################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34513 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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 0.15 _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 '2D 1H-15N HSQC' . . . 34513 1 2 '3D HNCA' . . . 34513 1 3 '3D HN(CO)CA' . . . 34513 1 4 '3D HNCACB' . . . 34513 1 5 '3D HNCO' . . . 34513 1 6 '2D 1H-13C HSQC' . . . 34513 1 7 '2D 1H-15N HSQC' . . . 34513 1 8 '2D 1H-13C HSQC' . . . 34513 1 9 '2D 1H-15N HSQC' . . . 34513 1 10 '3D HCCH-TOCSY' . . . 34513 1 11 '3D CBCA(CO)NH' . . . 34513 1 12 '3D HBHA(CO)NH' . . . 34513 1 13 '3D HN(COCA)CB' . . . 34513 1 14 '3D 1H-13C NOESY' . . . 34513 1 15 '2D 1H-13C HSQC' . . . 34513 1 16 '1D 1H' . . . 34513 1 17 '3D 1H-15N NOESY-HSQC' . . . 34513 1 18 '1H-13C NOESY-HSQC with 13C/15N filter in F1' . . . 34513 1 19 '2D 1H-13C HSQC' . . . 34513 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 GLY HA2 H 1 3.89 0.02 . 2 . . . 1 A 119 GLY HA2 . 34513 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.89 0.02 . 2 . . . 1 A 119 GLY HA3 . 34513 1 3 . 1 . 1 1 1 GLY CA C 13 43.57 0.25 . 1 . . . 1 A 119 GLY CA . 34513 1 4 . 1 . 1 2 2 SER HA H 1 4.54 0.02 . 1 . . . 1 A 120 SER HA . 34513 1 5 . 1 . 1 2 2 SER HB2 H 1 3.88 0.02 . 2 . . . 1 A 120 SER HB2 . 34513 1 6 . 1 . 1 2 2 SER HB3 H 1 3.88 0.02 . 2 . . . 1 A 120 SER HB3 . 34513 1 7 . 1 . 1 2 2 SER CA C 13 58.43 0.25 . 1 . . . 1 A 120 SER CA . 34513 1 8 . 1 . 1 2 2 SER CB C 13 63.80 0.25 . 1 . . . 1 A 120 SER CB . 34513 1 9 . 1 . 1 3 3 GLY HA2 H 1 4.04 0.02 . 2 . . . 1 A 121 GLY HA2 . 34513 1 10 . 1 . 1 3 3 GLY HA3 H 1 4.05 0.02 . 2 . . . 1 A 121 GLY HA3 . 34513 1 11 . 1 . 1 3 3 GLY CA C 13 45.16 0.25 . 1 . . . 1 A 121 GLY CA . 34513 1 12 . 1 . 1 4 4 SER HA H 1 4.50 0.02 . 1 . . . 1 A 122 SER HA . 34513 1 13 . 1 . 1 4 4 SER HB2 H 1 3.92 0.02 . 2 . . . 1 A 122 SER HB2 . 34513 1 14 . 1 . 1 4 4 SER HB3 H 1 3.92 0.02 . 2 . . . 1 A 122 SER HB3 . 34513 1 15 . 1 . 1 4 4 SER CA C 13 58.46 0.25 . 1 . . . 1 A 122 SER CA . 34513 1 16 . 1 . 1 4 4 SER CB C 13 63.70 0.25 . 1 . . . 1 A 122 SER CB . 34513 1 17 . 1 . 1 5 5 GLY HA2 H 1 4.04 0.02 . 2 . . . 1 A 123 GLY HA2 . 34513 1 18 . 1 . 1 5 5 GLY HA3 H 1 4.05 0.02 . 2 . . . 1 A 123 GLY HA3 . 34513 1 19 . 1 . 1 5 5 GLY CA C 13 45.15 0.25 . 1 . . . 1 A 123 GLY CA . 34513 1 20 . 1 . 1 6 6 SER HA H 1 4.50 0.02 . 1 . . . 1 A 124 SER HA . 34513 1 21 . 1 . 1 6 6 SER HB2 H 1 3.93 0.02 . 1 . . . 1 A 124 SER HB2 . 34513 1 22 . 1 . 1 6 6 SER HB3 H 1 3.93 0.02 . 1 . . . 1 A 124 SER HB3 . 34513 1 23 . 1 . 1 6 6 SER CA C 13 58.47 0.25 . 1 . . . 1 A 124 SER CA . 34513 1 24 . 1 . 1 6 6 SER CB C 13 63.84 0.25 . 1 . . . 1 A 124 SER CB . 34513 1 25 . 1 . 1 7 7 GLY H H 1 8.57 0.02 . 1 . . . 1 A 125 GLY H . 34513 1 26 . 1 . 1 7 7 GLY HA2 H 1 4.06 0.02 . 2 . . . 1 A 125 GLY HA2 . 34513 1 27 . 1 . 1 7 7 GLY HA3 H 1 4.05 0.02 . 2 . . . 1 A 125 GLY HA3 . 34513 1 28 . 1 . 1 7 7 GLY CA C 13 45.26 0.25 . 1 . . . 1 A 125 GLY CA . 34513 1 29 . 1 . 1 7 7 GLY N N 15 111.11 0.15 . 1 . . . 1 A 125 GLY N . 34513 1 30 . 1 . 1 8 8 SER H H 1 8.33 0.02 . 1 . . . 1 A 126 SER H . 34513 1 31 . 1 . 1 8 8 SER HA H 1 4.58 0.02 . 1 . . . 1 A 126 SER HA . 34513 1 32 . 1 . 1 8 8 SER HB2 H 1 3.95 0.02 . 2 . . . 1 A 126 SER HB2 . 34513 1 33 . 1 . 1 8 8 SER HB3 H 1 3.88 0.02 . 2 . . . 1 A 126 SER HB3 . 34513 1 34 . 1 . 1 8 8 SER CA C 13 58.12 0.25 . 1 . . . 1 A 126 SER CA . 34513 1 35 . 1 . 1 8 8 SER CB C 13 63.93 0.25 . 1 . . . 1 A 126 SER CB . 34513 1 36 . 1 . 1 8 8 SER N N 15 115.92 0.15 . 1 . . . 1 A 126 SER N . 34513 1 37 . 1 . 1 9 9 THR HA H 1 4.35 0.02 . 1 . . . 1 A 127 THR HA . 34513 1 38 . 1 . 1 9 9 THR HB H 1 4.28 0.02 . 1 . . . 1 A 127 THR HB . 34513 1 39 . 1 . 1 9 9 THR HG21 H 1 1.24 0.02 . 1 . . . 1 A 127 THR HG21 . 34513 1 40 . 1 . 1 9 9 THR HG22 H 1 1.24 0.02 . 1 . . . 1 A 127 THR HG22 . 34513 1 41 . 1 . 1 9 9 THR HG23 H 1 1.24 0.02 . 1 . . . 1 A 127 THR HG23 . 34513 1 42 . 1 . 1 9 9 THR CA C 13 62.49 0.25 . 1 . . . 1 A 127 THR CA . 34513 1 43 . 1 . 1 9 9 THR CB C 13 69.56 0.25 . 1 . . . 1 A 127 THR CB . 34513 1 44 . 1 . 1 9 9 THR CG2 C 13 21.63 0.25 . 1 . . . 1 A 127 THR CG2 . 34513 1 45 . 1 . 1 10 10 ASN HA H 1 4.68 0.02 . 1 . . . 1 A 128 ASN HA . 34513 1 46 . 1 . 1 10 10 ASN HB2 H 1 2.84 0.02 . 2 . . . 1 A 128 ASN HB2 . 34513 1 47 . 1 . 1 10 10 ASN HB3 H 1 2.79 0.02 . 2 . . . 1 A 128 ASN HB3 . 34513 1 48 . 1 . 1 10 10 ASN HD21 H 1 7.64 0.02 . 1 . . . 1 A 128 ASN HD21 . 34513 1 49 . 1 . 1 10 10 ASN HD22 H 1 6.96 0.02 . 1 . . . 1 A 128 ASN HD22 . 34513 1 50 . 1 . 1 10 10 ASN C C 13 175.59 0.25 . 1 . . . 1 A 128 ASN C . 34513 1 51 . 1 . 1 10 10 ASN CA C 13 54.01 0.25 . 1 . . . 1 A 128 ASN CA . 34513 1 52 . 