################################### # 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 15965 _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 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err 0.5 _Assigned_chem_shift_list.Chem_shift_15N_err 0.5 _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 3 '3D CBCA(CO)NH' . . . 15965 1 4 '3D HNCO' . . . 15965 1 6 '3D HNCA' . . . 15965 1 7 '3D HNCACB' . . . 15965 1 8 '3D HBHA(CO)NH' . . . 15965 1 9 '3D HN(CO)CA' . . . 15965 1 14 '3D HCCH-COSY' . . . 15965 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 $AutoStructure . . 15965 1 2 $CNS . . 15965 1 3 $SPARKY . . 15965 1 4 $NMRPipe . . 15965 1 5 $NMRDraw . . 15965 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 . 2 1 1 1 GLY HA2 H 1 3.855 0.05 . 1 . . . . 1 GLY HA2 . 15965 1 2 . 2 1 1 1 GLY HA3 H 1 3.855 0.05 . 1 . . . . 1 GLY HA3 . 15965 1 3 . 2 1 1 1 GLY CA C 13 43.523 0.5 . 1 . . . . 1 GLY CA . 15965 1 4 . 2 1 2 2 ALA H H 1 8.725 0.05 . 1 . . . . 2 ALA H . 15965 1 5 . 2 1 2 2 ALA HA H 1 4.373 0.05 . 1 . . . . 2 ALA HA . 15965 1 6 . 2 1 2 2 ALA HB1 H 1 1.402 0.05 . 1 . . . . 2 ALA HB . 15965 1 7 . 2 1 2 2 ALA HB2 H 1 1.402 0.05 . 1 . . . . 2 ALA HB . 15965 1 8 . 2 1 2 2 ALA HB3 H 1 1.402 0.05 . 1 . . . . 2 ALA HB . 15965 1 9 . 2 1 2 2 ALA CA C 13 52.891 0.5 . 1 . . . . 2 ALA CA . 15965 1 10 . 2 1 2 2 ALA CB C 13 19.489 0.5 . 1 . . . . 2 ALA CB . 15965 1 11 . 2 1 2 2 ALA N N 15 124.084 0.5 . 1 . . . . 2 ALA N . 15965 1 12 . 2 1 3 3 GLY H H 1 8.647 0.05 . 1 . . . . 3 GLY H . 15965 1 13 . 2 1 3 3 GLY HA2 H 1 3.996 0.05 . 2 . . . . 3 GLY HA2 . 15965 1 14 . 2 1 3 3 GLY HA3 H 1 3.996 0.05 . 2 . . . . 3 GLY HA3 . 15965 1 15 . 2 1 3 3 GLY CA C 13 45.438 0.5 . 1 . . . . 3 GLY CA . 15965 1 16 . 2 1 3 3 GLY N N 15 108.827 0.5 . 1 . . . . 3 GLY N . 15965 1 17 . 2 1 4 4 SER H H 1 8.311 0.05 . 1 . . . . 4 SER H . 15965 1 18 . 2 1 4 4 SER HA H 1 4.493 0.05 . 1 . . . . 4 SER HA . 15965 1 19 . 2 1 4 4 SER HB2 H 1 3.902 0.05 . 2 . . . . 4 SER HB2 . 15965 1 20 . 2 1 4 4 SER HB3 H 1 3.976 0.05 . 2 . . . . 4 SER HB3 . 15965 1 21 . 2 1 4 4 SER CA C 13 58.607 0.5 . 1 . . . . 4 SER CA . 15965 1 22 . 2 1 4 4 SER CB C 13 63.715 0.5 . 1 . . . . 4 SER CB . 15965 1 23 . 2 1 4 4 SER N N 15 115.868 0.5 . 1 . . . . 4 SER N . 15965 1 24 . 2 1 5 5 SER H H 1 8.62 0.05 . 1 . . . . 5 SER H . 15965 1 25 . 2 1 5 5 SER HA H 1 4.469 0.05 . 1 . . . . 5 SER HA . 15965 1 26 . 2 1 5 5 SER HB2 H 1 4.022 0.05 . 2 . . . . 5 SER HB2 . 15965 1 27 . 2 1 5 5 SER HB3 H 1 3.939 0.05 . 2 . . . . 5 SER HB3 . 15965 1 28 . 2 1 5 5 SER CA C 13 59.103 0.5 . 1 . . . . 5 SER CA . 15965 1 29 . 2 1 5 5 SER CB C 13 63.474 0.5 . 1 . . . . 5 SER CB . 15965 1 30 . 2 1 5 5 SER N N 15 118.963 0.5 . 1 . . . . 5 SER N . 15965 1 31 . 2 1 6 6 SER H H 1 8.49 0.05 . 1 . . . . 6 SER H . 15965 1 32 . 2 1 6 6 SER HA H 1 4.388 0.05 . 1 . . . . 6 SER HA . 15965 1 33 . 2 1 6 6 SER HB2 H 1 3.905 0.05 . 2 . . . . 6 SER HB2 . 15965 1 34 . 2 1 6 6 SER HB3 H 1 3.936 0.05 . 2 . . . . 6 SER HB3 . 15965 1 35 . 2 1 6 6 SER CA C 13 59.989 0.5 . 1 . . . . 6 SER CA . 15965 1 36 . 2 1 6 6 SER CB C 13 63.455 0.5 . 1 . . . . 6 SER CB . 15965 1 37 . 2 1 6 6 SER N N 15 119.176 0.5 . 1 . . . . 6 SER N . 15965 1 38 . 2 1 7 7 LEU H H 1 8.281 0.05 . 1 . . . . 7 LEU H . 15965 1 39 . 2 1 7 7 LEU HA H 1 4.129 0.05 . 1 . . . . 7 LEU HA . 15965 1 40 . 2 1 7 7 LEU HB2 H 1 1.737 0.05 . 2 . . . . 7 LEU HB2 . 15965 1 41 . 2 1 7 7 LEU HB3 H 1 1.62 0.05 . 2 . . . . 7 LEU HB3 . 15965 1 42 . 2 1 7 7 LEU HD11 H 1 0.903 0.05 . 2 . . . . 7 LEU HD1 . 15965 1 43 . 2 1 7 7 LEU HD12 H 1 0.903 0.05 . 2 . . . . 7 LEU HD1 . 15965 1 44 . 2 1 7 7 LEU HD13 H 1 0.903 0.05 . 2 . . . . 7 LEU HD1 . 15965 1 45 . 2 1 7 7 LEU HD21 H 1 0.91 0.05 . 2 . . . . 7 LEU HD2 . 15965 1 46 . 2 1 7 7 LEU HD22 H 1 0.91 0.05 . 2 . . . . 7 LEU HD2 . 15965 1 47 . 2 1 7 7 LEU HD23 H 1 0.91 0.05 . 2 . . . . 7 LEU HD2 . 15965 1 48 . 2 1 7 7 LEU HG H 1 1.59 0.05 . 1 . . . . 7 LEU HG . 15965 1 49 . 