################################### # 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 15701 _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 15701 1 2 '3D HNCA' . . . 15701 1 3 '3D CBCA(CO)NH' . . . 15701 1 4 '3D HBHA(CO)NH' . . . 15701 1 5 '3D H(CCO)NH' . . . 15701 1 6 '3D C(CO)NH' . . . 15701 1 7 '3D HCCH-TOCSY' . . . 15701 1 8 '3D (H)CCH-TOCSY' . . . 15701 1 9 '3D 1H-15N NOESY' . . . 15701 1 10 '3D 1H-13C NOESY' . . . 15701 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 $NMRPipe . . 15701 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.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 4.44 0.0300 . 2 . . . . . 1 GLY HA2 . 15701 1 2 . 1 1 1 1 GLY HA3 H 1 3.72 0.0300 . 2 . . . . . 1 GLY HA3 . 15701 1 3 . 1 1 1 1 GLY CA C 13 44.81 0.4000 . 1 . . . . . 1 GLY CA . 15701 1 4 . 1 1 2 2 SER H H 1 8.70 0.0300 . 1 . . . . . 2 SER H . 15701 1 5 . 1 1 2 2 SER N N 15 121.24 0.4000 . 1 . . . . . 2 SER N . 15701 1 6 . 1 1 4 4 MET HA H 1 4.30 0.0300 . 1 . . . . . 4 MET HA . 15701 1 7 . 1 1 4 4 MET HB2 H 1 2.11 0.0300 . 2 . . . . . 4 MET HB2 . 15701 1 8 . 1 1 4 4 MET HB3 H 1 1.94 0.0300 . 2 . . . . . 4 MET HB3 . 15701 1 9 . 1 1 4 4 MET HG2 H 1 2.30 0.0300 . 2 . . . . . 4 MET HG2 . 15701 1 10 . 1 1 4 4 MET HG3 H 1 2.30 0.0300 . 2 . . . . . 4 MET HG3 . 15701 1 11 . 1 1 4 4 MET C C 13 172.22 0.4000 . 1 . . . . . 4 MET C . 15701 1 12 . 1 1 4 4 MET CA C 13 55.62 0.4000 . 1 . . . . . 4 MET CA . 15701 1 13 . 1 1 4 4 MET CB C 13 29.60 0.4000 . 1 . . . . . 4 MET CB . 15701 1 14 . 1 1 4 4 MET CG C 13 33.97 0.4000 . 1 . . . . . 4 MET CG . 15701 1 15 . 1 1 5 5 MET H H 1 7.98 0.0300 . 1 . . . . . 5 MET H . 15701 1 16 . 1 1 5 5 MET HA H 1 4.11 0.0300 . 1 . . . . . 5 MET HA . 15701 1 17 . 1 1 5 5 MET HB2 H 1 2.09 0.0300 . 2 . . . . . 5 MET HB2 . 15701 1 18 . 1 1 5 5 MET HB3 H 1 1.89 0.0300 . 2 . . . . . 5 MET HB3 . 15701 1 19 . 1 1 5 5 MET HG2 H 1 2.26 0.0300 . 2 . . . . . 5 MET HG2 . 15701 1 20 . 1 1 5 5 MET HG3 H 1 2.26 0.0300 . 2 . . . . . 5 MET HG3 . 15701 1 21 . 1 1 5 5 MET CA C 13 57.64 0.4000 . 1 . . . . . 5 MET CA . 15701 1 22 . 1 1 5 5 MET CB C 13 30.34 0.4000 . 1 . . . . . 5 MET CB . 15701 1 23 . 1 1 5 5 MET CG C 13 34.52 0.4000 . 1 . . . . . 5 MET CG . 15701 1 24 . 1 1 5 5 MET N N 15 126.78 0.4000 . 1 . . . . . 5 MET N . 15701 1 25 . 