1 . 1 10 10 ASN CB C 13 38.64 0.25 . 1 . . . 1 A 128 ASN CB . 34513 1 53 . 1 . 1 10 10 ASN ND2 N 15 112.58 0.15 . 1 . . . 1 A 128 ASN ND2 . 34513 1 54 . 1 . 1 11 11 ASP H H 1 8.30 0.02 . 1 . . . 1 A 129 ASP H . 34513 1 55 . 1 . 1 11 11 ASP HA H 1 4.57 0.02 . 1 . . . 1 A 129 ASP HA . 34513 1 56 . 1 . 1 11 11 ASP HB2 H 1 2.72 0.02 . 2 . . . 1 A 129 ASP HB2 . 34513 1 57 . 1 . 1 11 11 ASP HB3 H 1 2.70 0.02 . 2 . . . 1 A 129 ASP HB3 . 34513 1 58 . 1 . 1 11 11 ASP C C 13 176.63 0.25 . 1 . . . 1 A 129 ASP C . 34513 1 59 . 1 . 1 11 11 ASP CA C 13 55.09 0.25 . 1 . . . 1 A 129 ASP CA . 34513 1 60 . 1 . 1 11 11 ASP CB C 13 40.75 0.25 . 1 . . . 1 A 129 ASP CB . 34513 1 61 . 1 . 1 11 11 ASP N N 15 120.77 0.15 . 1 . . . 1 A 129 ASP N . 34513 1 62 . 1 . 1 12 12 ASN H H 1 8.28 0.02 . 1 . . . 1 A 130 ASN H . 34513 1 63 . 1 . 1 12 12 ASN HA H 1 4.62 0.02 . 1 . . . 1 A 130 ASN HA . 34513 1 64 . 1 . 1 12 12 ASN HB2 H 1 2.94 0.02 . 2 . . . 1 A 130 ASN HB2 . 34513 1 65 . 1 . 1 12 12 ASN HB3 H 1 2.87 0.02 . 2 . . . 1 A 130 ASN HB3 . 34513 1 66 . 1 . 1 12 12 ASN HD21 H 1 6.99 0.02 . 1 . . . 1 A 130 ASN HD21 . 34513 1 67 . 1 . 1 12 12 ASN HD22 H 1 7.65 0.02 . 1 . . . 1 A 130 ASN HD22 . 34513 1 68 . 1 . 1 12 12 ASN C C 13 176.64 0.25 . 1 . . . 1 A 130 ASN C . 34513 1 69 . 1 . 1 12 12 ASN CA C 13 54.39 0.25 . 1 . . . 1 A 130 ASN CA . 34513 1 70 . 1 . 1 12 12 ASN CB C 13 38.47 0.25 . 1 . . . 1 A 130 ASN CB . 34513 1 71 . 1 . 1 12 12 ASN N N 15 119.10 0.15 . 1 . . . 1 A 130 ASN N . 34513 1 72 . 1 . 1 12 12 ASN ND2 N 15 112.56 0.15 . 1 . . . 1 A 130 ASN ND2 . 34513 1 73 . 1 . 1 13 13 ILE H H 1 8.26 0.02 . 1 . . . 1 A 131 ILE H . 34513 1 74 . 1 . 1 13 13 ILE HA H 1 3.70 0.02 . 1 . . . 1 A 131 ILE HA . 34513 1 75 . 1 . 1 13 13 ILE HB H 1 1.98 0.02 . 1 . . . 1 A 131 ILE HB . 34513 1 76 . 1 . 1 13 13 ILE HG12 H 1 1.07 0.02 . 2 . . . 1 A 131 ILE HG12 . 34513 1 77 . 1 . 1 13 13 ILE HG13 H 1 1.66 0.02 . 2 . . . 1 A 131 ILE HG13 . 34513 1 78 . 1 . 1 13 13 ILE HG21 H 1 0.86 0.02 . 1 . . . 1 A 131 ILE HG21 . 34513 1 79 . 1 . 1 13 13 ILE HG22 H 1 0.86 0.02 . 1 . . . 1 A 131 ILE HG22 . 34513 1 80 . 1 . 1 13 13 ILE HG23 H 1 0.86 0.02 . 1 . . . 1 A 131 ILE HG23 . 34513 1 81 . 1 . 1 13 13 ILE HD11 H 1 0.88 0.02 . 1 . . . 1 A 131 ILE HD11 . 34513 1 82 . 1 . 1 13 13 ILE HD12 H 1 0.88 0.02 . 1 . . . 1 A 131 ILE HD12 . 34513 1 83 . 1 . 1 13 13 ILE HD13 H 1 0.88 0.02 . 1 . . . 1 A 131 ILE HD13 . 34513 1 84 . 1 . 1 13 13 ILE C C 13 177.48 0.25 . 1 . . . 1 A 131 ILE C . 34513 1 85 . 1 . 1 13 13 ILE CA C 13 64.77 0.25 . 1 . . . 1 A 131 ILE CA . 34513 1 86 . 1 . 1 13 13 ILE CB C 13 37.68 0.25 . 1 . . . 1 A 131 ILE CB . 34513 1 87 . 1 . 1 13 13 ILE CG1 C 13 29.02 0.25 . 1 . . . 1 A 131 ILE CG1 . 34513 1 88 . 1 . 1 13 13 ILE CG2 C 13 17.06 0.25 . 1 . . . 1 A 131 ILE CG2 . 34513 1 89 . 1 . 1 13 13 ILE CD1 C 13 13.10 0.25 . 1 . . . 1 A 131 ILE CD1 . 34513 1 90 . 1 . 1 13 13 ILE N N 15 120.69 0.15 . 1 . . . 1 A 131 ILE N . 34513 1 91 . 1 . 1 14 14 THR H H 1 8.33 0.02 . 1 . . . 1 A 132 THR H . 34513 1 92 . 1 . 1 14 14 THR HA H 1 3.62 0.02 . 1 . . . 1 A 132 THR HA . 34513 1 93 . 1 . 1 14 14 THR HB H 1 4.16 0.02 . 1 . . . 1 A 132 THR HB . 34513 1 94 . 1 . 1 14 14 THR HG21 H 1 1.19 0.02 . 1 . . . 1 A 132 THR HG21 . 34513 1 95 . 1 . 1 14 14 THR HG22 H 1 1.19 0.02 . 1 . . . 1 A 132 THR HG22 . 34513 1 96 . 1 . 1 14 14 THR HG23 H 1 1.19 0.02 . 1 . . . 1 A 132 THR HG23 . 34513 1 97 . 1 . 1 14 14 THR C C 13 175.61 0.25 . 1 . . . 1 A 132 THR C . 34513 1 98 . 1 . 1 14 14 THR CA C 13 67.34 0.25 . 1 . . . 1 A 132 THR CA . 34513 1 99 . 1 . 1 14 14 THR CB C 13 67.59 0.25 . 1 . . . 1 A 132 THR CB . 34513 1 100 . 1 . 1 14 14 THR CG2 C 13 22.38 0.25 . 1 . . . 1 A 132 THR CG2 . 34513 1 101 . 1 . 1 14 14 THR N N 15 115.78 0.15 . 1 . . . 1 A 132 THR N . 34513 1 102 . 1 . 1 15 15 ALA H H 1 7.91 0.02 . 1 . . . 1 A 133 ALA H . 34513 1 103 . 1 . 1 15 15 ALA HA H 1 4.21 0.02 . 1 . . . 1 A 133 ALA HA . 34513 1 104 . 1 . 1 15 15 ALA HB1 H 1 1.49 0.02 . 1 . . . 1 A 133 ALA HB1 . 34513 1 105 . 1 . 1 15 15 ALA HB2 H 1 1.49 0.02 . 1 . . . 1 A 133 ALA HB2 . 34513 1 106 . 1 . 1 15 15 ALA HB3 H 1 1.49 0.02 . 1 . . . 1 A 133 ALA HB3 . 34513 1 107 . 1 . 1 15 15 ALA C C 13 181.10 0.25 . 1 . . . 1 A 133 ALA C . 34513 1 108 . 1 . 1 15 15 ALA CA C 13 55.09 0.25 . 1 . . . 1 A 133 ALA CA . 34513 1 109 . 1 . 1 15 15 ALA CB C 13 18.07 0.25 . 1 . . . 1 A 133 ALA CB . 34513 1 110 . 1 . 1 15 15 ALA N N 15 122.23 0.15 . 1 . . . 1 A 133 ALA N . 34513 1 111 . 1 . 1 16 16 ARG H H 1 7.56 0.02 . 1 . . . 1 A 134 ARG H . 34513 1 112 . 1 . 1 16 16 ARG HA H 1 4.03 0.02 . 1 . . . 1 A 134 ARG HA . 34513 1 113 . 1 . 1 16 16 ARG HB2 H 1 1.87 0.02 . 2 . . . 1 A 134 ARG HB2 . 34513 1 114 . 1 . 