2 1 7 7 LEU CA C 13 57.627 0.5 . 1 . . . . 7 LEU CA . 15965 1 50 . 2 1 7 7 LEU CB C 13 41.789 0.5 . 1 . . . . 7 LEU CB . 15965 1 51 . 2 1 7 7 LEU CD1 C 13 24.455 0.5 . 2 . . . . 7 LEU CD1 . 15965 1 52 . 2 1 7 7 LEU CD2 C 13 24.475 0.5 . 2 . . . . 7 LEU CD2 . 15965 1 53 . 2 1 7 7 LEU CG C 13 27.404 0.5 . 1 . . . . 7 LEU CG . 15965 1 54 . 2 1 7 7 LEU N N 15 123.537 0.5 . 1 . . . . 7 LEU N . 15965 1 55 . 2 1 8 8 GLU H H 1 8.192 0.05 . 1 . . . . 8 GLU H . 15965 1 56 . 2 1 8 8 GLU HA H 1 4.028 0.05 . 1 . . . . 8 GLU HA . 15965 1 57 . 2 1 8 8 GLU HB2 H 1 2.036 0.05 . 2 . . . . 8 GLU HB2 . 15965 1 58 . 2 1 8 8 GLU HB3 H 1 2.08 0.05 . 2 . . . . 8 GLU HB3 . 15965 1 59 . 2 1 8 8 GLU HG2 H 1 2.332 0.05 . 2 . . . . 8 GLU HG2 . 15965 1 60 . 2 1 8 8 GLU HG3 H 1 2.332 0.05 . 2 . . . . 8 GLU HG3 . 15965 1 61 . 2 1 8 8 GLU CA C 13 59.357 0.5 . 1 . . . . 8 GLU CA . 15965 1 62 . 2 1 8 8 GLU CB C 13 29.135 0.5 . 1 . . . . 8 GLU CB . 15965 1 63 . 2 1 8 8 GLU CG C 13 35.981 0.5 . 1 . . . . 8 GLU CG . 15965 1 64 . 2 1 8 8 GLU N N 15 118.872 0.5 . 1 . . . . 8 GLU N . 15965 1 65 . 2 1 9 9 ALA H H 1 7.973 0.05 . 1 . . . . 9 ALA H . 15965 1 66 . 2 1 9 9 ALA HA H 1 4.09 0.05 . 1 . . . . 9 ALA HA . 15965 1 67 . 2 1 9 9 ALA HB1 H 1 1.515 0.05 . 1 . . . . 9 ALA HB . 15965 1 68 . 2 1 9 9 ALA HB2 H 1 1.515 0.05 . 1 . . . . 9 ALA HB . 15965 1 69 . 2 1 9 9 ALA HB3 H 1 1.515 0.05 . 1 . . . . 9 ALA HB . 15965 1 70 . 2 1 9 9 ALA CA C 13 55.445 0.5 . 1 . . . . 9 ALA CA . 15965 1 71 . 2 1 9 9 ALA CB C 13 18.235 0.5 . 1 . . . . 9 ALA CB . 15965 1 72 . 2 1 9 9 ALA N N 15 121.399 0.5 . 1 . . . . 9 ALA N . 15965 1 73 . 2 1 10 10 VAL H H 1 7.889 0.05 . 1 . . . . 10 VAL H . 15965 1 74 . 2 1 10 10 VAL HA H 1 3.731 0.05 . 1 . . . . 10 VAL HA . 15965 1 75 . 2 1 10 10 VAL HB H 1 2.186 0.05 . 1 . . . . 10 VAL HB . 15965 1 76 . 2 1 10 10 VAL HG11 H 1 1.065 0.05 . 2 . . . . 10 VAL HG1 . 15965 1 77 . 2 1 10 10 VAL HG12 H 1 1.065 0.05 . 2 . . . . 10 VAL HG1 . 15965 1 78 . 2 1 10 10 VAL HG13 H 1 1.065 0.05 . 2 . . . . 10 VAL HG1 . 15965 1 79 . 2 1 10 10 VAL HG21 H 1 0.932 0.05 . 2 . . . . 10 VAL HG2 . 15965 1 80 . 2 1 10 10 VAL HG22 H 1 0.932 0.05 . 2 . . . . 10 VAL HG2 . 15965 1 81 . 2 1 10 10 VAL HG23 H 1 0.932 0.05 . 2 . . . . 10 VAL HG2 . 15965 1 82 . 2 1 10 10 VAL CA C 13 66.289 0.5 . 1 . . . . 10 VAL CA . 15965 1 83 . 2 1 10 10 VAL CB C 13 31.617 0.5 . 1 . . . . 10 VAL CB . 15965 1 84 . 2 1 10 10 VAL CG1 C 13 23.519 0.5 . 2 . . . . 10 VAL CG1 . 15965 1 85 . 2 1 10 10 VAL CG2 C 13 22.681 0.5 . 2 . . . . 10 VAL CG2 . 15965 1 86 . 2 1 10 10 VAL N N 15 119.522 0.5 . 1 . . . . 10 VAL N . 15965 1 87 . 2 1 11 11 ARG H H 1 8.299 0.05 . 1 . . . . 11 ARG H . 15965 1 88 . 2 1 11 11 ARG HA H 1 3.844 0.05 . 1 . . . . 11 ARG HA . 15965 1 89 . 2 1 11 11 ARG HB2 H 1 1.925 0.05 . 2 . . . . 11 ARG HB2 . 15965 1 90 . 2 1 11 11 ARG HB3 H 1 1.893 0.05 . 2 . . . . 11 ARG HB3 . 15965 1 91 . 2 1 11 11 ARG HD2 H 1 3.18 0.05 . 2 . . . . 11 ARG HD2 . 15965 1 92 . 2 1 11 11 ARG HD3 H 1 3.18 0.05 . 2 . . . . 11 ARG HD3 . 15965 1 93 . 2 1 11 11 ARG HG2 H 1 1.837 0.05 . 2 . . . . 11 ARG HG2 . 15965 1 94 . 2 1 11 11 ARG HG3 H 1 1.565 0.05 . 2 . . . . 11 ARG HG3 . 15965 1 95 . 2 1 11 11 ARG CA C 13 60.565 0.5 . 1 . . . . 11 ARG CA . 15965 1 96 . 2 1 11 11 ARG CB C 13 30.302 0.5 . 1 . . . . 11 ARG CB . 15965 1 97 . 2 1 11 11 ARG CD C 13 43.672 0.5 . 1 . . . . 11 ARG CD . 15965 1 98 . 2 1 11 11 ARG CG C 13 28.18 0.5 . 1 . . . . 11 ARG CG . 15965 1 99 . 2 1 11 11 ARG N N 15 120.475 0.5 . 1 . . . . 11 ARG N . 15965 1 100 . 2 1 12 12 ARG H H 1 8.183 0.05 . 1 . . . . 12 ARG H . 15965 1 101 . 2 1 12 12 ARG HA H 1 3.998 0.05 . 1 . . . . 12 ARG HA . 15965 1 102 . 2 1 12 12 ARG HB2 H 1 1.943 0.05 . 2 . . . . 12 ARG HB2 . 15965 1 103 . 2 1 12 12 ARG HB3 H 1 1.943 0.05 . 2 . . . . 12 ARG HB3 . 15965 1 104 . 2 1 12 12 ARG HD2 H 1 3.222 0.05 . 2 . . . . 12 ARG HD2 . 15965 1 105 . 2 1 12 12 ARG HD3 H 1 3.222 0.05 . 2 . . . . 12 ARG HD3 . 15965 1 106 . 