1 1 6 6 HIS HA H 1 4.57 0.0300 . 1 . . . . . 6 HIS HA . 15701 1 26 . 1 1 6 6 HIS HB2 H 1 3.03 0.0300 . 2 . . . . . 6 HIS HB2 . 15701 1 27 . 1 1 6 6 HIS HB3 H 1 3.03 0.0300 . 2 . . . . . 6 HIS HB3 . 15701 1 28 . 1 1 6 6 HIS HD2 H 1 6.93 0.0300 . 1 . . . . . 6 HIS HD2 . 15701 1 29 . 1 1 6 6 HIS HE1 H 1 7.50 0.0300 . 1 . . . . . 6 HIS HE1 . 15701 1 30 . 1 1 6 6 HIS CA C 13 56.65 0.4000 . 1 . . . . . 6 HIS CA . 15701 1 31 . 1 1 6 6 HIS CB C 13 31.07 0.4000 . 1 . . . . . 6 HIS CB . 15701 1 32 . 1 1 6 6 HIS CD2 C 13 117.10 0.4000 . 1 . . . . . 6 HIS CD2 . 15701 1 33 . 1 1 6 6 HIS CE1 C 13 134.90 0.4000 . 1 . . . . . 6 HIS CE1 . 15701 1 34 . 1 1 7 7 SER HA H 1 4.12 0.0300 . 1 . . . . . 7 SER HA . 15701 1 35 . 1 1 7 7 SER HB2 H 1 3.87 0.0300 . 2 . . . . . 7 SER HB2 . 15701 1 36 . 1 1 7 7 SER HB3 H 1 3.87 0.0300 . 2 . . . . . 7 SER HB3 . 15701 1 37 . 1 1 7 7 SER CA C 13 60.90 0.4000 . 1 . . . . . 7 SER CA . 15701 1 38 . 1 1 7 7 SER CB C 13 63.39 0.4000 . 1 . . . . . 7 SER CB . 15701 1 39 . 1 1 8 8 ALA HA H 1 4.27 0.0300 . 1 . . . . . 8 ALA HA . 15701 1 40 . 1 1 8 8 ALA HB1 H 1 1.36 0.0300 . 1 . . . . . 8 ALA HB . 15701 1 41 . 1 1 8 8 ALA HB2 H 1 1.36 0.0300 . 1 . . . . . 8 ALA HB . 15701 1 42 . 1 1 8 8 ALA HB3 H 1 1.36 0.0300 . 1 . . . . . 8 ALA HB . 15701 1 43 . 1 1 8 8 ALA C C 13 175.24 0.4000 . 1 . . . . . 8 ALA C . 15701 1 44 . 1 1 8 8 ALA CA C 13 52.89 0.4000 . 1 . . . . . 8 ALA CA . 15701 1 45 . 1 1 8 8 ALA CB C 13 19.15 0.4000 . 1 . . . . . 8 ALA CB . 15701 1 46 . 1 1 9 9 LEU H H 1 8.03 0.0300 . 1 . . . . . 9 LEU H . 15701 1 47 . 1 1 9 9 LEU HA H 1 4.21 0.0300 . 1 . . . . . 9 LEU HA . 15701 1 48 . 1 1 9 9 LEU HB2 H 1 1.57 0.0300 . 2 . . . . . 9 LEU HB2 . 15701 1 49 . 1 1 9 9 LEU HB3 H 1 1.57 0.0300 . 2 . . . . . 9 LEU HB3 . 15701 1 50 . 1 1 9 9 LEU HD11 H 1 0.78 0.0300 . 2 . . . . . 9 LEU HD1 . 15701 1 51 . 1 1 9 9 LEU HD12 H 1 0.78 0.0300 . 2 . . . . . 9 LEU HD1 . 15701 1 52 . 1 1 9 9 LEU HD13 H 1 0.78 0.0300 . 2 . . . . . 9 LEU HD1 . 15701 1 53 . 1 1 9 9 LEU HD21 H 1 0.84 0.0300 . 2 . . . . . 9 LEU HD2 . 15701 1 54 . 1 1 9 9 LEU HD22 H 1 0.84 0.0300 . 2 . . . . . 9 LEU HD2 . 15701 1 55 . 1 1 9 9 LEU HD23 H 1 0.84 0.0300 . 2 . . . . . 9 LEU HD2 . 15701 1 56 . 1 1 9 9 LEU HG H 1 1.47 0.0300 . 1 . . . . . 9 LEU HG . 15701 1 57 . 1 1 9 9 LEU C C 13 171.29 0.4000 . 