1 16 16 ARG HB3 H 1 2.02 0.02 . 2 . . . 1 A 134 ARG HB3 . 34513 1 115 . 1 . 1 16 16 ARG HG2 H 1 1.72 0.02 . 2 . . . 1 A 134 ARG HG2 . 34513 1 116 . 1 . 1 16 16 ARG HG3 H 1 1.92 0.02 . 2 . . . 1 A 134 ARG HG3 . 34513 1 117 . 1 . 1 16 16 ARG HD2 H 1 3.18 0.02 . 2 . . . 1 A 134 ARG HD2 . 34513 1 118 . 1 . 1 16 16 ARG HD3 H 1 3.16 0.02 . 2 . . . 1 A 134 ARG HD3 . 34513 1 119 . 1 . 1 16 16 ARG C C 13 179.82 0.25 . 1 . . . 1 A 134 ARG C . 34513 1 120 . 1 . 1 16 16 ARG CA C 13 58.48 0.25 . 1 . . . 1 A 134 ARG CA . 34513 1 121 . 1 . 1 16 16 ARG CB C 13 30.44 0.25 . 1 . . . 1 A 134 ARG CB . 34513 1 122 . 1 . 1 16 16 ARG CG C 13 27.97 0.25 . 1 . . . 1 A 134 ARG CG . 34513 1 123 . 1 . 1 16 16 ARG CD C 13 42.01 0.25 . 1 . . . 1 A 134 ARG CD . 34513 1 124 . 1 . 1 16 16 ARG N N 15 116.65 0.15 . 1 . . . 1 A 134 ARG N . 34513 1 125 . 1 . 1 17 17 LEU H H 1 8.31 0.02 . 1 . . . 1 A 135 LEU H . 34513 1 126 . 1 . 1 17 17 LEU HA H 1 4.06 0.02 . 1 . . . 1 A 135 LEU HA . 34513 1 127 . 1 . 1 17 17 LEU HB2 H 1 2.04 0.02 . 2 . . . 1 A 135 LEU HB2 . 34513 1 128 . 1 . 1 17 17 LEU HB3 H 1 1.28 0.02 . 2 . . . 1 A 135 LEU HB3 . 34513 1 129 . 1 . 1 17 17 LEU HG H 1 1.93 0.02 . 1 . . . 1 A 135 LEU HG . 34513 1 130 . 1 . 1 17 17 LEU HD11 H 1 0.80 0.02 . 2 . . . 1 A 135 LEU HD11 . 34513 1 131 . 1 . 1 17 17 LEU HD12 H 1 0.80 0.02 . 2 . . . 1 A 135 LEU HD12 . 34513 1 132 . 1 . 1 17 17 LEU HD13 H 1 0.80 0.02 . 2 . . . 1 A 135 LEU HD13 . 34513 1 133 . 1 . 1 17 17 LEU HD21 H 1 0.69 0.02 . 2 . . . 1 A 135 LEU HD21 . 34513 1 134 . 1 . 1 17 17 LEU HD22 H 1 0.69 0.02 . 2 . . . 1 A 135 LEU HD22 . 34513 1 135 . 1 . 1 17 17 LEU HD23 H 1 0.69 0.02 . 2 . . . 1 A 135 LEU HD23 . 34513 1 136 . 1 . 1 17 17 LEU C C 13 178.41 0.25 . 1 . . . 1 A 135 LEU C . 34513 1 137 . 1 . 1 17 17 LEU CA C 13 57.90 0.25 . 1 . . . 1 A 135 LEU CA . 34513 1 138 . 1 . 1 17 17 LEU CB C 13 40.73 0.25 . 1 . . . 1 A 135 LEU CB . 34513 1 139 . 1 . 1 17 17 LEU CG C 13 25.99 0.25 . 1 . . . 1 A 135 LEU CG . 34513 1 140 . 1 . 1 17 17 LEU CD1 C 13 27.11 0.25 . 2 . . . 1 A 135 LEU CD1 . 34513 1 141 . 1 . 1 17 17 LEU CD2 C 13 22.71 0.25 . 2 . . . 1 A 135 LEU CD2 . 34513 1 142 . 1 . 1 17 17 LEU N N 15 119.99 0.15 . 1 . . . 1 A 135 LEU N . 34513 1 143 . 1 . 1 18 18 ASP H H 1 8.70 0.02 . 1 . . . 1 A 136 ASP H . 34513 1 144 . 1 . 1 18 18 ASP HA H 1 4.30 0.02 . 1 . . . 1 A 136 ASP HA . 34513 1 145 . 1 . 1 18 18 ASP HB2 H 1 2.90 0.02 . 2 . . . 1 A 136 ASP HB2 . 34513 1 146 . 1 . 1 18 18 ASP HB3 H 1 2.72 0.02 . 2 . . . 1 A 136 ASP HB3 . 34513 1 147 . 1 . 1 18 18 ASP C C 13 178.84 0.25 . 1 . . . 1 A 136 ASP C . 34513 1 148 . 1 . 1 18 18 ASP CA C 13 57.74 0.25 . 1 . . . 1 A 136 ASP CA . 34513 1 149 . 1 . 1 18 18 ASP CB C 13 39.43 0.25 . 1 . . . 1 A 136 ASP CB . 34513 1 150 . 1 . 1 18 18 ASP N N 15 120.89 0.15 . 1 . . . 1 A 136 ASP N . 34513 1 151 . 1 . 1 19 19 ARG H H 1 7.66 0.02 . 1 . . . 1 A 137 ARG H . 34513 1 152 . 1 . 1 19 19 ARG HA H 1 4.21 0.02 . 1 . . . 1 A 137 ARG HA . 34513 1 153 . 1 . 1 19 19 ARG HB2 H 1 2.00 0.02 . 2 . . . 1 A 137 ARG HB2 . 34513 1 154 . 1 . 1 19 19 ARG HB3 H 1 2.06 0.02 . 2 . . . 1 A 137 ARG HB3 . 34513 1 155 . 1 . 1 19 19 ARG HG2 H 1 1.84 0.02 . 2 . . . 1 A 137 ARG HG2 . 34513 1 156 . 1 . 1 19 19 ARG HG3 H 1 1.83 0.02 . 2 . . . 1 A 137 ARG HG3 . 34513 1 157 . 1 . 1 19 19 ARG HD2 H 1 3.25 0.02 . 2 . . . 1 A 137 ARG HD2 . 34513 1 158 . 1 . 1 19 19 ARG HD3 H 1 3.31 0.02 . 2 . . . 1 A 137 ARG HD3 . 34513 1 159 . 1 . 1 19 19 ARG C C 13 179.15 0.25 . 1 . . . 1 A 137 ARG C . 34513 1 160 . 1 . 1 19 19 ARG CA C 13 59.14 0.25 . 1 . . . 1 A 137 ARG CA . 34513 1 161 . 1 . 1 19 19 ARG CB C 13 30.45 0.25 . 1 . . . 1 A 137 ARG CB . 34513 1 162 . 1 . 1 19 19 ARG CG C 13 26.99 0.25 . 1 . . . 1 A 137 ARG CG . 34513 1 163 . 1 . 1 19 19 ARG CD C 13 43.69 0.25 . 1 . . . 1 A 137 ARG CD . 34513 1 164 . 1 . 1 19 19 ARG N N 15 120.11 0.15 . 1 . . . 1 A 137 ARG N . 34513 1 165 . 1 . 1 20 20 ILE H H 1 7.87 0.02 . 1 . . . 1 A 138 ILE H . 34513 1 166 . 1 . 1 20 20 ILE HA H 1 3.58 0.02 . 1 . . . 1 A 138 ILE HA . 34513 1 167 . 1 . 1 20 20 ILE HB H 1 2.06 0.02 . 1 . . . 1 A 138 ILE HB . 34513 1 168 . 1 . 1 20 20 ILE HG12 H 1 1.90 0.02 . 2 . . . 1 A 138 ILE HG12 . 34513 1 169 . 1 . 1 20 20 ILE HG13 H 1 1.01 0.02 . 2 . . . 1 A 138 ILE HG13 . 34513 1 170 . 1 . 1 20 20 ILE HG21 H 1 0.89 0.02 . 1 . . . 1 A 138 ILE HG21 . 34513 1 171 . 1 . 1 20 20 ILE HG22 H 1 0.89 0.02 . 1 . . . 1 A 138 ILE HG22 . 34513 1 172 . 1 . 1 20 20 ILE HG23 H 1 0.89 0.02 . 1 . . . 1 A 138 ILE HG23 . 34513 1 173 . 1 . 1 20 20 ILE HD11 H 1 0.89 0.02 . 1 . . . 1 A 138 ILE HD11 . 34513 1 174 . 1 . 1 20 20 ILE HD12 H 1 0.89 0.02 . 1 . . . 1 A 138 ILE HD12 . 34513 1 175 . 1 . 1 20 20 ILE HD13 H 1 0.89 0.02 . 