2 1 12 12 ARG HG2 H 1 1.634 0.05 . 2 . . . . 12 ARG HG2 . 15965 1 107 . 2 1 12 12 ARG HG3 H 1 1.855 0.05 . 2 . . . . 12 ARG HG3 . 15965 1 108 . 2 1 12 12 ARG CA C 13 59.526 0.5 . 1 . . . . 12 ARG CA . 15965 1 109 . 2 1 12 12 ARG CB C 13 30.264 0.5 . 1 . . . . 12 ARG CB . 15965 1 110 . 2 1 12 12 ARG CD C 13 43.617 0.5 . 1 . . . . 12 ARG CD . 15965 1 111 . 2 1 12 12 ARG CG C 13 27.938 0.5 . 1 . . . . 12 ARG CG . 15965 1 112 . 2 1 12 12 ARG N N 15 118.44 0.5 . 1 . . . . 12 ARG N . 15965 1 113 . 2 1 13 13 LYS H H 1 7.972 0.05 . 1 . . . . 13 LYS H . 15965 1 114 . 2 1 13 13 LYS HA H 1 4.147 0.05 . 1 . . . . 13 LYS HA . 15965 1 115 . 2 1 13 13 LYS HB2 H 1 2.054 0.05 . 2 . . . . 13 LYS HB2 . 15965 1 116 . 2 1 13 13 LYS HB3 H 1 2.105 0.05 . 2 . . . . 13 LYS HB3 . 15965 1 117 . 2 1 13 13 LYS HD2 H 1 1.709 0.05 . 2 . . . . 13 LYS HD2 . 15965 1 118 . 2 1 13 13 LYS HD3 H 1 1.526 0.05 . 2 . . . . 13 LYS HD3 . 15965 1 119 . 2 1 13 13 LYS HE2 H 1 3.029 0.05 . 2 . . . . 13 LYS HE2 . 15965 1 120 . 2 1 13 13 LYS HE3 H 1 3.254 0.05 . 2 . . . . 13 LYS HE3 . 15965 1 121 . 2 1 13 13 LYS HG2 H 1 1.599 0.05 . 2 . . . . 13 LYS HG2 . 15965 1 122 . 2 1 13 13 LYS HG3 H 1 1.37 0.05 . 2 . . . . 13 LYS HG3 . 15965 1 123 . 2 1 13 13 LYS CA C 13 59.104 0.5 . 1 . . . . 13 LYS CA . 15965 1 124 . 2 1 13 13 LYS CB C 13 32.697 0.5 . 1 . . . . 13 LYS CB . 15965 1 125 . 2 1 13 13 LYS CD C 13 29.456 0.5 . 1 . . . . 13 LYS CD . 15965 1 126 . 2 1 13 13 LYS CE C 13 41.458 0.5 . 1 . . . . 13 LYS CE . 15965 1 127 . 2 1 13 13 LYS CG C 13 24.821 0.5 . 1 . . . . 13 LYS CG . 15965 1 128 . 2 1 13 13 LYS N N 15 122.454 0.5 . 1 . . . . 13 LYS N . 15965 1 129 . 2 1 14 14 ILE H H 1 8.291 0.05 . 1 . . . . 14 ILE H . 15965 1 130 . 2 1 14 14 ILE HA H 1 3.526 0.05 . 1 . . . . 14 ILE HA . 15965 1 131 . 2 1 14 14 ILE HB H 1 1.911 0.05 . 1 . . . . 14 ILE HB . 15965 1 132 . 2 1 14 14 ILE HD11 H 1 0.869 0.05 . 1 . . . . 14 ILE HD1 . 15965 1 133 . 2 1 14 14 ILE HD12 H 1 0.869 0.05 . 1 . . . . 14 ILE HD1 . 15965 1 134 . 2 1 14 14 ILE HD13 H 1 0.869 0.05 . 1 . . . . 14 ILE HD1 . 15965 1 135 . 2 1 14 14 ILE HG12 H 1 1.821 0.05 . 2 . . . . 14 ILE HG12 . 15965 1 136 . 2 1 14 14 ILE HG13 H 1 1.87 0.05 . 2 . . . . 14 ILE HG13 . 15965 1 137 . 2 1 14 14 ILE HG21 H 1 0.842 0.05 . 1 . . . . 14 ILE HG2 . 15965 1 138 . 2 1 14 14 ILE HG22 H 1 0.842 0.05 . 1 . . . . 14 ILE HG2 . 15965 1 139 . 2 1 14 14 ILE HG23 H 1 0.842 0.05 . 1 . . . . 14 ILE HG2 . 15965 1 140 . 2 1 14 14 ILE CA C 13 66.269 0.5 . 1 . . . . 14 ILE CA . 15965 1 141 . 2 1 14 14 ILE CB C 13 37.845 0.5 . 1 . . . . 14 ILE CB . 15965 1 142 . 2 1 14 14 ILE CD1 C 13 14.607 0.5 . 1 . . . . 14 ILE CD1 . 15965 1 143 . 2 1 14 14 ILE CG1 C 13 30.606 0.5 . 1 . . . . 14 ILE CG1 . 15965 1 144 . 2 1 14 14 ILE CG2 C 13 16.977 0.5 . 1 . . . . 14 ILE CG2 . 15965 1 145 . 2 1 14 14 ILE N N 15 119.298 0.5 . 1 . . . . 14 ILE N . 15965 1 146 . 2 1 15 15 ARG H H 1 8.047 0.05 . 1 . . . . 15 ARG H . 15965 1 147 . 2 1 15 15 ARG HA H 1 4.25 0.05 . 1 . . . . 15 ARG HA . 15965 1 148 . 2 1 15 15 ARG HB2 H 1 1.929 0.05 . 2 . . . . 15 ARG HB2 . 15965 1 149 . 2 1 15 15 ARG HB3 H 1 1.907 0.05 . 2 . . . . 15 ARG HB3 . 15965 1 150 . 2 1 15 15 ARG HD2 H 1 3.248 0.05 . 2 . . . . 15 ARG HD2 . 15965 1 151 . 2 1 15 15 ARG HD3 H 1 3.248 0.05 . 2 . . . . 15 ARG HD3 . 15965 1 152 . 2 1 15 15 ARG HG2 H 1 1.764 0.05 . 2 . . . . 15 ARG HG2 . 15965 1 153 . 2 1 15 15 ARG HG3 H 1 1.674 0.05 . 2 . . . . 15 ARG HG3 . 15965 1 154 . 2 1 15 15 ARG CA C 13 59.244 0.5 . 1 . . . . 15 ARG CA . 15965 1 155 . 2 1 15 15 ARG CB C 13 29.793 0.5 . 1 . . . . 15 ARG CB . 15965 1 156 . 2 1 15 15 ARG CD C 13 43.429 0.5 . 1 . . . . 15 ARG CD . 15965 1 157 . 2 1 15 15 ARG CG C 13 27.441 0.5 . 1 . . . . 15 ARG CG . 15965 1 158 . 2 1 15 15 ARG N N 15 120.923 0.5 . 1 . . . . 15 ARG N . 15965 1 159 . 2 1 16 16 SER H H 1 8.374 0.05 . 1 . . . . 16 SER H . 15965 1 160 . 2 1 16 16 SER HA H 1 4.344 0.05 . 1 . . . . 16 SER HA . 15965 1 161 . 2 1 16 16 SER HB2 H 1 4.056 0.05 . 