VAL CB C 13 31.0 0.2 . 1 . . . . 14 VAL CB . 15539 1 102 . 1 1 17 17 VAL N N 15 120.1 0.2 . 1 . . . . 14 VAL N . 15539 1 103 . 1 1 18 18 ALA H H 1 8.12 0.02 . 1 . . . . 15 ALA H . 15539 1 104 . 1 1 18 18 ALA HA H 1 4.66 0.02 . 1 . . . . 15 ALA HA . 15539 1 105 . 1 1 18 18 ALA HB1 H 1 1.66 0.02 . 1 . . . . 15 ALA HB . 15539 1 106 . 1 1 18 18 ALA HB2 H 1 1.66 0.02 . 1 . . . . 15 ALA HB . 15539 1 107 . 1 1 18 18 ALA HB3 H 1 1.66 0.02 . 1 . . . . 15 ALA HB . 15539 1 108 . 1 1 18 18 ALA C C 13 181.0 0.2 . 1 . . . . 15 ALA C . 15539 1 109 . 1 1 18 18 ALA CA C 13 55.1 0.2 . 1 . . . . 15 ALA CA . 15539 1 110 . 1 1 18 18 ALA CB C 13 17.2 0.2 . 1 . . . . 15 ALA CB . 15539 1 111 . 1 1 18 18 ALA N N 15 122.4 0.2 . 1 . . . . 15 ALA N . 15539 1 112 . 1 1 19 19 ASP H H 1 8.24 0.02 . 1 . . . . 16 ASP H . 15539 1 113 . 1 1 19 19 ASP HA H 1 4.50 0.02 . 1 . . . . 16 ASP HA . 15539 1 114 . 1 1 19 19 ASP HB2 H 1 2.91 0.02 . 1 . . . . 16 ASP HB2 . 15539 1 115 . 1 1 19 19 ASP HB3 H 1 2.77 0.02 . 1 . . . . 16 ASP HB3 . 15539 1 116 . 1 1 19 19 ASP C C 13 178.7 0.2 . 1 . . . . 16 ASP C . 15539 1 117 . 1 1 19 19 ASP CA C 13 57.2 0.2 . 1 . . . . 16 ASP CA . 15539 1 118 . 1 1 19 19 ASP CB C 13 41.0 0.2 . 1 . . . . 16 ASP CB . 15539 1 119 . 1 1 19 19 ASP N N 15 119.1 0.2 . 1 . . . . 16 ASP N . 15539 1 120 . 1 1 20 20 LEU H H 1 8.15 0.02 . 1 . . . . 17 LEU H . 15539 1 121 . 1 1 20 20 LEU C C 13 178.7 0.2 . 1 . . . . 17 LEU C . 15539 1 122 . 1 1 20 20 LEU CA C 13 57.6 0.2 . 1 . . . . 17 LEU CA . 15539 1 123 . 1 1 20 20 LEU CB C 13 46.0 0.2 . 1 . . . . 17 LEU CB . 15539 1 124 . 1 1 20 20 LEU N N 15 123.1 0.2 . 1 . . . . 17 LEU N . 15539 1 125 . 1 1 21 21 LYS H H 1 8.72 0.02 . 1 . . . . 18 LYS H . 15539 1 126 . 1 1 21 21 LYS C C 13 179.6 0.2 . 1 . . . . 18 LYS C . 15539 1 127 . 1 1 21 21 LYS CA C 13 60.5 0.2 . 1 . . . . 18 LYS CA . 15539 1 128 . 1 1 21 21 LYS CB C 13 31.6 0.2 . 1 . . . . 18 LYS CB . 15539 1 129 . 1 1 21 21 LYS N N 15 119.5 0.2 . 1 . . . . 18 LYS N . 15539 1 130 . 1 1 22 22 LYS H H 1 7.74 0.02 . 1 . . . . 19 LYS H . 15539 1 131 . 1 1 22 22 LYS C C 13 179.5 0.2 . 1 . . . . 19 LYS C . 15539 1 132 . 1 1 22 22 LYS CA C 13 59.8 0.2 . 1 . . . . 19 LYS CA . 15539 1 133 . 1 1 22 22 LYS CB C 13 31.6 0.2 . 1 . . . . 19 LYS CB . 15539 1 134 . 1 1 22 22 LYS N N 15 119.5 0.2 . 1 . . . . 19 LYS N . 15539 1 135 . 1 1 23 23 LYS H H 1 7.98 0.02 . 1 . . . . 20 LYS H . 15539 1 136 . 1 1 23 23 LYS HA H 1 4.07 0.02 . 1 . . . . 20 LYS HA . 15539 1 137 . 1 1 23 23 LYS HE2 H 1 3.02 0.02 . 2 . . . . 20 LYS HE2 . 15539 1 138 . 1 1 23 23 LYS HE3 H 1 3.02 0.02 . 2 . . . . 20 LYS HE3 . 15539 1 139 . 1 1 23 23 LYS C C 13 179.5 0.2 . 1 . . . . 20 LYS C . 15539 1 140 . 1 1 23 23 LYS CA C 13 59.5 0.2 . 1 . . . . 20 LYS CA . 15539 1 141 . 1 1 23 23 LYS CB C 13 32.2 0.2 . 1 . . . . 20 LYS CB . 15539 1 142 . 1 1 23 23 LYS N N 15 121.7 0.2 . 1 . . . . 20 LYS N . 15539 1 143 . 1 1 24 24 VAL H H 1 8.71 0.02 . 1 . . . . 21 VAL H . 15539 1 144 . 1 1 24 24 VAL C C 13 177.3 0.2 . 1 . . . . 21 VAL C . 15539 1 145 . 1 1 24 24 VAL CA C 13 66.8 0.2 . 1 . . . . 21 VAL CA . 15539 1 146 . 1 1 24 24 VAL CB C 13 31.0 0.2 . 1 . . . . 21 VAL CB . 15539 1 147 . 1 1 24 24 VAL N N 15 120.2 0.2 . 1 . . . . 21 VAL N . 