1 . . . 1 A 138 ILE HD13 . 34513 1 176 . 1 . 1 20 20 ILE C C 13 177.21 0.25 . 1 . . . 1 A 138 ILE C . 34513 1 177 . 1 . 1 20 20 ILE CA C 13 65.92 0.25 . 1 . . . 1 A 138 ILE CA . 34513 1 178 . 1 . 1 20 20 ILE CB C 13 38.12 0.25 . 1 . . . 1 A 138 ILE CB . 34513 1 179 . 1 . 1 20 20 ILE CG1 C 13 30.39 0.25 . 1 . . . 1 A 138 ILE CG1 . 34513 1 180 . 1 . 1 20 20 ILE CG2 C 13 16.22 0.25 . 1 . . . 1 A 138 ILE CG2 . 34513 1 181 . 1 . 1 20 20 ILE CD1 C 13 14.62 0.25 . 1 . . . 1 A 138 ILE CD1 . 34513 1 182 . 1 . 1 20 20 ILE N N 15 121.67 0.15 . 1 . . . 1 A 138 ILE N . 34513 1 183 . 1 . 1 21 21 ASP H H 1 8.59 0.02 . 1 . . . 1 A 139 ASP H . 34513 1 184 . 1 . 1 21 21 ASP HA H 1 4.30 0.02 . 1 . . . 1 A 139 ASP HA . 34513 1 185 . 1 . 1 21 21 ASP HB2 H 1 2.77 0.02 . 2 . . . 1 A 139 ASP HB2 . 34513 1 186 . 1 . 1 21 21 ASP HB3 H 1 2.80 0.02 . 2 . . . 1 A 139 ASP HB3 . 34513 1 187 . 1 . 1 21 21 ASP C C 13 179.15 0.25 . 1 . . . 1 A 139 ASP C . 34513 1 188 . 1 . 1 21 21 ASP CA C 13 58.14 0.25 . 1 . . . 1 A 139 ASP CA . 34513 1 189 . 1 . 1 21 21 ASP CB C 13 41.42 0.25 . 1 . . . 1 A 139 ASP CB . 34513 1 190 . 1 . 1 21 21 ASP N N 15 120.50 0.15 . 1 . . . 1 A 139 ASP N . 34513 1 191 . 1 . 1 22 22 GLU H H 1 8.03 0.02 . 1 . . . 1 A 140 GLU H . 34513 1 192 . 1 . 1 22 22 GLU HA H 1 4.12 0.02 . 1 . . . 1 A 140 GLU HA . 34513 1 193 . 1 . 1 22 22 GLU HB2 H 1 2.31 0.02 . 2 . . . 1 A 140 GLU HB2 . 34513 1 194 . 1 . 1 22 22 GLU HB3 H 1 2.17 0.02 . 2 . . . 1 A 140 GLU HB3 . 34513 1 195 . 1 . 1 22 22 GLU HG2 H 1 2.50 0.02 . 2 . . . 1 A 140 GLU HG2 . 34513 1 196 . 1 . 1 22 22 GLU HG3 H 1 2.32 0.02 . 2 . . . 1 A 140 GLU HG3 . 34513 1 197 . 1 . 1 22 22 GLU C C 13 180.13 0.25 . 1 . . . 1 A 140 GLU C . 34513 1 198 . 1 . 1 22 22 GLU CA C 13 59.48 0.25 . 1 . . . 1 A 140 GLU CA . 34513 1 199 . 1 . 1 22 22 GLU CB C 13 29.55 0.25 . 1 . . . 1 A 140 GLU CB . 34513 1 200 . 1 . 1 22 22 GLU CG C 13 36.15 0.25 . 1 . . . 1 A 140 GLU CG . 34513 1 201 . 1 . 1 22 22 GLU N N 15 119.48 0.15 . 1 . . . 1 A 140 GLU N . 34513 1 202 . 1 . 1 23 23 LYS H H 1 8.17 0.02 . 1 . . . 1 A 141 LYS H . 34513 1 203 . 1 . 1 23 23 LYS HA H 1 4.25 0.02 . 1 . . . 1 A 141 LYS HA . 34513 1 204 . 1 . 1 23 23 LYS HB2 H 1 1.68 0.02 . 2 . . . 1 A 141 LYS HB2 . 34513 1 205 . 1 . 1 23 23 LYS HB3 H 1 2.20 0.02 . 2 . . . 1 A 141 LYS HB3 . 34513 1 206 . 1 . 1 23 23 LYS HG2 H 1 1.52 0.02 . 2 . . . 1 A 141 LYS HG2 . 34513 1 207 . 1 . 1 23 23 LYS HG3 H 1 1.84 0.02 . 2 . . . 1 A 141 LYS HG3 . 34513 1 208 . 1 . 1 23 23 LYS HD2 H 1 1.57 0.02 . 2 . . . 1 A 141 LYS HD2 . 34513 1 209 . 1 . 1 23 23 LYS HD3 H 1 1.61 0.02 . 2 . . . 1 A 141 LYS HD3 . 34513 1 210 . 1 . 1 23 23 LYS HE2 H 1 2.93 0.02 . 2 . . . 1 A 141 LYS HE2 . 34513 1 211 . 1 . 1 23 23 LYS HE3 H 1 2.87 0.02 . 2 . . . 1 A 141 LYS HE3 . 34513 1 212 . 1 . 1 23 23 LYS C C 13 179.54 0.25 . 1 . . . 1 A 141 LYS C . 34513 1 213 . 1 . 1 23 23 LYS CA C 13 59.55 0.25 . 1 . . . 1 A 141 LYS CA . 34513 1 214 . 1 . 1 23 23 LYS CB C 13 33.01 0.25 . 1 . . . 1 A 141 LYS CB . 34513 1 215 . 1 . 1 23 23 LYS CG C 13 26.02 0.25 . 1 . . . 1 A 141 LYS CG . 34513 1 216 . 1 . 1 23 23 LYS CD C 13 29.50 0.25 . 1 . . . 1 A 141 LYS CD . 34513 1 217 . 1 . 1 23 23 LYS CE C 13 42.10 0.25 . 1 . . . 1 A 141 LYS CE . 34513 1 218 . 1 . 1 23 23 LYS N N 15 120.83 0.15 . 1 . . . 1 A 141 LYS N . 34513 1 219 . 1 . 1 24 24 LEU H H 1 8.72 0.02 . 1 . . . 1 A 142 LEU H . 34513 1 220 . 1 . 1 24 24 LEU HA H 1 4.08 0.02 . 1 . . . 1 A 142 LEU HA . 34513 1 221 . 1 . 1 24 24 LEU HB2 H 1 1.24 0.02 . 2 . . . 1 A 142 LEU HB2 . 34513 1 222 . 1 . 1 24 24 LEU HB3 H 1 2.28 0.02 . 2 . . . 1 A 142 LEU HB3 . 34513 1 223 . 1 . 1 24 24 LEU HG H 1 2.05 0.02 . 1 . . . 1 A 142 LEU HG . 34513 1 224 . 1 . 1 24 24 LEU HD11 H 1 0.77 0.02 . 2 . . . 1 A 142 LEU HD11 . 34513 1 225 . 1 . 1 24 24 LEU HD12 H 1 0.77 0.02 . 2 . . . 1 A 142 LEU HD12 . 34513 1 226 . 1 . 1 24 24 LEU HD13 H 1 0.77 0.02 . 2 . . . 1 A 142 LEU HD13 . 34513 1 227 . 1 . 1 24 24 LEU HD21 H 1 1.03 0.02 . 2 . . . 1 A 142 LEU HD21 . 34513 1 228 . 1 . 1 24 24 LEU HD22 H 1 1.03 0.02 . 2 . . . 1 A 142 LEU HD22 . 34513 1 229 . 1 . 1 24 24 LEU HD23 H 1 1.03 0.02 . 2 . . . 1 A 142 LEU HD23 . 34513 1 230 . 1 . 1 24 24 LEU C C 13 179.10 0.25 . 1 . . . 1 A 142 LEU C . 34513 1 231 . 1 . 1 24 24 LEU CA C 13 58.36 0.25 . 1 . . . 1 A 142 LEU CA . 34513 1 232 . 1 . 1 24 24 LEU CB C 13 41.55 0.25 . 1 . . . 1 A 142 LEU CB . 34513 1 233 . 1 . 1 24 24 LEU CG C 13 26.44 0.25 . 1 . . . 1 A 142 LEU CG . 34513 1 234 . 1 . 1 24 24 LEU CD1 C 13 24.31 0.25 . 2 . . . 1 A 142 LEU CD1 . 34513 1 235 . 1 . 1 24 24 LEU CD2 C 13 28.87 0.25 . 2 . . . 1 A 142 LEU CD2 . 34513 1 236 . 1 . 1 24 24 LEU N N 15 118.95 0.15 . 1 . . . 1 A 142 LEU N . 34513 1 237 . 