2 . . . . 16 SER HB2 . 15965 1 162 . 2 1 16 16 SER HB3 H 1 4.044 0.05 . 2 . . . . 16 SER HB3 . 15965 1 163 . 2 1 16 16 SER CA C 13 61.861 0.5 . 1 . . . . 16 SER CA . 15965 1 164 . 2 1 16 16 SER CB C 13 62.882 0.5 . 1 . . . . 16 SER CB . 15965 1 165 . 2 1 16 16 SER N N 15 114.52 0.5 . 1 . . . . 16 SER N . 15965 1 166 . 2 1 17 17 LEU H H 1 8.135 0.05 . 1 . . . . 17 LEU H . 15965 1 167 . 2 1 17 17 LEU HA H 1 4.096 0.05 . 1 . . . . 17 LEU HA . 15965 1 168 . 2 1 17 17 LEU HB2 H 1 1.33 0.05 . 2 . . . . 17 LEU HB2 . 15965 1 169 . 2 1 17 17 LEU HB3 H 1 2.142 0.05 . 2 . . . . 17 LEU HB3 . 15965 1 170 . 2 1 17 17 LEU HD11 H 1 0.93 0.05 . 2 . . . . 17 LEU HD1 . 15965 1 171 . 2 1 17 17 LEU HD12 H 1 0.93 0.05 . 2 . . . . 17 LEU HD1 . 15965 1 172 . 2 1 17 17 LEU HD13 H 1 0.93 0.05 . 2 . . . . 17 LEU HD1 . 15965 1 173 . 2 1 17 17 LEU HD21 H 1 0.891 0.05 . 2 . . . . 17 LEU HD2 . 15965 1 174 . 2 1 17 17 LEU HD22 H 1 0.891 0.05 . 2 . . . . 17 LEU HD2 . 15965 1 175 . 2 1 17 17 LEU HD23 H 1 0.891 0.05 . 2 . . . . 17 LEU HD2 . 15965 1 176 . 2 1 17 17 LEU HG H 1 1.891 0.05 . 1 . . . . 17 LEU HG . 15965 1 177 . 2 1 17 17 LEU CA C 13 58.197 0.5 . 1 . . . . 17 LEU CA . 15965 1 178 . 2 1 17 17 LEU CB C 13 43.647 0.5 . 1 . . . . 17 LEU CB . 15965 1 179 . 2 1 17 17 LEU CD1 C 13 27.092 0.5 . 2 . . . . 17 LEU CD1 . 15965 1 180 . 2 1 17 17 LEU CD2 C 13 23.750 0.5 . 2 . . . . 17 LEU CD2 . 15965 1 181 . 2 1 17 17 LEU CG C 13 27.492 0.5 . 1 . . . . 17 LEU CG . 15965 1 182 . 2 1 17 17 LEU N N 15 122.938 0.5 . 1 . . . . 17 LEU N . 15965 1 183 . 2 1 18 18 GLN H H 1 8.649 0.05 . 1 . . . . 18 GLN H . 15965 1 184 . 2 1 18 18 GLN HA H 1 3.965 0.05 . 1 . . . . 18 GLN HA . 15965 1 185 . 2 1 18 18 GLN HB2 H 1 2.008 0.05 . 2 . . . . 18 GLN HB2 . 15965 1 186 . 2 1 18 18 GLN HB3 H 1 2.407 0.05 . 2 . . . . 18 GLN HB3 . 15965 1 187 . 2 1 18 18 GLN HE21 H 1 6.877 0.05 . 2 . . . . 18 GLN HE21 . 15965 1 188 . 2 1 18 18 GLN HE22 H 1 7.142 0.05 . 2 . . . . 18 GLN HE22 . 15965 1 189 . 2 1 18 18 GLN HG2 H 1 2.335 0.05 . 2 . . . . 18 GLN HG2 . 15965 1 190 . 2 1 18 18 GLN HG3 H 1 2.612 0.05 . 2 . . . . 18 GLN HG3 . 15965 1 191 . 2 1 18 18 GLN CA C 13 59.45 0.5 . 1 . . . . 18 GLN CA . 15965 1 192 . 2 1 18 18 GLN CB C 13 28.71 0.5 . 1 . . . . 18 GLN CB . 15965 1 193 . 2 1 18 18 GLN CG C 13 35.129 0.5 . 1 . . . . 18 GLN CG . 15965 1 194 . 2 1 18 18 GLN N N 15 119.456 0.5 . 1 . . . . 18 GLN N . 15965 1 195 . 2 1 18 18 GLN NE2 N 15 110.982 0.5 . 1 . . . . 18 GLN NE2 . 15965 1 196 . 2 1 19 19 GLU H H 1 8.5 0.05 . 1 . . . . 19 GLU H . 15965 1 197 . 2 1 19 19 GLU HA H 1 4.12 0.05 . 1 . . . . 19 GLU HA . 15965 1 198 . 2 1 19 19 GLU HB2 H 1 2.173 0.05 . 2 . . . . 19 GLU HB2 . 15965 1 199 . 2 1 19 19 GLU HB3 H 1 2.231 0.05 . 2 . . . . 19 GLU HB3 . 15965 1 200 . 2 1 19 19 GLU HG2 H 1 2.514 0.05 . 2 . . . . 19 GLU HG2 . 15965 1 201 . 2 1 19 19 GLU HG3 H 1 2.31 0.05 . 2 . . . . 19 GLU HG3 . 15965 1 202 . 2 1 19 19 GLU CA C 13 59.647 0.5 . 1 . . . . 19 GLU CA . 15965 1 203 . 2 1 19 19 GLU CB C 13 29.625 0.5 . 1 . . . . 19 GLU CB . 15965 1 204 . 2 1 19 19 GLU CG C 13 36.67 0.5 . 1 . . . . 19 GLU CG . 15965 1 205 . 2 1 19 19 GLU N N 15 120.612 0.5 . 1 . . . . 19 GLU N . 15965 1 206 . 2 1 20 20 GLN H H 1 8.424 0.05 . 1 . . . . 20 GLN H . 15965 1 207 . 2 1 20 20 GLN HA H 1 4.285 0.05 . 1 . . . . 20 GLN HA . 15965 1 208 . 2 1 20 20 GLN HB2 H 1 2.095 0.05 . 2 . . . . 20 GLN HB2 . 15965 1 209 . 2 1 20 20 GLN HB3 H 1 2.217 0.05 . 2 . . . . 20 GLN HB3 . 15965 1 210 . 2 1 20 20 GLN HE21 H 1 6.864 0.05 . 2 . . . . 20 GLN HE21 . 15965 1 211 . 2 1 20 20 GLN HE22 H 1 7.394 0.05 . 2 . . . . 20 GLN HE22 . 15965 1 212 . 2 1 20 20 GLN HG2 H 1 2.458 0.05 . 2 . . . . 20 GLN HG2 . 15965 1 213 . 2 1 20 20 GLN HG3 H 1 2.605 0.05 . 2 . . . . 20 GLN HG3 . 15965 1 214 . 2 1 20 20 GLN CA C 13 58.982 0.5 . 1 . . . . 20 GLN CA . 15965 1 215 . 2 1 20 20 GLN CB C 13 28.787 0.5 . 1 . . . . 20 GLN CB . 15965 1 216 . 2 1 20 20 GLN CG C 13 33.921 0.5 . 1 . . . . 20 GLN CG . 