1 . . . . . 9 LEU C . 15701 1 58 . 1 1 9 9 LEU CA C 13 55.69 0.4000 . 1 . . . . . 9 LEU CA . 15701 1 59 . 1 1 9 9 LEU CB C 13 42.37 0.4000 . 1 . . . . . 9 LEU CB . 15701 1 60 . 1 1 9 9 LEU CD1 C 13 24.92 0.4000 . 1 . . . . . 9 LEU CD1 . 15701 1 61 . 1 1 9 9 LEU CD2 C 13 23.32 0.4000 . 1 . . . . . 9 LEU CD2 . 15701 1 62 . 1 1 9 9 LEU CG C 13 27.00 0.4000 . 1 . . . . . 9 LEU CG . 15701 1 63 . 1 1 9 9 LEU N N 15 120.26 0.4000 . 1 . . . . . 9 LEU N . 15701 1 64 . 1 1 11 11 MET H H 1 8.07 0.0300 . 1 . . . . . 11 MET H . 15701 1 65 . 1 1 11 11 MET HA H 1 4.36 0.0300 . 1 . . . . . 11 MET HA . 15701 1 66 . 1 1 11 11 MET HB2 H 1 2.39 0.0300 . 2 . . . . . 11 MET HB2 . 15701 1 67 . 1 1 11 11 MET HB3 H 1 2.39 0.0300 . 2 . . . . . 11 MET HB3 . 15701 1 68 . 1 1 11 11 MET HG2 H 1 1.95 0.0300 . 2 . . . . . 11 MET HG2 . 15701 1 69 . 1 1 11 11 MET HG3 H 1 1.95 0.0300 . 2 . . . . . 11 MET HG3 . 15701 1 70 . 1 1 11 11 MET C C 13 174.36 0.4000 . 1 . . . . . 11 MET C . 15701 1 71 . 1 1 11 11 MET CA C 13 56.00 0.4000 . 1 . . . . . 11 MET CA . 15701 1 72 . 1 1 11 11 MET CB C 13 31.89 0.4000 . 1 . . . . . 11 MET CB . 15701 1 73 . 1 1 11 11 MET CG C 13 32.60 0.4000 . 1 . . . . . 11 MET CG . 15701 1 74 . 1 1 11 11 MET N N 15 120.32 0.4000 . 1 . . . . . 11 MET N . 15701 1 75 . 1 1 12 12 THR H H 1 8.12 0.0300 . 1 . . . . . 12 THR H . 15701 1 76 . 1 1 12 12 THR HA H 1 4.01 0.0300 . 1 . . . . . 12 THR HA . 15701 1 77 . 1 1 12 12 THR HB H 1 4.17 0.0300 . 1 . . . . . 12 THR HB . 15701 1 78 . 1 1 12 12 THR HG21 H 1 1.21 0.0300 . 1 . . . . . 12 THR HG2 . 15701 1 79 . 1 1 12 12 THR HG22 H 1 1.21 0.0300 . 1 . . . . . 12 THR HG2 . 15701 1 80 . 1 1 12 12 THR HG23 H 1 1.21 0.0300 . 1 . . . . . 12 THR HG2 . 15701 1 81 . 1 1 12 12 THR C C 13 173.19 0.4000 . 1 . . . . . 12 THR C . 15701 1 82 . 1 1 12 12 THR CA C 13 65.05 0.4000 . 1 . . . . . 12 THR CA . 15701 1 83 . 1 1 12 12 THR CB C 13 69.04 0.4000 . 1 . . . . . 12 THR CB . 15701 1 84 . 1 1 12 12 THR CG2 C 13 21.60 0.4000 . 1 . . . . . 12 THR CG2 . 15701 1 85 . 1 1 12 12 THR N N 15 113.77 0.4000 . 1 . . . . . 12 THR N . 15701 1 86 . 1 1 13 13 ARG H H 1 7.88 0.0300 . 1 . . . . . 13 ARG H . 15701 1 87 . 1 1 13 13 ARG HA H 1 4.06 0.0300 . 1 . . . . . 13 ARG HA . 15701 1 88 . 1 1 13 13 ARG HB2 H 1 1.68 0.0300 . 2 . . . . . 13 ARG HB2 . 