1 . 1 25 25 SER H H 1 8.18 0.02 . 1 . . . 1 A 143 SER H . 34513 1 238 . 1 . 1 25 25 SER HA H 1 4.26 0.02 . 1 . . . 1 A 143 SER HA . 34513 1 239 . 1 . 1 25 25 SER HB2 H 1 4.12 0.02 . 2 . . . 1 A 143 SER HB2 . 34513 1 240 . 1 . 1 25 25 SER HB3 H 1 4.02 0.02 . 2 . . . 1 A 143 SER HB3 . 34513 1 241 . 1 . 1 25 25 SER C C 13 177.17 0.25 . 1 . . . 1 A 143 SER C . 34513 1 242 . 1 . 1 25 25 SER CA C 13 62.47 0.25 . 1 . . . 1 A 143 SER CA . 34513 1 243 . 1 . 1 25 25 SER CB C 13 62.35 0.25 . 1 . . . 1 A 143 SER CB . 34513 1 244 . 1 . 1 25 25 SER N N 15 115.44 0.15 . 1 . . . 1 A 143 SER N . 34513 1 245 . 1 . 1 26 26 GLU H H 1 7.95 0.02 . 1 . . . 1 A 144 GLU H . 34513 1 246 . 1 . 1 26 26 GLU HA H 1 4.13 0.02 . 1 . . . 1 A 144 GLU HA . 34513 1 247 . 1 . 1 26 26 GLU HB2 H 1 2.27 0.02 . 2 . . . 1 A 144 GLU HB2 . 34513 1 248 . 1 . 1 26 26 GLU HB3 H 1 2.28 0.02 . 2 . . . 1 A 144 GLU HB3 . 34513 1 249 . 1 . 1 26 26 GLU HG2 H 1 2.21 0.02 . 2 . . . 1 A 144 GLU HG2 . 34513 1 250 . 1 . 1 26 26 GLU HG3 H 1 2.46 0.02 . 2 . . . 1 A 144 GLU HG3 . 34513 1 251 . 1 . 1 26 26 GLU C C 13 179.72 0.25 . 1 . . . 1 A 144 GLU C . 34513 1 252 . 1 . 1 26 26 GLU CA C 13 59.51 0.25 . 1 . . . 1 A 144 GLU CA . 34513 1 253 . 1 . 1 26 26 GLU CB C 13 29.61 0.25 . 1 . . . 1 A 144 GLU CB . 34513 1 254 . 1 . 1 26 26 GLU CG C 13 36.10 0.25 . 1 . . . 1 A 144 GLU CG . 34513 1 255 . 1 . 1 26 26 GLU N N 15 124.81 0.15 . 1 . . . 1 A 144 GLU N . 34513 1 256 . 1 . 1 27 27 ILE H H 1 8.55 0.02 . 1 . . . 1 A 145 ILE H . 34513 1 257 . 1 . 1 27 27 ILE HA H 1 3.49 0.02 . 1 . . . 1 A 145 ILE HA . 34513 1 258 . 1 . 1 27 27 ILE HB H 1 2.09 0.02 . 1 . . . 1 A 145 ILE HB . 34513 1 259 . 1 . 1 27 27 ILE HG12 H 1 0.76 0.02 . 1 . . . 1 A 145 ILE HG12 . 34513 1 260 . 1 . 1 27 27 ILE HG21 H 1 0.83 0.02 . 1 . . . 1 A 145 ILE HG21 . 34513 1 261 . 1 . 1 27 27 ILE HG22 H 1 0.83 0.02 . 1 . . . 1 A 145 ILE HG22 . 34513 1 262 . 1 . 1 27 27 ILE HG23 H 1 0.83 0.02 . 1 . . . 1 A 145 ILE HG23 . 34513 1 263 . 1 . 1 27 27 ILE HD11 H 1 0.90 0.02 . 1 . . . 1 A 145 ILE HD11 . 34513 1 264 . 1 . 1 27 27 ILE HD12 H 1 0.90 0.02 . 1 . . . 1 A 145 ILE HD12 . 34513 1 265 . 1 . 1 27 27 ILE HD13 H 1 0.90 0.02 . 1 . . . 1 A 145 ILE HD13 . 34513 1 266 . 1 . 1 27 27 ILE C C 13 177.35 0.25 . 1 . . . 1 A 145 ILE C . 34513 1 267 . 1 . 1 27 27 ILE CA C 13 65.77 0.25 . 1 . . . 1 A 145 ILE CA . 34513 1 268 . 1 . 1 27 27 ILE CB C 13 38.10 0.25 . 1 . . . 1 A 145 ILE CB . 34513 1 269 . 1 . 1 27 27 ILE CG1 C 13 30.97 0.25 . 1 . . . 1 A 145 ILE CG1 . 34513 1 270 . 1 . 1 27 27 ILE CG2 C 13 16.66 0.25 . 1 . . . 1 A 145 ILE CG2 . 34513 1 271 . 1 . 1 27 27 ILE CD1 C 13 15.25 0.25 . 1 . . . 1 A 145 ILE CD1 . 34513 1 272 . 1 . 1 27 27 ILE N N 15 121.43 0.15 . 1 . . . 1 A 145 ILE N . 34513 1 273 . 1 . 1 28 28 LEU H H 1 8.51 0.02 . 1 . . . 1 A 146 LEU H . 34513 1 274 . 1 . 1 28 28 LEU HA H 1 3.90 0.02 . 1 . . . 1 A 146 LEU HA . 34513 1 275 . 1 . 1 28 28 LEU HB2 H 1 1.62 0.02 . 2 . . . 1 A 146 LEU HB2 . 34513 1 276 . 1 . 1 28 28 LEU HB3 H 1 1.93 0.02 . 2 . . . 1 A 146 LEU HB3 . 34513 1 277 . 1 . 1 28 28 LEU HG H 1 1.60 0.02 . 1 . . . 1 A 146 LEU HG . 34513 1 278 . 1 . 1 28 28 LEU HD11 H 1 0.94 0.02 . 2 . . . 1 A 146 LEU HD11 . 34513 1 279 . 1 . 1 28 28 LEU HD12 H 1 0.94 0.02 . 2 . . . 1 A 146 LEU HD12 . 34513 1 280 . 1 . 1 28 28 LEU HD13 H 1 0.94 0.02 . 2 . . . 1 A 146 LEU HD13 . 34513 1 281 . 1 . 1 28 28 LEU HD21 H 1 0.94 0.02 . 2 . . . 1 A 146 LEU HD21 . 34513 1 282 . 1 . 1 28 28 LEU HD22 H 1 0.94 0.02 . 2 . . . 1 A 146 LEU HD22 . 34513 1 283 . 1 . 1 28 28 LEU HD23 H 1 0.94 0.02 . 2 . . . 1 A 146 LEU HD23 . 34513 1 284 . 1 . 1 28 28 LEU C C 13 179.09 0.25 . 1 . . . 1 A 146 LEU C . 34513 1 285 . 1 . 1 28 28 LEU CA C 13 58.87 0.25 . 1 . . . 1 A 146 LEU CA . 34513 1 286 . 1 . 1 28 28 LEU CB C 13 41.98 0.25 . 1 . . . 1 A 146 LEU CB . 34513 1 287 . 1 . 1 28 28 LEU CG C 13 27.91 0.25 . 1 . . . 1 A 146 LEU CG . 34513 1 288 . 1 . 1 28 28 LEU CD1 C 13 24.99 0.25 . 2 . . . 1 A 146 LEU CD1 . 34513 1 289 . 1 . 1 28 28 LEU CD2 C 13 25.04 0.25 . 2 . . . 1 A 146 LEU CD2 . 34513 1 290 . 1 . 1 28 28 LEU N N 15 120.24 0.15 . 1 . . . 1 A 146 LEU N . 34513 1 291 . 1 . 1 29 29 GLY H H 1 8.09 0.02 . 1 . . . 1 A 147 GLY H . 34513 1 292 . 1 . 1 29 29 GLY HA2 H 1 3.94 0.02 . 2 . . . 1 A 147 GLY HA2 . 34513 1 293 . 1 . 1 29 29 GLY HA3 H 1 4.03 0.02 . 2 . . . 1 A 147 GLY HA3 . 34513 1 294 . 1 . 1 29 29 GLY C C 13 176.93 0.25 . 1 . . . 1 A 147 GLY C . 34513 1 295 . 1 . 1 29 29 GLY CA C 13 47.28 0.25 . 1 . . . 1 A 147 GLY CA . 34513 1 296 . 1 . 1 29 29 GLY N N 15 105.68 0.15 . 1 . . . 1 A 147 GLY N . 34513 1 297 . 1 . 1 30 30 MET H H 1 7.84 0.02 . 1 . . . 1 A 148 MET H . 34513 1 298 . 1 . 1 30 30 MET HA H 1 4.26 0.02 . 