15965 1 217 . 2 1 20 20 GLN N N 15 120.205 0.5 . 1 . . . . 20 GLN N . 15965 1 218 . 2 1 20 20 GLN NE2 N 15 111.019 0.5 . 1 . . . . 20 GLN NE2 . 15965 1 219 . 2 1 21 21 ASN H H 1 8.563 0.05 . 1 . . . . 21 ASN H . 15965 1 220 . 2 1 21 21 ASN HA H 1 4.383 0.05 . 1 . . . . 21 ASN HA . 15965 1 221 . 2 1 21 21 ASN HB2 H 1 3.205 0.05 . 1 . . . . 21 ASN HB2 . 15965 1 222 . 2 1 21 21 ASN HB3 H 1 2.751 0.05 . 1 . . . . 21 ASN HB3 . 15965 1 223 . 2 1 21 21 ASN HD21 H 1 6.807 0.05 . 1 . . . . 21 ASN HD21 . 15965 1 224 . 2 1 21 21 ASN HD22 H 1 7.552 0.05 . 1 . . . . 21 ASN HD22 . 15965 1 225 . 2 1 21 21 ASN CA C 13 57.475 0.5 . 1 . . . . 21 ASN CA . 15965 1 226 . 2 1 21 21 ASN CB C 13 38.667 0.5 . 1 . . . . 21 ASN CB . 15965 1 227 . 2 1 21 21 ASN N N 15 120.117 0.5 . 1 . . . . 21 ASN N . 15965 1 228 . 2 1 21 21 ASN ND2 N 15 106.392 0.5 . 1 . . . . 21 ASN ND2 . 15965 1 229 . 2 1 22 22 TYR H H 1 8.115 0.05 . 1 . . . . 22 TYR H . 15965 1 230 . 2 1 22 22 TYR HA H 1 4.394 0.05 . 1 . . . . 22 TYR HA . 15965 1 231 . 2 1 22 22 TYR HB2 H 1 3.2 0.05 . 2 . . . . 22 TYR HB2 . 15965 1 232 . 2 1 22 22 TYR HB3 H 1 3.229 0.05 . 2 . . . . 22 TYR HB3 . 15965 1 233 . 2 1 22 22 TYR HD1 H 1 7.04 0.05 . 3 . . . . 22 TYR HD1 . 15965 1 234 . 2 1 22 22 TYR HD2 H 1 7.04 0.05 . 3 . . . . 22 TYR HD2 . 15965 1 235 . 2 1 22 22 TYR HE1 H 1 6.795 0.05 . 3 . . . . 22 TYR HE1 . 15965 1 236 . 2 1 22 22 TYR HE2 H 1 6.795 0.05 . 3 . . . . 22 TYR HE2 . 15965 1 237 . 2 1 22 22 TYR CA C 13 60.646 0.5 . 1 . . . . 22 TYR CA . 15965 1 238 . 2 1 22 22 TYR CB C 13 37.993 0.5 . 1 . . . . 22 TYR CB . 15965 1 239 . 2 1 22 22 TYR N N 15 120.082 0.5 . 1 . . . . 22 TYR N . 15965 1 240 . 2 1 23 23 HIS H H 1 8.025 0.05 . 1 . . . . 23 HIS H . 15965 1 241 . 2 1 23 23 HIS HA H 1 4.402 0.05 . 1 . . . . 23 HIS HA . 15965 1 242 . 2 1 23 23 HIS HB2 H 1 3.356 0.05 . 2 . . . . 23 HIS HB2 . 15965 1 243 . 2 1 23 23 HIS HB3 H 1 3.356 0.05 . 2 . . . . 23 HIS HB3 . 15965 1 244 . 2 1 23 23 HIS HD2 H 1 7.168 0.05 . 1 . . . . 23 HIS HD2 . 15965 1 245 . 2 1 23 23 HIS CA C 13 59.328 0.5 . 1 . . . . 23 HIS CA . 15965 1 246 . 2 1 23 23 HIS CB C 13 29.518 0.5 . 1 . . . . 23 HIS CB . 15965 1 247 . 2 1 23 23 HIS N N 15 118.108 0.5 . 1 . . . . 23 HIS N . 15965 1 248 . 2 1 24 24 LEU H H 1 8.751 0.05 . 1 . . . . 24 LEU H . 15965 1 249 . 2 1 24 24 LEU HA H 1 3.928 0.05 . 1 . . . . 24 LEU HA . 15965 1 250 . 2 1 24 24 LEU HB2 H 1 2.119 0.05 . 2 . . . . 24 LEU HB2 . 15965 1 251 . 2 1 24 24 LEU HB3 H 1 1.318 0.05 . 2 . . . . 24 LEU HB3 . 15965 1 252 . 2 1 24 24 LEU HD11 H 1 1.014 0.05 . 2 . . . . 24 LEU HD1 . 15965 1 253 . 2 1 24 24 LEU HD12 H 1 1.014 0.05 . 2 . . . . 24 LEU HD1 . 15965 1 254 . 2 1 24 24 LEU HD13 H 1 1.014 0.05 . 2 . . . . 24 LEU HD1 . 15965 1 255 . 2 1 24 24 LEU HD21 H 1 0.88 0.05 . 2 . . . . 24 LEU HD2 . 15965 1 256 . 2 1 24 24 LEU HD22 H 1 0.88 0.05 . 2 . . . . 24 LEU HD2 . 15965 1 257 . 2 1 24 24 LEU HD23 H 1 0.88 0.05 . 2 . . . . 24 LEU HD2 . 15965 1 258 . 2 1 24 24 LEU HG H 1 1.963 0.05 . 1 . . . . 24 LEU HG . 15965 1 259 . 2 1 24 24 LEU CA C 13 58.226 0.5 . 1 . . . . 24 LEU CA . 15965 1 260 . 2 1 24 24 LEU CB C 13 43.778 0.5 . 1 . . . . 24 LEU CB . 15965 1 261 . 2 1 24 24 LEU CD1 C 13 26.836 0.5 . 2 . . . . 24 LEU CD1 . 15965 1 262 . 2 1 24 24 LEU CD2 C 13 23.343 0.5 . 2 . . . . 24 LEU CD2 . 15965 1 263 . 2 1 24 24 LEU CG C 13 27.349 0.5 . 1 . . . . 24 LEU CG . 15965 1 264 . 2 1 24 24 LEU N N 15 120.548 0.5 . 1 . . . . 24 LEU N . 15965 1 265 . 2 1 25 25 GLU H H 1 8.83 0.05 . 1 . . . . 25 GLU H . 15965 1 266 . 2 1 25 25 GLU HA H 1 3.926 0.05 . 1 . . . . 25 GLU HA . 15965 1 267 . 2 1 25 25 GLU HB2 H 1 1.989 0.05 . 2 . . . . 25 GLU HB2 . 15965 1 268 . 2 1 25 25 GLU HB3 H 1 2.179 0.05 . 2 . . . . 25 GLU HB3 . 15965 1 269 . 2 1 25 25 GLU HG2 H 1 2.471 0.05 . 2 . . . . 25 GLU HG2 . 15965 1 270 . 2 1 25 25 GLU HG3 H 1 2.259 0.05 . 2 . . . . 25 GLU HG3 . 15965 1 271 . 2 1 25 25 GLU CA C 13 60.114 0.5 . 1 . . . . 25 GLU CA . 15965 1 272 . 