15539 1 148 . 1 1 25 25 ARG H H 1 7.96 0.02 . 1 . . . . 22 ARG H . 15539 1 149 . 1 1 25 25 ARG C C 13 179.8 0.2 . 1 . . . . 22 ARG C . 15539 1 150 . 1 1 25 25 ARG CA C 13 59.8 0.2 . 1 . . . . 22 ARG CA . 15539 1 151 . 1 1 25 25 ARG CB C 13 29.1 0.2 . 1 . . . . 22 ARG CB . 15539 1 152 . 1 1 25 25 ARG N N 15 120.1 0.2 . 1 . . . . 22 ARG N . 15539 1 153 . 1 1 26 26 LYS C C 13 179.8 0.2 . 1 . . . . 23 LYS C . 15539 1 154 . 1 1 26 26 LYS CA C 13 59.0 0.2 . 1 . . . . 23 LYS CA . 15539 1 155 . 1 1 26 26 LYS CB C 13 31.6 0.2 . 1 . . . . 23 LYS CB . 15539 1 156 . 1 1 26 26 LYS N N 15 119.9 0.2 . 1 . . . . 23 LYS N . 15539 1 157 . 1 1 27 27 LEU H H 1 8.46 0.02 . 1 . . . . 24 LEU H . 15539 1 158 . 1 1 27 27 LEU C C 13 178.7 0.2 . 1 . . . . 24 LEU C . 15539 1 159 . 1 1 27 27 LEU CA C 13 57.2 0.2 . 1 . . . . 24 LEU CA . 15539 1 160 . 1 1 27 27 LEU CB C 13 41.6 0.2 . 1 . . . . 24 LEU CB . 15539 1 161 . 1 1 27 27 LEU CD1 C 13 24.1 0.2 . 2 . . . . 24 LEU CD1 . 15539 1 162 . 1 1 27 27 LEU CD2 C 13 24.1 0.2 . 2 . . . . 24 LEU CD2 . 15539 1 163 . 1 1 27 27 LEU N N 15 121.9 0.2 . 1 . . . . 24 LEU N . 15539 1 164 . 1 1 28 28 ASN H H 1 9.03 0.02 . 1 . . . . 25 ASN H . 15539 1 165 . 1 1 28 28 ASN CA C 13 56.5 0.2 . 1 . . . . 25 ASN CA . 15539 1 166 . 1 1 28 28 ASN CB C 13 38.5 0.2 . 1 . . . . 25 ASN CB . 15539 1 167 . 1 1 28 28 ASN N N 15 119.1 0.2 . 1 . . . . 25 ASN N . 15539 1 168 . 1 1 29 29 SER H H 1 7.73 0.02 . 1 . . . . 26 SER H . 15539 1 169 . 1 1 29 29 SER C C 13 177.3 0.2 . 1 . . . . 26 SER C . 15539 1 170 . 1 1 29 29 SER CA C 13 61.4 0.2 . 1 . . . . 26 SER CA . 15539 1 171 . 1 1 29 29 SER CB C 13 62.3 0.2 . 1 . . . . 26 SER CB . 15539 1 172 . 1 1 29 29 SER N N 15 115.7 0.2 . 1 . . . . 26 SER N . 15539 1 173 . 1 1 30 30 LYS H H 1 7.72 0.02 . 1 . . . . 27 LYS H . 15539 1 174 . 1 1 30 30 LYS C C 13 178.7 0.2 . 1 . . . . 27 LYS C . 15539 1 175 . 1 1 30 30 LYS CA C 13 58.6 0.2 . 1 . . . . 27 LYS CA . 15539 1 176 . 1 1 30 30 LYS CB C 13 31.6 0.2 . 1 . . . . 27 LYS CB . 15539 1 177 . 1 1 30 30 LYS N N 15 124.0 0.2 . 1 . . . . 27 LYS N . 15539 1 178 . 1 1 31 31 ALA H H 1 8.97 0.02 . 1 . . . . 28 ALA H . 15539 1 179 . 1 1 31 31 ALA C C 13 179.2 0.2 . 1 . . . . 28 ALA C . 15539 1 180 . 1 1 31 31 ALA CA C 13 55.1 0.2 . 1 . . . . 28 ALA CA . 15539 1 181 . 1 1 31 31 ALA CB C 13 16.6 0.2 . 1 . . . . 28 ALA CB . 15539 1 182 . 1 1 31 31 ALA N N 15 123.2 0.2 . 1 . . . . 28 ALA N . 15539 1 183 . 1 1 32 32 GLY H H 1 7.92 0.02 . 1 . . . . 29 GLY H . 15539 1 184 . 1 1 32 32 GLY C C 13 176.8 0.2 . 1 . . . . 29 GLY C . 15539 1 185 . 1 1 32 32 GLY CA C 13 47.3 0.2 . 1 . . . . 29 GLY CA . 15539 1 186 . 1 1 32 32 GLY N N 15 104.2 0.2 . 1 . . . . 29 GLY N . 15539 1 187 . 1 1 33 33 GLN H H 1 7.60 0.02 . 1 . . . . 30 GLN H . 15539 1 188 . 1 1 33 33 GLN C C 13 178.2 0.2 . 1 . . . . 30 GLN C . 15539 1 189 . 1 1 33 33 GLN CA C 13 58.8 0.2 . 1 . . . . 30 GLN CA . 15539 1 190 . 1 1 33 33 GLN CB C 13 27.9 0.2 . 1 . . . . 30 GLN CB . 15539 1 191 . 1 1 33 33 GLN N N 15 122.2 0.2 . 1 . . . . 30 GLN N . 15539 1 192 . 1 1 34 34 MET H H 1 8.37 0.02 . 1 . . . . 31 MET H . 15539 1 193 . 1 1 34 34 MET C C 13 179.0 0.2 . 1 . . . . 31 MET C . 15539 1 194 . 1 1 34 34 MET CA C 13 57.6 0.2 . 1 . . . . 