1 . . . 1 A 148 MET HA . 34513 1 299 . 1 . 1 30 30 MET HB2 H 1 2.28 0.02 . 2 . . . 1 A 148 MET HB2 . 34513 1 300 . 1 . 1 30 30 MET HB3 H 1 1.86 0.02 . 2 . . . 1 A 148 MET HB3 . 34513 1 301 . 1 . 1 30 30 MET HG2 H 1 2.56 0.02 . 2 . . . 1 A 148 MET HG2 . 34513 1 302 . 1 . 1 30 30 MET HG3 H 1 2.80 0.02 . 2 . . . 1 A 148 MET HG3 . 34513 1 303 . 1 . 1 30 30 MET HE1 H 1 1.90 0.02 . 1 . . . 1 A 148 MET HE1 . 34513 1 304 . 1 . 1 30 30 MET HE2 H 1 1.90 0.02 . 1 . . . 1 A 148 MET HE2 . 34513 1 305 . 1 . 1 30 30 MET HE3 H 1 1.90 0.02 . 1 . . . 1 A 148 MET HE3 . 34513 1 306 . 1 . 1 30 30 MET C C 13 178.71 0.25 . 1 . . . 1 A 148 MET C . 34513 1 307 . 1 . 1 30 30 MET CA C 13 59.23 0.25 . 1 . . . 1 A 148 MET CA . 34513 1 308 . 1 . 1 30 30 MET CB C 13 34.17 0.25 . 1 . . . 1 A 148 MET CB . 34513 1 309 . 1 . 1 30 30 MET CG C 13 33.10 0.25 . 1 . . . 1 A 148 MET CG . 34513 1 310 . 1 . 1 30 30 MET CE C 13 17.57 0.25 . 1 . . . 1 A 148 MET CE . 34513 1 311 . 1 . 1 30 30 MET N N 15 120.97 0.15 . 1 . . . 1 A 148 MET N . 34513 1 312 . 1 . 1 31 31 LEU H H 1 8.58 0.02 . 1 . . . 1 A 149 LEU H . 34513 1 313 . 1 . 1 31 31 LEU HA H 1 4.03 0.02 . 1 . . . 1 A 149 LEU HA . 34513 1 314 . 1 . 1 31 31 LEU HB2 H 1 1.56 0.02 . 2 . . . 1 A 149 LEU HB2 . 34513 1 315 . 1 . 1 31 31 LEU HB3 H 1 1.96 0.02 . 2 . . . 1 A 149 LEU HB3 . 34513 1 316 . 1 . 1 31 31 LEU HG H 1 1.81 0.02 . 1 . . . 1 A 149 LEU HG . 34513 1 317 . 1 . 1 31 31 LEU HD11 H 1 0.83 0.02 . 2 . . . 1 A 149 LEU HD11 . 34513 1 318 . 1 . 1 31 31 LEU HD12 H 1 0.83 0.02 . 2 . . . 1 A 149 LEU HD12 . 34513 1 319 . 1 . 1 31 31 LEU HD13 H 1 0.83 0.02 . 2 . . . 1 A 149 LEU HD13 . 34513 1 320 . 1 . 1 31 31 LEU HD21 H 1 0.95 0.02 . 2 . . . 1 A 149 LEU HD21 . 34513 1 321 . 1 . 1 31 31 LEU HD22 H 1 0.95 0.02 . 2 . . . 1 A 149 LEU HD22 . 34513 1 322 . 1 . 1 31 31 LEU HD23 H 1 0.95 0.02 . 2 . . . 1 A 149 LEU HD23 . 34513 1 323 . 1 . 1 31 31 LEU C C 13 178.51 0.25 . 1 . . . 1 A 149 LEU C . 34513 1 324 . 1 . 1 31 31 LEU CA C 13 58.05 0.25 . 1 . . . 1 A 149 LEU CA . 34513 1 325 . 1 . 1 31 31 LEU CB C 13 41.98 0.25 . 1 . . . 1 A 149 LEU CB . 34513 1 326 . 1 . 1 31 31 LEU CG C 13 27.23 0.25 . 1 . . . 1 A 149 LEU CG . 34513 1 327 . 1 . 1 31 31 LEU CD1 C 13 25.61 0.25 . 2 . . . 1 A 149 LEU CD1 . 34513 1 328 . 1 . 1 31 31 LEU CD2 C 13 27.80 0.25 . 2 . . . 1 A 149 LEU CD2 . 34513 1 329 . 1 . 1 31 31 LEU N N 15 119.56 0.15 . 1 . . . 1 A 149 LEU N . 34513 1 330 . 1 . 1 32 32 HIS H H 1 8.54 0.02 . 1 . . . 1 A 150 HIS H . 34513 1 331 . 1 . 1 32 32 HIS HA H 1 4.23 0.02 . 1 . . . 1 A 150 HIS HA . 34513 1 332 . 1 . 1 32 32 HIS HB2 H 1 3.30 0.02 . 2 . . . 1 A 150 HIS HB2 . 34513 1 333 . 1 . 1 32 32 HIS HB3 H 1 3.31 0.02 . 2 . . . 1 A 150 HIS HB3 . 34513 1 334 . 1 . 1 32 32 HIS HD2 H 1 7.12 0.02 . 1 . . . 1 A 150 HIS HD2 . 34513 1 335 . 1 . 1 32 32 HIS C C 13 177.21 0.25 . 1 . . . 1 A 150 HIS C . 34513 1 336 . 1 . 1 32 32 HIS CA C 13 60.51 0.25 . 1 . . . 1 A 150 HIS CA . 34513 1 337 . 1 . 1 32 32 HIS CB C 13 29.31 0.25 . 1 . . . 1 A 150 HIS CB . 34513 1 338 . 1 . 1 32 32 HIS CD2 C 13 119.77 0.25 . 1 . . . 1 A 150 HIS CD2 . 34513 1 339 . 1 . 1 32 32 HIS N N 15 118.27 0.15 . 1 . . . 1 A 150 HIS N . 34513 1 340 . 1 . 1 33 33 THR H H 1 7.66 0.02 . 1 . . . 1 A 151 THR H . 34513 1 341 . 1 . 1 33 33 THR HA H 1 3.91 0.02 . 1 . . . 1 A 151 THR HA . 34513 1 342 . 1 . 1 33 33 THR HB H 1 4.47 0.02 . 1 . . . 1 A 151 THR HB . 34513 1 343 . 1 . 1 33 33 THR HG21 H 1 1.28 0.02 . 1 . . . 1 A 151 THR HG21 . 34513 1 344 . 1 . 1 33 33 THR HG22 H 1 1.28 0.02 . 1 . . . 1 A 151 THR HG22 . 34513 1 345 . 1 . 1 33 33 THR HG23 H 1 1.28 0.02 . 1 . . . 1 A 151 THR HG23 . 34513 1 346 . 1 . 1 33 33 THR C C 13 176.34 0.25 . 1 . . . 1 A 151 THR C . 34513 1 347 . 1 . 1 33 33 THR CA C 13 66.31 0.25 . 1 . . . 1 A 151 THR CA . 34513 1 348 . 1 . 1 33 33 THR CB C 13 68.67 0.25 . 1 . . . 1 A 151 THR CB . 34513 1 349 . 1 . 1 33 33 THR CG2 C 13 21.89 0.25 . 1 . . . 1 A 151 THR CG2 . 34513 1 350 . 1 . 1 33 33 THR N N 15 114.48 0.15 . 1 . . . 1 A 151 THR N . 34513 1 351 . 1 . 1 34 34 LEU H H 1 7.78 0.02 . 1 . . . 1 A 152 LEU H . 34513 1 352 . 1 . 1 34 34 LEU HA H 1 4.11 0.02 . 1 . . . 1 A 152 LEU HA . 34513 1 353 . 1 . 1 34 34 LEU HB2 H 1 1.58 0.02 . 2 . . . 1 A 152 LEU HB2 . 34513 1 354 . 1 . 1 34 34 LEU HB3 H 1 1.94 0.02 . 2 . . . 1 A 152 LEU HB3 . 34513 1 355 . 1 . 1 34 34 LEU HG H 1 1.77 0.02 . 1 . . . 1 A 152 LEU HG . 34513 1 356 . 1 . 1 34 34 LEU HD11 H 1 0.78 0.02 . 2 . . . 1 A 152 LEU HD11 . 34513 1 357 . 1 . 1 34 34 LEU HD12 H 1 0.78 0.02 . 2 . . . 1 A 152 LEU HD12 . 34513 1 358 . 1 . 1 34 34 LEU HD13 H 1 0.78 0.02 . 2 . . . 1 A 152 LEU HD13 . 34513 1 359 . 1 . 1 34 34 LEU HD21 H 1 0.80 0.02 . 2 . . . 1 A 152 LEU HD21 . 