2 1 25 25 GLU CB C 13 29.339 0.5 . 1 . . . . 25 GLU CB . 15965 1 273 . 2 1 25 25 GLU CG C 13 36.82 0.5 . 1 . . . . 25 GLU CG . 15965 1 274 . 2 1 25 25 GLU N N 15 119.875 0.5 . 1 . . . . 25 GLU N . 15965 1 275 . 2 1 26 26 ASN H H 1 7.774 0.05 . 1 . . . . 26 ASN H . 15965 1 276 . 2 1 26 26 ASN HA H 1 4.435 0.05 . 1 . . . . 26 ASN HA . 15965 1 277 . 2 1 26 26 ASN HB2 H 1 2.746 0.05 . 2 . . . . 26 ASN HB2 . 15965 1 278 . 2 1 26 26 ASN HB3 H 1 2.906 0.05 . 2 . . . . 26 ASN HB3 . 15965 1 279 . 2 1 26 26 ASN HD21 H 1 5.863 0.05 . 2 . . . . 26 ASN HD21 . 15965 1 280 . 2 1 26 26 ASN HD22 H 1 7.429 0.05 . 2 . . . . 26 ASN HD22 . 15965 1 281 . 2 1 26 26 ASN CA C 13 56.238 0.5 . 1 . . . . 26 ASN CA . 15965 1 282 . 2 1 26 26 ASN CB C 13 37.945 0.5 . 1 . . . . 26 ASN CB . 15965 1 283 . 2 1 26 26 ASN N N 15 119.022 0.5 . 1 . . . . 26 ASN N . 15965 1 284 . 2 1 26 26 ASN ND2 N 15 111.714 0.5 . 1 . . . . 26 ASN ND2 . 15965 1 285 . 2 1 27 27 GLU H H 1 8.179 0.05 . 1 . . . . 27 GLU H . 15965 1 286 . 2 1 27 27 GLU HA H 1 4.436 0.05 . 1 . . . . 27 GLU HA . 15965 1 287 . 2 1 27 27 GLU HB2 H 1 1.965 0.05 . 2 . . . . 27 GLU HB2 . 15965 1 288 . 2 1 27 27 GLU HB3 H 1 2.155 0.05 . 2 . . . . 27 GLU HB3 . 15965 1 289 . 2 1 27 27 GLU HG2 H 1 2.332 0.05 . 2 . . . . 27 GLU HG2 . 15965 1 290 . 2 1 27 27 GLU HG3 H 1 2.081 0.05 . 2 . . . . 27 GLU HG3 . 15965 1 291 . 2 1 27 27 GLU CA C 13 58.674 0.5 . 1 . . . . 27 GLU CA . 15965 1 292 . 2 1 27 27 GLU CB C 13 30.279 0.5 . 1 . . . . 27 GLU CB . 15965 1 293 . 2 1 27 27 GLU CG C 13 35.939 0.5 . 1 . . . . 27 GLU CG . 15965 1 294 . 2 1 27 27 GLU N N 15 124.075 0.5 . 1 . . . . 27 GLU N . 15965 1 295 . 2 1 28 28 VAL H H 1 8.731 0.05 . 1 . . . . 28 VAL H . 15965 1 296 . 2 1 28 28 VAL HA H 1 3.385 0.05 . 1 . . . . 28 VAL HA . 15965 1 297 . 2 1 28 28 VAL HB H 1 2.125 0.05 . 1 . . . . 28 VAL HB . 15965 1 298 . 2 1 28 28 VAL HG11 H 1 0.881 0.05 . 2 . . . . 28 VAL HG1 . 15965 1 299 . 2 1 28 28 VAL HG12 H 1 0.881 0.05 . 2 . . . . 28 VAL HG1 . 15965 1 300 . 2 1 28 28 VAL HG13 H 1 0.881 0.05 . 2 . . . . 28 VAL HG1 . 15965 1 301 . 2 1 28 28 VAL HG21 H 1 1.027 0.05 . 2 . . . . 28 VAL HG2 . 15965 1 302 . 2 1 28 28 VAL HG22 H 1 1.027 0.05 . 2 . . . . 28 VAL HG2 . 15965 1 303 . 2 1 28 28 VAL HG23 H 1 1.027 0.05 . 2 . . . . 28 VAL HG2 . 15965 1 304 . 2 1 28 28 VAL CA C 13 67.756 0.5 . 1 . . . . 28 VAL CA . 15965 1 305 . 2 1 28 28 VAL CB C 13 31.732 0.5 . 1 . . . . 28 VAL CB . 15965 1 306 . 2 1 28 28 VAL CG1 C 13 21.776 0.5 . 2 . . . . 28 VAL CG1 . 15965 1 307 . 2 1 28 28 VAL CG2 C 13 25.705 0.5 . 2 . . . . 28 VAL CG2 . 15965 1 308 . 2 1 28 28 VAL N N 15 120.425 0.5 . 1 . . . . 28 VAL N . 15965 1 309 . 2 1 29 29 ALA H H 1 7.767 0.05 . 1 . . . . 29 ALA H . 15965 1 310 . 2 1 29 29 ALA HA H 1 4.01 0.05 . 1 . . . . 29 ALA HA . 15965 1 311 . 2 1 29 29 ALA HB1 H 1 1.497 0.05 . 1 . . . . 29 ALA HB . 15965 1 312 . 2 1 29 29 ALA HB2 H 1 1.497 0.05 . 1 . . . . 29 ALA HB . 15965 1 313 . 2 1 29 29 ALA HB3 H 1 1.497 0.05 . 1 . . . . 29 ALA HB . 15965 1 314 . 2 1 29 29 ALA CA C 13 55.524 0.5 . 1 . . . . 29 ALA CA . 15965 1 315 . 2 1 29 29 ALA CB C 13 18.122 0.5 . 1 . . . . 29 ALA CB . 15965 1 316 . 2 1 29 29 ALA N N 15 120.034 0.5 . 1 . . . . 29 ALA N . 15965 1 317 . 2 1 30 30 ARG H H 1 7.994 0.05 . 1 . . . . 30 ARG H . 15965 1 318 . 2 1 30 30 ARG HA H 1 3.965 0.05 . 1 . . . . 30 ARG HA . 15965 1 319 . 2 1 30 30 ARG HB2 H 1 1.879 0.05 . 2 . . . . 30 ARG HB2 . 15965 1 320 . 2 1 30 30 ARG HB3 H 1 2.147 0.05 . 2 . . . . 30 ARG HB3 . 15965 1 321 . 2 1 30 30 ARG HD2 H 1 3.442 0.05 . 2 . . . . 30 ARG HD2 . 15965 1 322 . 2 1 30 30 ARG HD3 H 1 2.987 0.05 . 2 . . . . 30 ARG HD3 . 15965 1 323 . 2 1 30 30 ARG HG2 H 1 1.636 0.05 . 2 . . . . 30 ARG HG2 . 15965 1 324 . 2 1 30 30 ARG HG3 H 1 1.322 0.05 . 2 . . . . 30 ARG HG3 . 15965 1 325 . 2 1 30 30 ARG CA C 13 59.663 0.5 . 1 . . . . 30 ARG CA . 15965 1 326 . 2 1 30 30 ARG CB C 13 30.86 0.5 . 1 . . . . 30 ARG CB . 15965 1 327 . 2 1 30 30 ARG CD C 13 42.916 0.5 . 