31 MET CA . 15539 1 195 . 1 1 34 34 MET CB C 13 31.0 0.2 . 1 . . . . 31 MET CB . 15539 1 196 . 1 1 34 34 MET N N 15 119.0 0.2 . 1 . . . . 31 MET N . 15539 1 197 . 1 1 35 35 LYS H H 1 8.75 0.02 . 1 . . . . 32 LYS H . 15539 1 198 . 1 1 35 35 LYS C C 13 177.9 0.2 . 1 . . . . 32 LYS C . 15539 1 199 . 1 1 35 35 LYS CA C 13 60.0 0.2 . 1 . . . . 32 LYS CA . 15539 1 200 . 1 1 35 35 LYS CB C 13 31.6 0.2 . 1 . . . . 32 LYS CB . 15539 1 201 . 1 1 35 35 LYS N N 15 120.4 0.2 . 1 . . . . 32 LYS N . 15539 1 202 . 1 1 36 36 MET H H 1 7.51 0.02 . 1 . . . . 33 MET H . 15539 1 203 . 1 1 36 36 MET C C 13 178.4 0.2 . 1 . . . . 33 MET C . 15539 1 204 . 1 1 36 36 MET CA C 13 58.1 0.2 . 1 . . . . 33 MET CA . 15539 1 205 . 1 1 36 36 MET CB C 13 31.0 0.2 . 1 . . . . 33 MET CB . 15539 1 206 . 1 1 36 36 MET N N 15 118.5 0.2 . 1 . . . . 33 MET N . 15539 1 207 . 1 1 37 37 ASP H H 1 8.63 0.02 . 1 . . . . 34 ASP H . 15539 1 208 . 1 1 37 37 ASP C C 13 177.1 0.2 . 1 . . . . 34 ASP C . 15539 1 209 . 1 1 37 37 ASP CA C 13 57.4 0.2 . 1 . . . . 34 ASP CA . 15539 1 210 . 1 1 37 37 ASP CB C 13 39.1 0.2 . 1 . . . . 34 ASP CB . 15539 1 211 . 1 1 37 37 ASP N N 15 121.2 0.2 . 1 . . . . 34 ASP N . 15539 1 212 . 1 1 38 38 LEU H H 1 8.11 0.02 . 1 . . . . 35 LEU H . 15539 1 213 . 1 1 38 38 LEU N N 15 123.0 0.2 . 1 . . . . 35 LEU N . 15539 1 214 . 1 1 39 39 HIS H H 1 8.53 0.2 . 1 . . . . 36 HIS H . 15539 1 215 . 1 1 39 39 HIS N N 15 119.7 0.2 . 1 . . . . 36 HIS N . 15539 1 216 . 1 1 40 40 ASP H H 1 8.65 0.02 . 1 . . . . 37 ASP H . 15539 1 217 . 1 1 40 40 ASP C C 13 177.3 0.2 . 1 . . . . 37 ASP C . 15539 1 218 . 1 1 40 40 ASP CA C 13 54.1 0.2 . 1 . . . . 37 ASP CA . 15539 1 219 . 1 1 40 40 ASP CB C 13 40.4 0.2 . 1 . . . . 37 ASP CB . 15539 1 220 . 1 1 40 40 ASP N N 15 119.7 0.2 . 1 . . . . 37 ASP N . 15539 1 221 . 1 1 41 41 LEU H H 1 8.38 0.02 . 1 . . . . 38 LEU H . 15539 1 222 . 1 1 41 41 LEU C C 13 178.2 0.2 . 1 . . . . 38 LEU C . 15539 1 223 . 1 1 41 41 LEU CA C 13 52.7 0.2 . 1 . . . . 38 LEU CA . 15539 1 224 . 1 1 41 41 LEU CB C 13 40.4 0.2 . 1 . . . . 38 LEU CB . 15539 1 225 . 1 1 41 41 LEU N N 15 119.1 0.2 . 1 . . . . 38 LEU N . 15539 1 226 . 1 1 42 42 ALA H H 1 8.63 0.02 . 1 . . . . 39 ALA H . 15539 1 227 . 1 1 42 42 ALA C C 13 177.6 0.2 . 1 . . . . 39 ALA C . 15539 1 228 . 1 1 42 42 ALA CA C 13 54.7 0.2 . 1 . . . . 39 ALA CA . 15539 1 229 . 1 1 42 42 ALA CB C 13 16.6 0.2 . 1 . . . . 39 ALA CB . 15539 1 230 . 1 1 42 42 ALA N N 15 120.5 0.2 . 1 . . . . 39 ALA N . 15539 1 231 . 1 1 43 43 GLU H H 1 8.16 0.02 . 1 . . . . 40 GLU H . 15539 1 232 . 1 1 43 43 GLU C C 13 178.2 0.2 . 1 . . . . 40 GLU C . 15539 1 233 . 1 1 43 43 GLU CA C 13 58.2 0.2 . 1 . . . . 40 GLU CA . 15539 1 234 . 1 1 43 43 GLU CB C 13 29.7 0.2 . 1 . . . . 40 GLU CB . 15539 1 235 . 1 1 43 43 GLU N N 15 114.8 0.2 . 1 . . . . 40 GLU N . 15539 1 236 . 1 1 44 44 GLY H H 1 7.49 0.02 . 1 . . . . 41 GLY H . 15539 1 237 . 1 1 44 44 GLY C C 13 175.6 0.2 . 1 . . . . 41 GLY C . 15539 1 238 . 1 1 44 44 GLY CA C 13 45.5 0.2 . 1 . . . . 41 GLY CA . 15539 1 239 . 1 1 44 44 GLY N N 15 103.5 0.2 . 1 . . . . 41 GLY N . 15539 1 240 . 1 1 45 45 LEU H H 1 7.11 0.02 . 1 . . . . 42 LEU H . 15539 1 241 . 1 1 45 45 LEU CA C 13 54.1 0.2 . 1 . . . . 