15701 1 89 . 1 1 13 13 ARG HB3 H 1 1.68 0.0300 . 2 . . . . . 13 ARG HB3 . 15701 1 90 . 1 1 13 13 ARG HD2 H 1 3.08 0.0300 . 2 . . . . . 13 ARG HD2 . 15701 1 91 . 1 1 13 13 ARG HD3 H 1 3.08 0.0300 . 2 . . . . . 13 ARG HD3 . 15701 1 92 . 1 1 13 13 ARG HG2 H 1 1.47 0.0300 . 2 . . . . . 13 ARG HG2 . 15701 1 93 . 1 1 13 13 ARG HG3 H 1 1.47 0.0300 . 2 . . . . . 13 ARG HG3 . 15701 1 94 . 1 1 13 13 ARG C C 13 174.72 0.4000 . 1 . . . . . 13 ARG C . 15701 1 95 . 1 1 13 13 ARG CA C 13 57.90 0.4000 . 1 . . . . . 13 ARG CA . 15701 1 96 . 1 1 13 13 ARG CB C 13 30.11 0.4000 . 1 . . . . . 13 ARG CB . 15701 1 97 . 1 1 13 13 ARG CD C 13 43.41 0.4000 . 1 . . . . . 13 ARG CD . 15701 1 98 . 1 1 13 13 ARG CG C 13 26.91 0.4000 . 1 . . . . . 13 ARG CG . 15701 1 99 . 1 1 13 13 ARG N N 15 120.97 0.4000 . 1 . . . . . 13 ARG N . 15701 1 100 . 1 1 14 14 TYR H H 1 7.80 0.0300 . 1 . . . . . 14 TYR H . 15701 1 101 . 1 1 14 14 TYR HA H 1 4.33 0.0300 . 1 . . . . . 14 TYR HA . 15701 1 102 . 1 1 14 14 TYR HB2 H 1 2.84 0.0300 . 2 . . . . . 14 TYR HB2 . 15701 1 103 . 1 1 14 14 TYR HB3 H 1 2.84 0.0300 . 2 . . . . . 14 TYR HB3 . 15701 1 104 . 1 1 14 14 TYR HD1 H 1 6.82 0.0300 . 1 . . . . . 14 TYR HD1 . 15701 1 105 . 1 1 14 14 TYR HD2 H 1 6.82 0.0300 . 1 . . . . . 14 TYR HD2 . 15701 1 106 . 1 1 14 14 TYR HE1 H 1 6.64 0.0300 . 1 . . . . . 14 TYR HE1 . 15701 1 107 . 1 1 14 14 TYR HE2 H 1 6.64 0.0300 . 1 . . . . . 14 TYR HE2 . 15701 1 108 . 1 1 14 14 TYR C C 13 174.09 0.4000 . 1 . . . . . 14 TYR C . 15701 1 109 . 1 1 14 14 TYR CA C 13 59.72 0.4000 . 1 . . . . . 14 TYR CA . 15701 1 110 . 1 1 14 14 TYR CB C 13 38.21 0.4000 . 1 . . . . . 14 TYR CB . 15701 1 111 . 1 1 14 14 TYR CD1 C 13 130.50 0.4000 . 1 . . . . . 14 TYR CD1 . 15701 1 112 . 1 1 14 14 TYR CD2 C 13 130.50 0.4000 . 1 . . . . . 14 TYR CD2 . 15701 1 113 . 1 1 14 14 TYR CE1 C 13 115.40 0.4000 . 1 . . . . . 14 TYR CE1 . 15701 1 114 . 1 1 14 14 TYR CE2 C 13 115.40 0.4000 . 1 . . . . . 14 TYR CE2 . 15701 1 115 . 1 1 14 14 TYR N N 15 120.40 0.4000 . 1 . . . . . 14 TYR N . 15701 1 116 . 1 1 15 15 TRP H H 1 8.12 0.0300 . 1 . . . . . 15 TRP H . 15701 1 117 . 1 1 15 15 TRP HA H 1 4.61 0.0300 . 1 . . . . . 15 TRP HA . 15701 1 118 . 1 1 15 15 TRP HB2 H 1 3.45 0.0300 . 2 . . . . . 15 TRP HB2 . 15701 1 119 . 1 1 15 15 TRP HB3 H 1 3.35 0.0300 . 