34513 1 360 . 1 . 1 34 34 LEU HD22 H 1 0.80 0.02 . 2 . . . 1 A 152 LEU HD22 . 34513 1 361 . 1 . 1 34 34 LEU HD23 H 1 0.80 0.02 . 2 . . . 1 A 152 LEU HD23 . 34513 1 362 . 1 . 1 34 34 LEU C C 13 179.20 0.25 . 1 . . . 1 A 152 LEU C . 34513 1 363 . 1 . 1 34 34 LEU CA C 13 57.40 0.25 . 1 . . . 1 A 152 LEU CA . 34513 1 364 . 1 . 1 34 34 LEU CB C 13 42.08 0.25 . 1 . . . 1 A 152 LEU CB . 34513 1 365 . 1 . 1 34 34 LEU CG C 13 26.57 0.25 . 1 . . . 1 A 152 LEU CG . 34513 1 366 . 1 . 1 34 34 LEU CD1 C 13 23.06 0.25 . 2 . . . 1 A 152 LEU CD1 . 34513 1 367 . 1 . 1 34 34 LEU CD2 C 13 25.58 0.25 . 2 . . . 1 A 152 LEU CD2 . 34513 1 368 . 1 . 1 34 34 LEU N N 15 121.33 0.15 . 1 . . . 1 A 152 LEU N . 34513 1 369 . 1 . 1 35 35 VAL H H 1 8.60 0.02 . 1 . . . 1 A 153 VAL H . 34513 1 370 . 1 . 1 35 35 VAL HA H 1 3.68 0.02 . 1 . . . 1 A 153 VAL HA . 34513 1 371 . 1 . 1 35 35 VAL HB H 1 2.22 0.02 . 1 . . . 1 A 153 VAL HB . 34513 1 372 . 1 . 1 35 35 VAL HG11 H 1 1.03 0.02 . 2 . . . 1 A 153 VAL HG11 . 34513 1 373 . 1 . 1 35 35 VAL HG12 H 1 1.03 0.02 . 2 . . . 1 A 153 VAL HG12 . 34513 1 374 . 1 . 1 35 35 VAL HG13 H 1 1.03 0.02 . 2 . . . 1 A 153 VAL HG13 . 34513 1 375 . 1 . 1 35 35 VAL HG21 H 1 0.94 0.02 . 2 . . . 1 A 153 VAL HG21 . 34513 1 376 . 1 . 1 35 35 VAL HG22 H 1 0.94 0.02 . 2 . . . 1 A 153 VAL HG22 . 34513 1 377 . 1 . 1 35 35 VAL HG23 H 1 0.94 0.02 . 2 . . . 1 A 153 VAL HG23 . 34513 1 378 . 1 . 1 35 35 VAL C C 13 178.71 0.25 . 1 . . . 1 A 153 VAL C . 34513 1 379 . 1 . 1 35 35 VAL CA C 13 66.11 0.25 . 1 . . . 1 A 153 VAL CA . 34513 1 380 . 1 . 1 35 35 VAL CB C 13 31.72 0.25 . 1 . . . 1 A 153 VAL CB . 34513 1 381 . 1 . 1 35 35 VAL CG1 C 13 22.75 0.25 . 2 . . . 1 A 153 VAL CG1 . 34513 1 382 . 1 . 1 35 35 VAL CG2 C 13 21.20 0.25 . 2 . . . 1 A 153 VAL CG2 . 34513 1 383 . 1 . 1 35 35 VAL N N 15 120.62 0.15 . 1 . . . 1 A 153 VAL N . 34513 1 384 . 1 . 1 36 36 VAL H H 1 8.04 0.02 . 1 . . . 1 A 154 VAL H . 34513 1 385 . 1 . 1 36 36 VAL HA H 1 3.80 0.02 . 1 . . . 1 A 154 VAL HA . 34513 1 386 . 1 . 1 36 36 VAL HB H 1 2.07 0.02 . 1 . . . 1 A 154 VAL HB . 34513 1 387 . 1 . 1 36 36 VAL HG11 H 1 0.90 0.02 . 2 . . . 1 A 154 VAL HG11 . 34513 1 388 . 1 . 1 36 36 VAL HG12 H 1 0.90 0.02 . 2 . . . 1 A 154 VAL HG12 . 34513 1 389 . 1 . 1 36 36 VAL HG13 H 1 0.90 0.02 . 2 . . . 1 A 154 VAL HG13 . 34513 1 390 . 1 . 1 36 36 VAL HG21 H 1 0.91 0.02 . 2 . . . 1 A 154 VAL HG21 . 34513 1 391 . 1 . 1 36 36 VAL HG22 H 1 0.91 0.02 . 2 . . . 1 A 154 VAL HG22 . 34513 1 392 . 1 . 1 36 36 VAL HG23 H 1 0.91 0.02 . 2 . . . 1 A 154 VAL HG23 . 34513 1 393 . 1 . 1 36 36 VAL C C 13 178.05 0.25 . 1 . . . 1 A 154 VAL C . 34513 1 394 . 1 . 1 36 36 VAL CA C 13 65.28 0.25 . 1 . . . 1 A 154 VAL CA . 34513 1 395 . 1 . 1 36 36 VAL CB C 13 31.62 0.25 . 1 . . . 1 A 154 VAL CB . 34513 1 396 . 1 . 1 36 36 VAL CG1 C 13 21.84 0.25 . 2 . . . 1 A 154 VAL CG1 . 34513 1 397 . 1 . 1 36 36 VAL CG2 C 13 21.06 0.25 . 2 . . . 1 A 154 VAL CG2 . 34513 1 398 . 1 . 1 36 36 VAL N N 15 120.50 0.15 . 1 . . . 1 A 154 VAL N . 34513 1 399 . 1 . 1 37 37 ALA H H 1 7.82 0.02 . 1 . . . 1 A 155 ALA H . 34513 1 400 . 1 . 1 37 37 ALA HA H 1 4.25 0.02 . 1 . . . 1 A 155 ALA HA . 34513 1 401 . 1 . 1 37 37 ALA HB1 H 1 1.49 0.02 . 1 . . . 1 A 155 ALA HB1 . 34513 1 402 . 1 . 1 37 37 ALA HB2 H 1 1.49 0.02 . 1 . . . 1 A 155 ALA HB2 . 34513 1 403 . 1 . 1 37 37 ALA HB3 H 1 1.49 0.02 . 1 . . . 1 A 155 ALA HB3 . 34513 1 404 . 1 . 1 37 37 ALA C C 13 178.83 0.25 . 1 . . . 1 A 155 ALA C . 34513 1 405 . 1 . 1 37 37 ALA CA C 13 53.77 0.25 . 1 . . . 1 A 155 ALA CA . 34513 1 406 . 1 . 1 37 37 ALA CB C 13 18.46 0.25 . 1 . . . 1 A 155 ALA CB . 34513 1 407 . 1 . 1 37 37 ALA N N 15 122.17 0.15 . 1 . . . 1 A 155 ALA N . 34513 1 408 . 1 . 1 38 38 SER H H 1 7.82 0.02 . 1 . . . 1 A 156 SER H . 34513 1 409 . 1 . 1 38 38 SER HA H 1 4.38 0.02 . 1 . . . 1 A 156 SER HA . 34513 1 410 . 1 . 1 38 38 SER HB2 H 1 3.90 0.02 . 2 . . . 1 A 156 SER HB2 . 34513 1 411 . 1 . 1 38 38 SER HB3 H 1 3.90 0.02 . 2 . . . 1 A 156 SER HB3 . 34513 1 412 . 1 . 1 38 38 SER C C 13 174.34 0.25 . 1 . . . 1 A 156 SER C . 34513 1 413 . 1 . 1 38 38 SER CA C 13 59.34 0.25 . 1 . . . 1 A 156 SER CA . 34513 1 414 . 1 . 1 38 38 SER CB C 13 63.83 0.25 . 1 . . . 1 A 156 SER CB . 34513 1 415 . 1 . 1 38 38 SER N N 15 112.78 0.15 . 1 . . . 1 A 156 SER N . 34513 1 416 . 1 . 1 39 39 ALA H H 1 7.84 0.02 . 1 . . . 1 A 157 ALA H . 34513 1 417 . 1 . 1 39 39 ALA HA H 1 4.41 0.02 . 1 . . . 1 A 157 ALA HA . 34513 1 418 . 1 . 1 39 39 ALA HB1 H 1 1.46 0.02 . 1 . . . 1 A 157 ALA HB1 . 34513 1 419 . 1 . 1 39 39 ALA HB2 H 1 1.46 0.02 . 1 . . . 1 A 157 ALA HB2 . 34513 1 420 . 1 . 1 39 39 ALA HB3 H 1 1.46 0.02 . 1 . . . 1 A 157 ALA HB3 . 34513 1 421 . 1 . 