42 LEU CA . 15539 1 242 . 1 1 45 45 LEU CB C 13 39.1 0.2 . 1 . . . . 42 LEU CB . 15539 1 243 . 1 1 45 45 LEU N N 15 121.0 0.2 . 1 . . . . 42 LEU N . 15539 1 244 . 1 1 46 46 PRO C C 13 175.9 0.2 . 1 . . . . 43 PRO C . 15539 1 245 . 1 1 46 46 PRO CA C 13 63.3 0.2 . 1 . . . . 43 PRO CA . 15539 1 246 . 1 1 46 46 PRO CB C 13 34.7 0.2 . 1 . . . . 43 PRO CB . 15539 1 247 . 1 1 47 47 THR H H 1 8.97 0.02 . 1 . . . . 44 THR H . 15539 1 248 . 1 1 47 47 THR C C 13 174.8 0.2 . 1 . . . . 44 THR C . 15539 1 249 . 1 1 47 47 THR CA C 13 65.6 0.2 . 1 . . . . 44 THR CA . 15539 1 250 . 1 1 47 47 THR CB C 13 67.9 0.2 . 1 . . . . 44 THR CB . 15539 1 251 . 1 1 47 47 THR CG2 C 13 21.7 0.2 . 1 . . . . 44 THR CG2 . 15539 1 252 . 1 1 47 47 THR N N 15 123.2 0.2 . 1 . . . . 44 THR N . 15539 1 253 . 1 1 48 48 ASP H H 1 9.23 0.02 . 1 . . . . 45 ASP H . 15539 1 254 . 1 1 48 48 ASP CA C 13 56.0 0.2 . 1 . . . . 45 ASP CA . 15539 1 255 . 1 1 48 48 ASP CB C 13 38.5 0.2 . 1 . . . . 45 ASP CB . 15539 1 256 . 1 1 48 48 ASP N N 15 122.1 0.2 . 1 . . . . 45 ASP N . 15539 1 257 . 1 1 49 49 TYR H H 1 7.73 0.02 . 1 . . . . 46 TYR H . 15539 1 258 . 1 1 49 49 TYR C C 13 177.3 0.2 . 1 . . . . 46 TYR C . 15539 1 259 . 1 1 49 49 TYR CA C 13 60.5 0.2 . 1 . . . . 46 TYR CA . 15539 1 260 . 1 1 49 49 TYR CB C 13 36.0 0.2 . 1 . . . . 46 TYR CB . 15539 1 261 . 1 1 49 49 TYR N N 15 115.7 0.2 . 1 . . . . 46 TYR N . 15539 1 262 . 1 1 50 50 GLU H H 1 9.00 0.2 . 1 . . . . 47 GLU H . 15539 1 263 . 1 1 50 50 GLU C C 13 177.1 0.2 . 1 . . . . 47 GLU C . 15539 1 264 . 1 1 50 50 GLU CA C 13 58.6 0.2 . 1 . . . . 47 GLU CA . 15539 1 265 . 1 1 50 50 GLU CB C 13 27.9 0.2 . 1 . . . . 47 GLU CB . 15539 1 266 . 1 1 50 50 GLU CG C 13 36.0 0.2 . 1 . . . . 47 GLU CG . 15539 1 267 . 1 1 50 50 GLU N N 15 120.9 0.2 . 1 . . . . 47 GLU N . 15539 1 268 . 1 1 51 51 ASN H H 1 7.98 0.02 . 1 . . . . 48 ASN H . 15539 1 269 . 1 1 51 51 ASN C C 13 176.7 0.2 . 1 . . . . 48 ASN C . 15539 1 270 . 1 1 51 51 ASN CA C 13 52.7 0.2 . 1 . . . . 48 ASN CA . 15539 1 271 . 1 1 51 51 ASN CB C 13 38.5 0.2 . 1 . . . . 48 ASN CB . 15539 1 272 . 1 1 51 51 ASN N N 15 116.7 0.2 . 1 . . . . 48 ASN N . 15539 1 273 . 1 1 52 52 LEU H H 1 7.77 0.02 . 1 . . . . 49 LEU H . 15539 1 274 . 1 1 52 52 LEU C C 13 177.4 0.2 . 1 . . . . 49 LEU C . 15539 1 275 . 1 1 52 52 LEU CA C 13 59.0 0.2 . 1 . . . . 49 LEU CA . 15539 1 276 . 1 1 52 52 LEU CB C 13 43.5 0.2 . 1 . . . . 49 LEU CB . 15539 1 277 . 1 1 52 52 LEU N N 15 123.4 0.2 . 1 . . . . 49 LEU N . 15539 1 278 . 1 1 53 53 VAL H H 1 8.88 0.02 . 1 . . . . 50 VAL H . 15539 1 279 . 1 1 53 53 VAL C C 13 177.6 0.2 . 1 . . . . 50 VAL C . 15539 1 280 . 1 1 53 53 VAL CA C 13 67.7 0.2 . 1 . . . . 50 VAL CA . 15539 1 281 . 1 1 53 53 VAL CB C 13 30.4 0.2 . 1 . . . . 50 VAL CB . 15539 1 282 . 1 1 53 53 VAL CG1 C 13 22.9 0.2 . 2 . . . . 50 VAL CG1 . 15539 1 283 . 1 1 53 53 VAL CG2 C 13 21.0 0.2 . 2 . . . . 50 VAL CG2 . 15539 1 284 . 1 1 53 53 VAL N N 15 119.7 0.2 . 1 . . . . 50 VAL N . 15539 1 285 . 1 1 54 54 GLU H H 1 8.82 0.02 . 1 . . . . 51 GLU H . 15539 1 286 . 1 1 54 54 GLU C C 13 179.3 0.2 . 1 . . . . 51 GLU C . 15539 1 287 . 1 1 54 54 GLU CA C 13 59.0 0.2 . 1 . . . . 51 GLU CA . 15539 1 288 . 1 1 54 54 GLU CB C 13 28.5 0.2 . 