2 . . . . . 15 TRP HB3 . 15701 1 120 . 1 1 15 15 TRP HD1 H 1 7.19 0.0300 . 1 . . . . . 15 TRP HD1 . 15701 1 121 . 1 1 15 15 TRP HE1 H 1 10.33 0.0300 . 1 . . . . . 15 TRP HE1 . 15701 1 122 . 1 1 15 15 TRP HE3 H 1 7.52 0.0300 . 1 . . . . . 15 TRP HE3 . 15701 1 123 . 1 1 15 15 TRP HH2 H 1 7.09 0.0300 . 1 . . . . . 15 TRP HH2 . 15701 1 124 . 1 1 15 15 TRP HZ2 H 1 7.50 0.0300 . 1 . . . . . 15 TRP HZ2 . 15701 1 125 . 1 1 15 15 TRP HZ3 H 1 7.20 0.0300 . 1 . . . . . 15 TRP HZ3 . 15701 1 126 . 1 1 15 15 TRP C C 13 174.13 0.4000 . 1 . . . . . 15 TRP C . 15701 1 127 . 1 1 15 15 TRP CA C 13 57.94 0.4000 . 1 . . . . . 15 TRP CA . 15701 1 128 . 1 1 15 15 TRP CB C 13 29.62 0.4000 . 1 . . . . . 15 TRP CB . 15701 1 129 . 1 1 15 15 TRP CD1 C 13 124.30 0.4000 . 1 . . . . . 15 TRP CD1 . 15701 1 130 . 1 1 15 15 TRP CE3 C 13 118.50 0.4000 . 1 . . . . . 15 TRP CE3 . 15701 1 131 . 1 1 15 15 TRP CZ2 C 13 112.10 0.4000 . 1 . . . . . 15 TRP CZ2 . 15701 1 132 . 1 1 15 15 TRP CZ3 C 13 122.10 0.4000 . 1 . . . . . 15 TRP CZ3 . 15701 1 133 . 1 1 15 15 TRP N N 15 120.37 0.4000 . 1 . . . . . 15 TRP N . 15701 1 134 . 1 1 15 15 TRP NE1 N 15 129.21 0.4000 . 1 . . . . . 15 TRP NE1 . 15701 1 135 . 1 1 16 16 ARG H H 1 7.86 0.0300 . 1 . . . . . 16 ARG H . 15701 1 136 . 1 1 16 16 ARG HA H 1 4.19 0.0300 . 1 . . . . . 16 ARG HA . 15701 1 137 . 1 1 16 16 ARG HB2 H 1 1.80 0.0300 . 2 . . . . . 16 ARG HB2 . 15701 1 138 . 1 1 16 16 ARG HB3 H 1 1.80 0.0300 . 2 . . . . . 16 ARG HB3 . 15701 1 139 . 1 1 16 16 ARG HD2 H 1 3.19 0.0300 . 2 . . . . . 16 ARG HD2 . 15701 1 140 . 1 1 16 16 ARG HD3 H 1 3.19 0.0300 . 2 . . . . . 16 ARG HD3 . 15701 1 141 . 1 1 16 16 ARG HG2 H 1 1.59 0.0300 . 2 . . . . . 16 ARG HG2 . 15701 1 142 . 1 1 16 16 ARG HG3 H 1 1.59 0.0300 . 2 . . . . . 16 ARG HG3 . 15701 1 143 . 1 1 16 16 ARG CA C 13 57.59 0.4000 . 1 . . . . . 16 ARG CA . 15701 1 144 . 1 1 16 16 ARG CB C 13 30.64 0.4000 . 1 . . . . . 16 ARG CB . 15701 1 145 . 1 1 16 16 ARG CD C 13 43.38 0.4000 . 1 . . . . . 16 ARG CD . 15701 1 146 . 1 1 16 16 ARG CG C 13 27.02 0.4000 . 1 . . . . . 16 ARG CG . 15701 1 147 . 1 1 16 16 ARG N N 15 119.77 0.4000 . 1 . . . . . 16 ARG N . 15701 1 148 . 1 1 17 17 GLN HA H 1 4.12 0.0300 . 1 . . . . . 17 GLN HA . 15701 1 149 . 1 1 17 17 GLN HB2 H 1 2.05 0.0300 . 2 . . . . . 17 GLN HB2 . 15701 1 150 . 