1 . . . . 30 ARG CD . 15965 1 328 . 2 1 30 30 ARG CG C 13 27.467 0.5 . 1 . . . . 30 ARG CG . 15965 1 329 . 2 1 30 30 ARG N N 15 119.884 0.5 . 1 . . . . 30 ARG N . 15965 1 330 . 2 1 31 31 LEU H H 1 8.516 0.05 . 1 . . . . 31 LEU H . 15965 1 331 . 2 1 31 31 LEU HA H 1 3.964 0.05 . 1 . . . . 31 LEU HA . 15965 1 332 . 2 1 31 31 LEU HB2 H 1 1.329 0.05 . 2 . . . . 31 LEU HB2 . 15965 1 333 . 2 1 31 31 LEU HB3 H 1 1.965 0.05 . 2 . . . . 31 LEU HB3 . 15965 1 334 . 2 1 31 31 LEU HD11 H 1 0.828 0.05 . 2 . . . . 31 LEU HD1 . 15965 1 335 . 2 1 31 31 LEU HD12 H 1 0.828 0.05 . 2 . . . . 31 LEU HD1 . 15965 1 336 . 2 1 31 31 LEU HD13 H 1 0.828 0.05 . 2 . . . . 31 LEU HD1 . 15965 1 337 . 2 1 31 31 LEU HD21 H 1 0.916 0.05 . 2 . . . . 31 LEU HD2 . 15965 1 338 . 2 1 31 31 LEU HD22 H 1 0.916 0.05 . 2 . . . . 31 LEU HD2 . 15965 1 339 . 2 1 31 31 LEU HD23 H 1 0.916 0.05 . 2 . . . . 31 LEU HD2 . 15965 1 340 . 2 1 31 31 LEU HG H 1 1.678 0.05 . 1 . . . . 31 LEU HG . 15965 1 341 . 2 1 31 31 LEU CA C 13 58.141 0.5 . 1 . . . . 31 LEU CA . 15965 1 342 . 2 1 31 31 LEU CB C 13 44.129 0.5 . 1 . . . . 31 LEU CB . 15965 1 343 . 2 1 31 31 LEU CD1 C 13 23.777 0.5 . 2 . . . . 31 LEU CD1 . 15965 1 344 . 2 1 31 31 LEU CD2 C 13 28.076 0.5 . 2 . . . . 31 LEU CD2 . 15965 1 345 . 2 1 31 31 LEU CG C 13 28.083 0.5 . 1 . . . . 31 LEU CG . 15965 1 346 . 2 1 31 31 LEU N N 15 120.609 0.5 . 1 . . . . 31 LEU N . 15965 1 347 . 2 1 32 32 LYS H H 1 9.048 0.05 . 1 . . . . 32 LYS H . 15965 1 348 . 2 1 32 32 LYS HA H 1 3.822 0.05 . 1 . . . . 32 LYS HA . 15965 1 349 . 2 1 32 32 LYS HB2 H 1 1.836 0.05 . 2 . . . . 32 LYS HB2 . 15965 1 350 . 2 1 32 32 LYS HB3 H 1 1.861 0.05 . 2 . . . . 32 LYS HB3 . 15965 1 351 . 2 1 32 32 LYS HD2 H 1 1.628 0.05 . 2 . . . . 32 LYS HD2 . 15965 1 352 . 2 1 32 32 LYS HD3 H 1 1.47 0.05 . 2 . . . . 32 LYS HD3 . 15965 1 353 . 2 1 32 32 LYS HE2 H 1 2.822 0.05 . 2 . . . . 32 LYS HE2 . 15965 1 354 . 2 1 32 32 LYS HE3 H 1 3.08 0.05 . 2 . . . . 32 LYS HE3 . 15965 1 355 . 2 1 32 32 LYS HG2 H 1 1.788 0.05 . 2 . . . . 32 LYS HG2 . 15965 1 356 . 2 1 32 32 LYS HG3 H 1 1.316 0.05 . 2 . . . . 32 LYS HG3 . 15965 1 357 . 2 1 32 32 LYS CA C 13 60.976 0.5 . 1 . . . . 32 LYS CA . 15965 1 358 . 2 1 32 32 LYS CB C 13 32.591 0.5 . 1 . . . . 32 LYS CB . 15965 1 359 . 2 1 32 32 LYS CD C 13 29.919 0.5 . 1 . . . . 32 LYS CD . 15965 1 360 . 2 1 32 32 LYS CE C 13 42.066 0.5 . 1 . . . . 32 LYS CE . 15965 1 361 . 2 1 32 32 LYS CG C 13 27.714 0.5 . 1 . . . . 32 LYS CG . 15965 1 362 . 2 1 32 32 LYS N N 15 118.822 0.5 . 1 . . . . 32 LYS N . 15965 1 363 . 2 1 33 33 LYS H H 1 7.381 0.05 . 1 . . . . 33 LYS H . 15965 1 364 . 2 1 33 33 LYS HA H 1 4.141 0.05 . 1 . . . . 33 LYS HA . 15965 1 365 . 2 1 33 33 LYS HB2 H 1 1.902 0.05 . 2 . . . . 33 LYS HB2 . 15965 1 366 . 2 1 33 33 LYS HB3 H 1 1.964 0.05 . 2 . . . . 33 LYS HB3 . 15965 1 367 . 2 1 33 33 LYS HD2 H 1 1.704 0.05 . 2 . . . . 33 LYS HD2 . 15965 1 368 . 2 1 33 33 LYS HD3 H 1 1.715 0.05 . 2 . . . . 33 LYS HD3 . 15965 1 369 . 2 1 33 33 LYS HE2 H 1 2.989 0.05 . 2 . . . . 33 LYS HE2 . 15965 1 370 . 2 1 33 33 LYS HE3 H 1 2.989 0.05 . 2 . . . . 33 LYS HE3 . 15965 1 371 . 2 1 33 33 LYS HG2 H 1 1.596 0.05 . 2 . . . . 33 LYS HG2 . 15965 1 372 . 2 1 33 33 LYS HG3 H 1 1.454 0.05 . 2 . . . . 33 LYS HG3 . 15965 1 373 . 2 1 33 33 LYS CA C 13 58.987 0.5 . 1 . . . . 33 LYS CA . 15965 1 374 . 2 1 33 33 LYS CB C 13 32.372 0.5 . 1 . . . . 33 LYS CB . 15965 1 375 . 2 1 33 33 LYS CD C 13 29.318 0.5 . 1 . . . . 33 LYS CD . 15965 1 376 . 2 1 33 33 LYS CE C 13 42.272 0.5 . 1 . . . . 33 LYS CE . 15965 1 377 . 2 1 33 33 LYS CG C 13 25.365 0.5 . 1 . . . . 33 LYS CG . 15965 1 378 . 2 1 33 33 LYS N N 15 117.698 0.5 . 1 . . . . 33 LYS N . 15965 1 379 . 2 1 34 34 LEU H H 1 7.475 0.05 . 1 . . . . 34 LEU H . 15965 1 380 . 2 1 34 34 LEU HA H 1 4.185 0.05 . 1 . . . . 34 LEU HA . 15965 1 381 . 2 1 34 34 LEU HB2 H 1 1.621 0.05 . 2 . . . . 34 LEU HB2 . 15965 1 382 . 2 1 34 34 LEU HB3 H 1 2.07 0.05 . 2 . . . . 34 LEU HB3 . 