1 . . . . 51 GLU CB . 15539 1 289 . 1 1 54 54 GLU CG C 13 36.3 0.2 . 1 . . . . 51 GLU CG . 15539 1 290 . 1 1 54 54 GLU N N 15 120.2 0.2 . 1 . . . . 51 GLU N . 15539 1 291 . 1 1 55 55 THR H H 1 7.65 0.02 . 1 . . . . 52 THR H . 15539 1 292 . 1 1 55 55 THR C C 13 177.6 0.2 . 1 . . . . 52 THR C . 15539 1 293 . 1 1 55 55 THR CA C 13 66.8 0.2 . 1 . . . . 52 THR CA . 15539 1 294 . 1 1 55 55 THR CB C 13 67.3 0.2 . 1 . . . . 52 THR CB . 15539 1 295 . 1 1 55 55 THR N N 15 114.5 0.2 . 1 . . . . 52 THR N . 15539 1 296 . 1 1 56 56 ALA H H 1 8.80 0.02 . 1 . . . . 53 ALA H . 15539 1 297 . 1 1 56 56 ALA C C 13 178.5 0.2 . 1 . . . . 53 ALA C . 15539 1 298 . 1 1 56 56 ALA CA C 13 56.0 0.2 . 1 . . . . 53 ALA CA . 15539 1 299 . 1 1 56 56 ALA CB C 13 18.5 0.2 . 1 . . . . 53 ALA CB . 15539 1 300 . 1 1 56 56 ALA N N 15 127.6 0.2 . 1 . . . . 53 ALA N . 15539 1 301 . 1 1 57 57 GLU H H 1 9.27 0.02 . 1 . . . . 54 GLU H . 15539 1 302 . 1 1 57 57 GLU C C 13 179.2 0.2 . 1 . . . . 54 GLU C . 15539 1 303 . 1 1 57 57 GLU CA C 13 60.0 0.2 . 1 . . . . 54 GLU CA . 15539 1 304 . 1 1 57 57 GLU CB C 13 29.1 0.2 . 1 . . . . 54 GLU CB . 15539 1 305 . 1 1 57 57 GLU CG C 13 36.8 0.2 . 1 . . . . 54 GLU CG . 15539 1 306 . 1 1 57 57 GLU N N 15 120.1 0.2 . 1 . . . . 54 GLU N . 15539 1 307 . 1 1 58 58 LYS H H 1 8.12 0.02 . 1 . . . . 55 LYS H . 15539 1 308 . 1 1 58 58 LYS C C 13 179.5 0.2 . 1 . . . . 55 LYS C . 15539 1 309 . 1 1 58 58 LYS CA C 13 59.0 0.2 . 1 . . . . 55 LYS CA . 15539 1 310 . 1 1 58 58 LYS CB C 13 31.6 0.2 . 1 . . . . 55 LYS CB . 15539 1 311 . 1 1 58 58 LYS N N 15 118.7 0.2 . 1 . . . . 55 LYS N . 15539 1 312 . 1 1 59 59 THR H H 1 8.02 0.02 . 1 . . . . 56 THR H . 15539 1 313 . 1 1 59 59 THR C C 13 175.7 0.2 . 1 . . . . 56 THR C . 15539 1 314 . 1 1 59 59 THR CA C 13 67.3 0.2 . 1 . . . . 56 THR CA . 15539 1 315 . 1 1 59 59 THR N N 15 117.0 0.2 . 1 . . . . 56 THR N . 15539 1 316 . 1 1 60 60 TYR H H 1 9.13 0.02 . 1 . . . . 57 TYR H . 15539 1 317 . 1 1 60 60 TYR C C 13 177.0 0.2 . 1 . . . . 57 TYR C . 15539 1 318 . 1 1 60 60 TYR CA C 13 62.4 0.2 . 1 . . . . 57 TYR CA . 15539 1 319 . 1 1 60 60 TYR CB C 13 37.9 0.2 . 1 . . . . 57 TYR CB . 15539 1 320 . 1 1 60 60 TYR N N 15 123.5 0.2 . 1 . . . . 57 TYR N . 15539 1 321 . 1 1 61 61 GLU H H 1 8.23 0.2 . 1 . . . . 58 GLU H . 15539 1 322 . 1 1 61 61 GLU C C 13 179.8 0.2 . 1 . . . . 58 GLU C . 15539 1 323 . 1 1 61 61 GLU CA C 13 59.0 0.2 . 1 . . . . 58 GLU CA . 15539 1 324 . 1 1 61 61 GLU CB C 13 29.1 0.2 . 1 . . . . 58 GLU CB . 15539 1 325 . 1 1 61 61 GLU N N 15 116.6 0.2 . 1 . . . . 58 GLU N . 15539 1 326 . 1 1 62 62 ILE H H 1 7.43 0.02 . 1 . . . . 59 ILE H . 15539 1 327 . 1 1 62 62 ILE HA H 1 4.05 0.02 . 1 . . . . 59 ILE HA . 15539 1 328 . 1 1 62 62 ILE HB H 1 1.97 0.02 . 1 . . . . 59 ILE HB . 15539 1 329 . 1 1 62 62 ILE HD11 H 1 0.74 0.02 . 1 . . . . 59 ILE HD1 . 15539 1 330 . 1 1 62 62 ILE HD12 H 1 0.74 0.02 . 1 . . . . 59 ILE HD1 . 15539 1 331 . 1 1 62 62 ILE HD13 H 1 0.74 0.02 . 1 . . . . 59 ILE HD1 . 15539 1 332 . 1 1 62 62 ILE HG12 H 1 1.55 0.02 . 2 . . . . 59 ILE HG12 . 15539 1 333 . 1 1 62 62 ILE HG13 H 1 1.34 0.02 . 2 . . . . 59 ILE HG13 . 15539 1 334 . 1 1 62 62 ILE HG21 H 1 0.87 0.02 . 1 . . . . 59 ILE HG2 . 15539 1 335 . 