1 1 17 17 GLN HB3 H 1 2.05 0.0300 . 2 . . . . . 17 GLN HB3 . 15701 1 151 . 1 1 17 17 GLN HG2 H 1 2.35 0.0300 . 2 . . . . . 17 GLN HG2 . 15701 1 152 . 1 1 17 17 GLN HG3 H 1 2.35 0.0300 . 2 . . . . . 17 GLN HG3 . 15701 1 153 . 1 1 17 17 GLN C C 13 174.83 0.4000 . 1 . . . . . 17 GLN C . 15701 1 154 . 1 1 17 17 GLN CA C 13 57.41 0.4000 . 1 . . . . . 17 GLN CA . 15701 1 155 . 1 1 17 17 GLN CB C 13 28.56 0.4000 . 1 . . . . . 17 GLN CB . 15701 1 156 . 1 1 17 17 GLN CG C 13 33.96 0.4000 . 1 . . . . . 17 GLN CG . 15701 1 157 . 1 1 18 18 LEU H H 1 8.04 0.0300 . 1 . . . . . 18 LEU H . 15701 1 158 . 1 1 18 18 LEU HA H 1 4.06 0.0300 . 1 . . . . . 18 LEU HA . 15701 1 159 . 1 1 18 18 LEU HB2 H 1 1.30 0.0300 . 2 . . . . . 18 LEU HB2 . 15701 1 160 . 1 1 18 18 LEU HB3 H 1 1.30 0.0300 . 2 . . . . . 18 LEU HB3 . 15701 1 161 . 1 1 18 18 LEU HD11 H 1 0.64 0.0300 . 2 . . . . . 18 LEU HD1 . 15701 1 162 . 1 1 18 18 LEU HD12 H 1 0.64 0.0300 . 2 . . . . . 18 LEU HD1 . 15701 1 163 . 1 1 18 18 LEU HD13 H 1 0.64 0.0300 . 2 . . . . . 18 LEU HD1 . 15701 1 164 . 1 1 18 18 LEU HD21 H 1 0.50 0.0300 . 2 . . . . . 18 LEU HD2 . 15701 1 165 . 1 1 18 18 LEU HD22 H 1 0.50 0.0300 . 2 . . . . . 18 LEU HD2 . 15701 1 166 . 1 1 18 18 LEU HD23 H 1 0.50 0.0300 . 2 . . . . . 18 LEU HD2 . 15701 1 167 . 1 1 18 18 LEU HG H 1 1.18 0.0300 . 1 . . . . . 18 LEU HG . 15701 1 168 . 1 1 18 18 LEU C C 13 174.38 0.4000 . 1 . . . . . 18 LEU C . 15701 1 169 . 1 1 18 18 LEU CA C 13 56.65 0.4000 . 1 . . . . . 18 LEU CA . 15701 1 170 . 1 1 18 18 LEU CB C 13 41.63 0.4000 . 1 . . . . . 18 LEU CB . 15701 1 171 . 1 1 18 18 LEU CD1 C 13 24.47 0.4000 . 1 . . . . . 18 LEU CD1 . 15701 1 172 . 1 1 18 18 LEU CD2 C 13 23.98 0.4000 . 1 . . . . . 18 LEU CD2 . 15701 1 173 . 1 1 18 18 LEU CG C 13 26.77 0.4000 . 1 . . . . . 18 LEU CG . 15701 1 174 . 1 1 18 18 LEU N N 15 122.82 0.4000 . 1 . . . . . 18 LEU N . 15701 1 175 . 1 1 19 19 ASP H H 1 8.24 0.0300 . 1 . . . . . 19 ASP H . 15701 1 176 . 1 1 19 19 ASP HA H 1 4.44 0.0300 . 1 . . . . . 19 ASP HA . 15701 1 177 . 1 1 19 19 ASP HB2 H 1 2.69 0.0300 . 2 . . . . . 19 ASP HB2 . 15701 1 178 . 1 1 19 19 ASP HB3 H 1 2.63 0.0300 . 2 . . . . . 19 ASP HB3 . 15701 1 179 . 1 1 19 19 ASP C C 13 174.53 0.4000 . 1 . . . . . 19 ASP C . 15701 1 180 . 1 1 19 19 ASP CA C 13 56.00 0.4000 . 1 . . . . . 