1 39 39 ALA C C 13 177.88 0.25 . 1 . . . 1 A 157 ALA C . 34513 1 422 . 1 . 1 39 39 ALA CA C 13 52.57 0.25 . 1 . . . 1 A 157 ALA CA . 34513 1 423 . 1 . 1 39 39 ALA CB C 13 19.34 0.25 . 1 . . . 1 A 157 ALA CB . 34513 1 424 . 1 . 1 39 39 ALA N N 15 124.46 0.15 . 1 . . . 1 A 157 ALA N . 34513 1 425 . 1 . 1 40 40 GLY H H 1 8.01 0.02 . 1 . . . 1 A 158 GLY H . 34513 1 426 . 1 . 1 40 40 GLY HA2 H 1 4.12 0.02 . 2 . . . 1 A 158 GLY HA2 . 34513 1 427 . 1 . 1 40 40 GLY HA3 H 1 4.16 0.02 . 2 . . . 1 A 158 GLY HA3 . 34513 1 428 . 1 . 1 40 40 GLY CA C 13 44.67 0.25 . 1 . . . 1 A 158 GLY CA . 34513 1 429 . 1 . 1 40 40 GLY N N 15 107.38 0.15 . 1 . . . 1 A 158 GLY N . 34513 1 430 . 1 . 1 41 41 PRO HA H 1 4.54 0.02 . 1 . . . 1 A 159 PRO HA . 34513 1 431 . 1 . 1 41 41 PRO HB2 H 1 2.00 0.02 . 2 . . . 1 A 159 PRO HB2 . 34513 1 432 . 1 . 1 41 41 PRO HB3 H 1 2.32 0.02 . 2 . . . 1 A 159 PRO HB3 . 34513 1 433 . 1 . 1 41 41 PRO HG2 H 1 2.05 0.02 . 2 . . . 1 A 159 PRO HG2 . 34513 1 434 . 1 . 1 41 41 PRO HG3 H 1 2.05 0.02 . 2 . . . 1 A 159 PRO HG3 . 34513 1 435 . 1 . 1 41 41 PRO HD2 H 1 3.68 0.02 . 2 . . . 1 A 159 PRO HD2 . 34513 1 436 . 1 . 1 41 41 PRO HD3 H 1 3.67 0.02 . 2 . . . 1 A 159 PRO HD3 . 34513 1 437 . 1 . 1 41 41 PRO C C 13 177.66 0.25 . 1 . . . 1 A 159 PRO C . 34513 1 438 . 1 . 1 41 41 PRO CA C 13 63.30 0.25 . 1 . . . 1 A 159 PRO CA . 34513 1 439 . 1 . 1 41 41 PRO CB C 13 32.07 0.25 . 1 . . . 1 A 159 PRO CB . 34513 1 440 . 1 . 1 41 41 PRO CG C 13 27.14 0.25 . 1 . . . 1 A 159 PRO CG . 34513 1 441 . 1 . 1 41 41 PRO CD C 13 49.74 0.25 . 1 . . . 1 A 159 PRO CD . 34513 1 442 . 1 . 1 42 42 THR H H 1 8.33 0.02 . 1 . . . 1 A 160 THR H . 34513 1 443 . 1 . 1 42 42 THR HA H 1 4.39 0.02 . 1 . . . 1 A 160 THR HA . 34513 1 444 . 1 . 1 42 42 THR HB H 1 4.29 0.02 . 1 . . . 1 A 160 THR HB . 34513 1 445 . 1 . 1 42 42 THR HG21 H 1 1.24 0.02 . 1 . . . 1 A 160 THR HG21 . 34513 1 446 . 1 . 1 42 42 THR HG22 H 1 1.24 0.02 . 1 . . . 1 A 160 THR HG22 . 34513 1 447 . 1 . 1 42 42 THR HG23 H 1 1.24 0.02 . 1 . . . 1 A 160 THR HG23 . 34513 1 448 . 1 . 1 42 42 THR C C 13 174.67 0.25 . 1 . . . 1 A 160 THR C . 34513 1 449 . 1 . 1 42 42 THR CA C 13 61.86 0.25 . 1 . . . 1 A 160 THR CA . 34513 1 450 . 1 . 1 42 42 THR CB C 13 69.52 0.25 . 1 . . . 1 A 160 THR CB . 34513 1 451 . 1 . 1 42 42 THR CG2 C 13 21.41 0.25 . 1 . . . 1 A 160 THR CG2 . 34513 1 452 . 1 . 1 42 42 THR N N 15 113.84 0.15 . 1 . . . 1 A 160 THR N . 34513 1 453 . 1 . 1 43 43 SER H H 1 8.22 0.02 . 1 . . . 1 A 161 SER H . 34513 1 454 . 1 . 1 43 43 SER HA H 1 4.46 0.02 . 1 . . . 1 A 161 SER HA . 34513 1 455 . 1 . 1 43 43 SER HB2 H 1 3.89 0.02 . 1 . . . 1 A 161 SER HB2 . 34513 1 456 . 1 . 1 43 43 SER HB3 H 1 3.89 0.02 . 1 . . . 1 A 161 SER HB3 . 34513 1 457 . 1 . 1 43 43 SER C C 13 173.94 0.25 . 1 . . . 1 A 161 SER C . 34513 1 458 . 1 . 1 43 43 SER CA C 13 58.19 0.25 . 1 . . . 1 A 161 SER CA . 34513 1 459 . 1 . 1 43 43 SER CB C 13 63.83 0.25 . 1 . . . 1 A 161 SER CB . 34513 1 460 . 1 . 1 43 43 SER N N 15 117.77 0.15 . 1 . . . 1 A 161 SER N . 34513 1 461 . 1 . 1 44 44 ALA H H 1 8.30 0.02 . 1 . . . 1 A 162 ALA H . 34513 1 462 . 1 . 1 44 44 ALA HA H 1 4.37 0.02 . 1 . . . 1 A 162 ALA HA . 34513 1 463 . 1 . 1 44 44 ALA HB1 H 1 1.40 0.02 . 1 . . . 1 A 162 ALA HB1 . 34513 1 464 . 1 . 1 44 44 ALA HB2 H 1 1.40 0.02 . 1 . . . 1 A 162 ALA HB2 . 34513 1 465 . 1 . 1 44 44 ALA HB3 H 1 1.40 0.02 . 1 . . . 1 A 162 ALA HB3 . 34513 1 466 . 1 . 1 44 44 ALA C C 13 176.57 0.25 . 1 . . . 1 A 162 ALA C . 34513 1 467 . 1 . 1 44 44 ALA CA C 13 52.47 0.25 . 1 . . . 1 A 162 ALA CA . 34513 1 468 . 1 . 1 44 44 ALA CB C 13 19.16 0.25 . 1 . . . 1 A 162 ALA CB . 34513 1 469 . 1 . 1 44 44 ALA N N 15 126.46 0.15 . 1 . . . 1 A 162 ALA N . 34513 1 470 . 1 . 1 45 45 ARG H H 1 7.91 0.02 . 1 . . . 1 A 163 ARG H . 34513 1 471 . 1 . 1 45 45 ARG HA H 1 4.17 0.02 . 1 . . . 1 A 163 ARG HA . 34513 1 472 . 1 . 1 45 45 ARG HB2 H 1 1.86 0.02 . 2 . . . 1 A 163 ARG HB2 . 34513 1 473 . 1 . 1 45 45 ARG HB3 H 1 1.72 0.02 . 2 . . . 1 A 163 ARG HB3 . 34513 1 474 . 1 . 1 45 45 ARG HG2 H 1 1.61 0.02 . 2 . . . 1 A 163 ARG HG2 . 34513 1 475 . 1 . 1 45 45 ARG HG3 H 1 1.60 0.02 . 2 . . . 1 A 163 ARG HG3 . 34513 1 476 . 1 . 1 45 45 ARG HD2 H 1 3.20 0.02 . 1 . . . 1 A 163 ARG HD2 . 34513 1 477 . 1 . 1 45 45 ARG HD3 H 1 3.20 0.02 . 1 . . . 1 A 163 ARG HD3 . 34513 1 478 . 1 . 1 45 45 ARG CA C 13 57.26 0.25 . 1 . . . 1 A 163 ARG CA . 34513 1 479 . 1 . 1 45 45 ARG CB C 13 31.45 0.25 . 1 . . . 1 A 163 ARG CB . 34513 1 480 . 1 . 1 45 45 ARG CG C 13 26.99 0.25 . 1 . . . 1 A 163 ARG CG . 34513 1 481 . 1 . 1 45 45 ARG CD C 13 43.37 0.25 . 1 . . . 1 A 163 ARG CD . 34513 1 482 . 1 . 1 45 45 ARG N N 15 125.49 0.15 . 1 . . . 1 A 163 ARG N . 34513 1 stop_ save_