1 1 62 62 ILE HG22 H 1 0.87 0.02 . 1 . . . . 59 ILE HG2 . 15539 1 336 . 1 1 62 62 ILE HG23 H 1 0.87 0.02 . 1 . . . . 59 ILE HG2 . 15539 1 337 . 1 1 62 62 ILE C C 13 177.0 0.2 . 1 . . . . 59 ILE C . 15539 1 338 . 1 1 62 62 ILE CA C 13 63.0 0.2 . 1 . . . . 59 ILE CA . 15539 1 339 . 1 1 62 62 ILE CB C 13 36.6 0.2 . 1 . . . . 59 ILE CB . 15539 1 340 . 1 1 62 62 ILE CD1 C 13 13.1 0.2 . 1 . . . . 59 ILE CD1 . 15539 1 341 . 1 1 62 62 ILE CG1 C 13 29.4 0.2 . 1 . . . . 59 ILE CG1 . 15539 1 342 . 1 1 62 62 ILE CG2 C 13 17.2 0.2 . 1 . . . . 59 ILE CG2 . 15539 1 343 . 1 1 62 62 ILE N N 15 119.5 0.2 . 1 . . . . 59 ILE N . 15539 1 344 . 1 1 63 63 PHE H H 1 7.91 0.2 . 1 . . . . 60 PHE H . 15539 1 345 . 1 1 63 63 PHE C C 13 178.2 0.2 . 1 . . . . 60 PHE C . 15539 1 346 . 1 1 63 63 PHE CA C 13 63.7 0.2 . 1 . . . . 60 PHE CA . 15539 1 347 . 1 1 63 63 PHE CB C 13 37.9 0.2 . 1 . . . . 60 PHE CB . 15539 1 348 . 1 1 63 63 PHE N N 15 119.1 0.2 . 1 . . . . 60 PHE N . 15539 1 349 . 1 1 64 64 ARG H H 1 8.78 0.02 . 1 . . . . 61 ARG H . 15539 1 350 . 1 1 64 64 ARG C C 13 178.2 0.2 . 1 . . . . 61 ARG C . 15539 1 351 . 1 1 64 64 ARG CA C 13 58.6 0.2 . 1 . . . . 61 ARG CA . 15539 1 352 . 1 1 64 64 ARG CB C 13 28.5 0.2 . 1 . . . . 61 ARG CB . 15539 1 353 . 1 1 64 64 ARG N N 15 122.9 0.2 . 1 . . . . 61 ARG N . 15539 1 354 . 1 1 65 65 GLU H H 1 7.72 0.02 . 1 . . . . 62 GLU H . 15539 1 355 . 1 1 65 65 GLU C C 13 178.7 0.2 . 1 . . . . 62 GLU C . 15539 1 356 . 1 1 65 65 GLU CA C 13 59.0 0.2 . 1 . . . . 62 GLU CA . 15539 1 357 . 1 1 65 65 GLU CB C 13 28.5 0.2 . 1 . . . . 62 GLU CB . 15539 1 358 . 1 1 65 65 GLU N N 15 121.4 0.2 . 1 . . . . 62 GLU N . 15539 1 359 . 1 1 66 66 LEU H H 1 8.30 0.02 . 1 . . . . 63 LEU H . 15539 1 360 . 1 1 66 66 LEU C C 13 177.4 0.2 . 1 . . . . 63 LEU C . 15539 1 361 . 1 1 66 66 LEU CA C 13 57.9 0.2 . 1 . . . . 63 LEU CA . 15539 1 362 . 1 1 66 66 LEU CB C 13 41.6 0.2 . 1 . . . . 63 LEU CB . 15539 1 363 . 1 1 66 66 LEU CD1 C 13 22.9 0.2 . 2 . . . . 63 LEU CD1 . 15539 1 364 . 1 1 66 66 LEU CD2 C 13 22.9 0.2 . 2 . . . . 63 LEU CD2 . 15539 1 365 . 1 1 66 66 LEU CG C 13 24.3 0.2 . 1 . . . . 63 LEU CG . 15539 1 366 . 1 1 66 66 LEU N N 15 119.5 0.2 . 1 . . . . 63 LEU N . 15539 1 367 . 1 1 67 67 ASP H H 1 7.89 0.02 . 1 . . . . 64 ASP H . 15539 1 368 . 1 1 67 67 ASP C C 13 178.5 0.2 . 1 . . . . 64 ASP C . 15539 1 369 . 1 1 67 67 ASP CA C 13 56.9 0.2 . 1 . . . . 64 ASP CA . 15539 1 370 . 1 1 67 67 ASP CB C 13 41.6 0.2 . 1 . . . . 64 ASP CB . 15539 1 371 . 1 1 67 67 ASP N N 15 118.2 0.2 . 1 . . . . 64 ASP N . 15539 1 372 . 1 1 68 68 GLN H H 1 7.81 0.02 . 1 . . . . 65 GLN H . 15539 1 373 . 1 1 68 68 GLN C C 13 177.4 0.2 . 1 . . . . 65 GLN C . 15539 1 374 . 1 1 68 68 GLN CA C 13 58.6 0.2 . 1 . . . . 65 GLN CA . 15539 1 375 . 1 1 68 68 GLN CB C 13 27.9 0.2 . 1 . . . . 65 GLN CB . 15539 1 376 . 1 1 68 68 GLN N N 15 115.9 0.2 . 1 . . . . 65 GLN N . 15539 1 377 . 1 1 69 69 LEU H H 1 8.59 0.02 . 1 . . . . 66 LEU H . 15539 1 378 . 1 1 69 69 LEU C C 13 178.7 0.2 . 1 . . . . 66 LEU C . 15539 1 379 . 1 1 69 69 LEU CA C 13 57.4 0.2 . 1 . . . . 66 LEU CA . 15539 1 380 . 1 1 69 69 LEU CB C 13 41.0 0.2 . 1 . . . . 66 LEU CB . 15539 1 381 . 1 1 69 69 LEU N N 15 120.7 0.2 . 