15965 1 383 . 2 1 34 34 LEU HD11 H 1 0.953 0.05 . 2 . . . . 34 LEU HD1 . 15965 1 384 . 2 1 34 34 LEU HD12 H 1 0.953 0.05 . 2 . . . . 34 LEU HD1 . 15965 1 385 . 2 1 34 34 LEU HD13 H 1 0.953 0.05 . 2 . . . . 34 LEU HD1 . 15965 1 386 . 2 1 34 34 LEU HD21 H 1 0.903 0.05 . 2 . . . . 34 LEU HD2 . 15965 1 387 . 2 1 34 34 LEU HD22 H 1 0.903 0.05 . 2 . . . . 34 LEU HD2 . 15965 1 388 . 2 1 34 34 LEU HD23 H 1 0.903 0.05 . 2 . . . . 34 LEU HD2 . 15965 1 389 . 2 1 34 34 LEU HG H 1 1.838 0.05 . 1 . . . . 34 LEU HG . 15965 1 390 . 2 1 34 34 LEU CA C 13 57.475 0.5 . 1 . . . . 34 LEU CA . 15965 1 391 . 2 1 34 34 LEU CB C 13 42.687 0.5 . 1 . . . . 34 LEU CB . 15965 1 392 . 2 1 34 34 LEU CD1 C 13 25.614 0.5 . 2 . . . . 34 LEU CD1 . 15965 1 393 . 2 1 34 34 LEU CD2 C 13 23.377 0.5 . 2 . . . . 34 LEU CD2 . 15965 1 394 . 2 1 34 34 LEU CG C 13 26.875 0.5 . 1 . . . . 34 LEU CG . 15965 1 395 . 2 1 34 34 LEU N N 15 118.971 0.5 . 1 . . . . 34 LEU N . 15965 1 396 . 2 1 35 35 VAL H H 1 7.794 0.05 . 1 . . . . 35 VAL H . 15965 1 397 . 2 1 35 35 VAL HA H 1 4.086 0.05 . 1 . . . . 35 VAL HA . 15965 1 398 . 2 1 35 35 VAL HB H 1 2.239 0.05 . 1 . . . . 35 VAL HB . 15965 1 399 . 2 1 35 35 VAL HG11 H 1 0.932 0.05 . 2 . . . . 35 VAL HG1 . 15965 1 400 . 2 1 35 35 VAL HG12 H 1 0.932 0.05 . 2 . . . . 35 VAL HG1 . 15965 1 401 . 2 1 35 35 VAL HG13 H 1 0.932 0.05 . 2 . . . . 35 VAL HG1 . 15965 1 402 . 2 1 35 35 VAL HG21 H 1 0.988 0.05 . 2 . . . . 35 VAL HG2 . 15965 1 403 . 2 1 35 35 VAL HG22 H 1 0.988 0.05 . 2 . . . . 35 VAL HG2 . 15965 1 404 . 2 1 35 35 VAL HG23 H 1 0.988 0.05 . 2 . . . . 35 VAL HG2 . 15965 1 405 . 2 1 35 35 VAL CA C 13 62.99 0.5 . 1 . . . . 35 VAL CA . 15965 1 406 . 2 1 35 35 VAL CB C 13 32.638 0.5 . 1 . . . . 35 VAL CB . 15965 1 407 . 2 1 35 35 VAL CG1 C 13 21.982 0.5 . 2 . . . . 35 VAL CG1 . 15965 1 408 . 2 1 35 35 VAL CG2 C 13 21.982 0.5 . 2 . . . . 35 VAL CG2 . 15965 1 409 . 2 1 35 35 VAL N N 15 113.834 0.5 . 1 . . . . 35 VAL N . 15965 1 410 . 2 1 36 36 GLY H H 1 7.873 0.05 . 1 . . . . 36 GLY H . 15965 1 411 . 2 1 36 36 GLY HA2 H 1 3.88 0.05 . 2 . . . . 36 GLY HA2 . 15965 1 412 . 2 1 36 36 GLY HA3 H 1 4.099 0.05 . 2 . . . . 36 GLY HA3 . 15965 1 413 . 2 1 36 36 GLY CA C 13 45.946 0.5 . 1 . . . . 36 GLY CA . 15965 1 414 . 2 1 36 36 GLY N N 15 109.267 0.5 . 1 . . . . 36 GLY N . 15965 1 415 . 2 1 37 37 GLU H H 1 7.978 0.05 . 1 . . . . 37 GLU H . 15965 1 416 . 2 1 37 37 GLU HA H 1 4.357 0.05 . 1 . . . . 37 GLU HA . 15965 1 417 . 2 1 37 37 GLU HB2 H 1 2.038 0.05 . 2 . . . . 37 GLU HB2 . 15965 1 418 . 2 1 37 37 GLU HB3 H 1 1.738 0.05 . 2 . . . . 37 GLU HB3 . 15965 1 419 . 2 1 37 37 GLU HG2 H 1 2.25 0.05 . 2 . . . . 37 GLU HG2 . 15965 1 420 . 2 1 37 37 GLU HG3 H 1 2.25 0.05 . 2 . . . . 37 GLU HG3 . 15965 1 421 . 2 1 37 37 GLU CA C 13 56.352 0.5 . 1 . . . . 37 GLU CA . 15965 1 422 . 2 1 37 37 GLU CB C 13 31.523 0.5 . 1 . . . . 37 GLU CB . 15965 1 423 . 2 1 37 37 GLU CG C 13 36.766 0.5 . 1 . . . . 37 GLU CG . 15965 1 424 . 2 1 37 37 GLU N N 15 120.938 0.5 . 1 . . . . 37 GLU N . 15965 1 425 . 2 1 38 38 ARG H H 1 7.983 0.05 . 1 . . . . 38 ARG H . 15965 1 426 . 2 1 38 38 ARG HA H 1 4.13 0.05 . 1 . . . . 38 ARG HA . 15965 1 427 . 2 1 38 38 ARG HB2 H 1 1.677 0.05 . 2 . . . . 38 ARG HB2 . 15965 1 428 . 2 1 38 38 ARG HB3 H 1 1.823 0.05 . 2 . . . . 38 ARG HB3 . 15965 1 429 . 2 1 38 38 ARG HD2 H 1 3.196 0.05 . 2 . . . . 38 ARG HD2 . 15965 1 430 . 2 1 38 38 ARG HD3 H 1 3.196 0.05 . 2 . . . . 38 ARG HD3 . 15965 1 431 . 2 1 38 38 ARG HG2 H 1 1.614 0.05 . 2 . . . . 38 ARG HG2 . 15965 1 432 . 2 1 38 38 ARG HG3 H 1 1.614 0.05 . 2 . . . . 38 ARG HG3 . 15965 1 433 . 2 1 38 38 ARG CA C 13 57.541 0.5 . 1 . . . . 38 ARG CA . 15965 1 434 . 2 1 38 38 ARG CB C 13 31.666 0.5 . 1 . . . . 38 ARG CB . 15965 1 435 . 2 1 38 38 ARG CD C 13 43.524 0.5 . 1 . . . . 38 ARG CD . 15965 1 436 . 2 1 38 38 ARG CG C 13 27.455 0.5 . 1 . . . . 38 ARG CG . 15965 1 437 . 2 1 38 38 ARG N N 15 127.3 0.5 . 1 . . . . 38 ARG N . 15965 1 stop_ save_