1 . . . . 66 LEU N . 15539 1 382 . 1 1 70 70 LYS H H 1 8.72 0.02 . 1 . . . . 67 LYS H . 15539 1 383 . 1 1 70 70 LYS C C 13 179.8 0.2 . 1 . . . . 67 LYS C . 15539 1 384 . 1 1 70 70 LYS CA C 13 60.0 0.2 . 1 . . . . 67 LYS CA . 15539 1 385 . 1 1 70 70 LYS CB C 13 31.6 0.2 . 1 . . . . 67 LYS CB . 15539 1 386 . 1 1 70 70 LYS N N 15 119.5 0.2 . 1 . . . . 67 LYS N . 15539 1 387 . 1 1 71 71 LYS H H 1 7.90 0.02 . 1 . . . . 68 LYS H . 15539 1 388 . 1 1 71 71 LYS C C 13 179.0 0.2 . 1 . . . . 68 LYS C . 15539 1 389 . 1 1 71 71 LYS CA C 13 59.5 0.2 . 1 . . . . 68 LYS CA . 15539 1 390 . 1 1 71 71 LYS CB C 13 31.0 0.2 . 1 . . . . 68 LYS CB . 15539 1 391 . 1 1 71 71 LYS N N 15 119.9 0.2 . 1 . . . . 68 LYS N . 15539 1 392 . 1 1 72 72 LYS H H 1 7.48 0.02 . 1 . . . . 69 LYS H . 15539 1 393 . 1 1 72 72 LYS CA C 13 58.8 0.2 . 1 . . . . 69 LYS CA . 15539 1 394 . 1 1 72 72 LYS CB C 13 31.0 0.2 . 1 . . . . 69 LYS CB . 15539 1 395 . 1 1 72 72 LYS N N 15 120.6 0.2 . 1 . . . . 69 LYS N . 15539 1 396 . 1 1 73 73 LEU H H 1 8.62 0.02 . 1 . . . . 70 LEU H . 15539 1 397 . 1 1 73 73 LEU C C 13 174.2 0.2 . 1 . . . . 70 LEU C . 15539 1 398 . 1 1 73 73 LEU CA C 13 57.6 0.2 . 1 . . . . 70 LEU CA . 15539 1 399 . 1 1 73 73 LEU CB C 13 40.4 0.2 . 1 . . . . 70 LEU CB . 15539 1 400 . 1 1 73 73 LEU CD1 C 13 23.2 0.2 . 2 . . . . 70 LEU CD1 . 15539 1 401 . 1 1 73 73 LEU CD2 C 13 23.2 0.2 . 2 . . . . 70 LEU CD2 . 15539 1 402 . 1 1 73 73 LEU CG C 13 26.2 0.2 . 1 . . . . 70 LEU CG . 15539 1 403 . 1 1 73 73 LEU N N 15 122.1 0.2 . 1 . . . . 70 LEU N . 15539 1 404 . 1 1 74 74 ASN H H 1 8.04 0.02 . 1 . . . . 71 ASN H . 15539 1 405 . 1 1 74 74 ASN C C 13 177.9 0.2 . 1 . . . . 71 ASN C . 15539 1 406 . 1 1 74 74 ASN CA C 13 56.2 0.2 . 1 . . . . 71 ASN CA . 15539 1 407 . 1 1 74 74 ASN CB C 13 38.5 0.2 . 1 . . . . 71 ASN CB . 15539 1 408 . 1 1 74 74 ASN N N 15 116.4 0.2 . 1 . . . . 71 ASN N . 15539 1 409 . 1 1 75 75 ILE H H 1 7.63 0.02 . 1 . . . . 72 ILE H . 15539 1 410 . 1 1 75 75 ILE HA H 1 3.99 0.02 . 1 . . . . 72 ILE HA . 15539 1 411 . 1 1 75 75 ILE HB H 1 2.08 0.02 . 1 . . . . 72 ILE HB . 15539 1 412 . 1 1 75 75 ILE HD11 H 1 0.94 0.02 . 1 . . . . 72 ILE HD1 . 15539 1 413 . 1 1 75 75 ILE HD12 H 1 0.94 0.02 . 1 . . . . 72 ILE HD1 . 15539 1 414 . 1 1 75 75 ILE HD13 H 1 0.94 0.02 . 1 . . . . 72 ILE HD1 . 15539 1 415 . 1 1 75 75 ILE HG12 H 1 1.78 0.02 . 2 . . . . 72 ILE HG12 . 15539 1 416 . 1 1 75 75 ILE HG13 H 1 1.28 0.02 . 2 . . . . 72 ILE HG13 . 15539 1 417 . 1 1 75 75 ILE HG21 H 1 1.07 0.02 . 1 . . . . 72 ILE HG2 . 15539 1 418 . 1 1 75 75 ILE HG22 H 1 1.07 0.02 . 1 . . . . 72 ILE HG2 . 15539 1 419 . 1 1 75 75 ILE HG23 H 1 1.07 0.02 . 1 . . . . 72 ILE HG2 . 15539 1 420 . 1 1 75 75 ILE C C 13 179.6 0.2 . 1 . . . . 72 ILE C . 15539 1 421 . 1 1 75 75 ILE CA C 13 64.2 0.2 . 1 . . . . 72 ILE CA . 15539 1 422 . 1 1 75 75 ILE CB C 13 37.2 0.2 . 1 . . . . 72 ILE CB . 15539 1 423 . 1 1 75 75 ILE CD1 C 13 12.3 0.2 . 1 . . . . 72 ILE CD1 . 15539 1 424 . 1 1 75 75 ILE CG2 C 13 17.3 0.2 . 1 . . . . 72 ILE CG2 . 15539 1 425 . 1 1 75 75 ILE N N 15 119.7 0.2 . 1 . . . . 72 ILE N . 15539 1 426 . 1 1 76 76 TRP H H 1 8.89 0.02 . 1 . . . . 73 TRP H . 15539 1 427 . 1 1 76 76 TRP HD1 H 1 7.53 0.02 . 1 . . . . 73 TRP HD1 . 15539 1 428 . 1 1 76 76 TRP HE1 H 1 10.20 0.02 . 1 . . . . 73 TRP HE1 . 15539 1 429 . 1 1 76 76 TRP HZ2 H 1 7.10 0.02 . 1 . . . . 73 TRP HZ2 . 15539 1 430 . 1 1 76 76 TRP C C 13 179.0 0.2 . 1 . . . . 73 TRP C . 15539 1 431 . 1 1 76 76 TRP CA C 13 59.0 0.2 . 1 . . . . 73 TRP CA . 15539 1 432 . 1 1 76 76 TRP CB C 13 29.1 0.2 . 1 . . . . 73 TRP CB . 15539 1 433 . 1 1 76 76 TRP N N 15 122.5 0.2 . 1 . . . . 73 TRP N . 15539 1 434 . 1 1 76 76 TRP NE1 N 15 128.0 0.2 . 1 . . . . 73 TRP NE1 . 15539 1 435 . 1 1 77 77 GLU H H 1 9.18 0.02 . 1 . . . . 74 GLU H . 15539 1 436 . 1 1 77 77 GLU C C 13 179.2 0.2 . 1 . . . . 74 GLU C . 15539 1 437 . 1 1 77 77 GLU CA C 13 59.8 0.2 . 1 . . . . 74 GLU CA . 15539 1 438 . 1 1 77 77 GLU CB C 13 29.1 0.2 . 1 . . . . 74 GLU CB . 15539 1 439 . 1 1 77 77 GLU N N 15 118.5 0.2 . 1 . . . . 74 GLU N . 15539 1 440 . 1 1 78 78 GLU H H 1 7.84 0.02 . 1 . . . . 75 GLU H . 15539 1 441 . 1 1 78 78 GLU HA H 1 4.37 0.02 . 1 . . . . 75 GLU HA . 15539 1 442 . 1 1 78 78 GLU C C 13 178.4 0.2 . 1 . . . . 75 GLU C . 15539 1 443 . 1 1 78 78 GLU CA C 13 58.1 0.2 . 1 . . . . 75 GLU CA . 15539 1 444 . 1 1 78 78 GLU CB C 13 29.1 0.2 . 1 . . . . 75 GLU CB . 15539 1 445 . 1 1 78 78 GLU CG C 13 36.1 0.2 . 1 . . . . 75 GLU CG . 15539 1 446 . 1 1 78 78 GLU N N 15 118.6 0.2 . 1 . . . . 75 GLU N . 15539 1 447 . 1 1 79 79 THR H H 1 7.88 0.02 . 1 . . . . 76 THR H . 15539 1 448 . 1 1 79 79 THR HA H 1 4.48 0.02 . 1 . . . . 76 THR HA . 15539 1 449 . 1 1 79 79 THR HB H 1 4.32 0.02 . 1 . . . . 76 THR HB . 15539 1 450 . 1 1 79 79 THR HG21 H 1 1.26 0.02 . 1 . . . . 76 THR HG2 . 15539 1 451 . 1 1 79 79 THR HG22 H 1 1.26 0.02 . 1 . . . . 76 THR HG2 . 15539 1 452 . 1 1 79 79 THR HG23 H 1 1.26 0.02 . 1 . . . . 76 THR HG2 . 15539 1 453 . 1 1 79 79 THR C C 13 175.3 0.2 . 1 . . . . 76 THR C . 15539 1 454 . 1 1 79 79 THR CA C 13 63.7 0.2 . 1 . . . . 76 THR CA . 15539 1 455 . 1 1 79 79 THR CB C 13 69.1 0.2 . 1 . . . . 76 THR CB . 15539 1 456 . 1 1 79 79 THR CG2 C 13 21.0 0.2 . 1 . . . . 76 THR CG2 . 15539 1 457 . 1 1 79 79 THR N N 15 111.7 0.2 . 1 . . . . 76 THR N . 15539 1 458 . 1 1 80 80 LEU H H 1 7.48 0.02 . 1 . . . . 77 LEU H . 15539 1 459 . 1 1 80 80 LEU HA H 1 4.39 0.02 . 1 . . . . 77 LEU HA . 15539 1 460 . 1 1 80 80 LEU C C 13 176.3 0.2 . 1 . . . . 77 LEU C . 15539 1 461 . 1 1 80 80 LEU CA C 13 54.8 0.2 . 1 . . . . 77 LEU CA . 15539 1 462 . 1 1 80 80 LEU CB C 13 41.6 0.2 . 1 . . . . 77 LEU CB . 15539 1 463 . 1 1 80 80 LEU CD1 C 13 22.3 0.2 . 2 . . . . 77 LEU CD1 . 15539 1 464 . 1 1 80 80 LEU CD2 C 13 22.3 0.2 . 2 . . . . 77 LEU CD2 . 15539 1 465 . 1 1 80 80 LEU CG C 13 24.8 0.2 . 1 . . . . 77 LEU CG . 15539 1 466 . 1 1 80 80 LEU N N 15 121.7 0.2 . 1 . . . . 77 LEU N . 15539 1 467 . 1 1 81 81 LYS H H 1 7.44 0.02 . 1 . . . . 78 LYS H . 15539 1 468 . 1 1 81 81 LYS HA H 1 4.14 0.02 . 1 . . . . 78 LYS HA . 15539 1 469 . 1 1 81 81 LYS HB2 H 1 1.86 0.02 . 2 . . . . 78 LYS HB2 . 15539 1 470 . 1 1 81 81 LYS HB3 H 1 1.86 0.02 . 2 . . . . 78 LYS HB3 . 15539 1 471 . 1 1 81 81 LYS CA C 13 57.9 0.2 . 1 . . . . 78 LYS CA . 15539 1 472 . 1 1 81 81 LYS CB C 13 32.9 0.2 . 1 . . . . 78 LYS CB . 15539 1 473 . 1 1 81 81 LYS N N 15 126.4 0.2 . 1 . . . . 78 LYS N . 15539 1 stop_ save_