19 ASP CA . 15701 1 181 . 1 1 19 19 ASP CB C 13 40.87 0.4000 . 1 . . . . . 19 ASP CB . 15701 1 182 . 1 1 19 19 ASP N N 15 119.10 0.4000 . 1 . . . . . 19 ASP N . 15701 1 183 . 1 1 20 20 ASP H H 1 8.08 0.0300 . 1 . . . . . 20 ASP H . 15701 1 184 . 1 1 20 20 ASP HA H 1 4.44 0.0300 . 1 . . . . . 20 ASP HA . 15701 1 185 . 1 1 20 20 ASP HB2 H 1 2.69 0.0300 . 2 . . . . . 20 ASP HB2 . 15701 1 186 . 1 1 20 20 ASP HB3 H 1 2.63 0.0300 . 2 . . . . . 20 ASP HB3 . 15701 1 187 . 1 1 20 20 ASP CA C 13 56.00 0.4000 . 1 . . . . . 20 ASP CA . 15701 1 188 . 1 1 20 20 ASP CB C 13 40.87 0.4000 . 1 . . . . . 20 ASP CB . 15701 1 189 . 1 1 20 20 ASP N N 15 121.04 0.4000 . 1 . . . . . 20 ASP N . 15701 1 190 . 1 1 21 21 GLU HA H 1 4.21 0.0300 . 1 . . . . . 21 GLU HA . 15701 1 191 . 1 1 21 21 GLU HB2 H 1 2.03 0.0300 . 2 . . . . . 21 GLU HB2 . 15701 1 192 . 1 1 21 21 GLU HB3 H 1 1.95 0.0300 . 2 . . . . . 21 GLU HB3 . 15701 1 193 . 1 1 21 21 GLU HG2 H 1 2.26 0.0300 . 2 . . . . . 21 GLU HG2 . 15701 1 194 . 1 1 21 21 GLU HG3 H 1 2.18 0.0300 . 2 . . . . . 21 GLU HG3 . 15701 1 195 . 1 1 21 21 GLU C C 13 174.11 0.4000 . 1 . . . . . 21 GLU C . 15701 1 196 . 1 1 21 21 GLU CA C 13 57.07 0.4000 . 1 . . . . . 21 GLU CA . 15701 1 197 . 1 1 21 21 GLU CB C 13 30.19 0.4000 . 1 . . . . . 21 GLU CB . 15701 1 198 . 1 1 21 21 GLU CG C 13 36.45 0.4000 . 1 . . . . . 21 GLU CG . 15701 1 199 . 1 1 22 22 VAL H H 1 7.99 0.0300 . 1 . . . . . 22 VAL H . 15701 1 200 . 1 1 22 22 VAL HA H 1 4.02 0.0300 . 1 . . . . . 22 VAL HA . 15701 1 201 . 1 1 22 22 VAL HB H 1 2.05 0.0300 . 1 . . . . . 22 VAL HB . 15701 1 202 . 1 1 22 22 VAL HG11 H 1 0.89 0.0300 . 2 . . . . . 22 VAL HG1 . 15701 1 203 . 1 1 22 22 VAL HG12 H 1 0.89 0.0300 . 2 . . . . . 22 VAL HG1 . 15701 1 204 . 1 1 22 22 VAL HG13 H 1 0.89 0.0300 . 2 . . . . . 22 VAL HG1 . 15701 1 205 . 1 1 22 22 VAL C C 13 173.34 0.4000 . 1 . . . . . 22 VAL C . 15701 1 206 . 1 1 22 22 VAL CA C 13 62.47 0.4000 . 1 . . . . . 22 VAL CA . 15701 1 207 . 1 1 22 22 VAL CB C 13 32.52 0.4000 . 1 . . . . . 22 VAL CB . 15701 1 208 . 1 1 22 22 VAL CG1 C 13 21.05 0.4000 . 1 . . . . . 22 VAL CG1 . 15701 1 209 . 1 1 22 22 VAL N N 15 120.03 0.4000 . 1 . . . . . 22 VAL N . 15701 1 210 . 1 1 23 23 ALA H H 1 8.21 0.0300 . 1 . . . . . 23 ALA H . 15701 1 211 . 1 1 23 23 ALA HA H 1 4.26 0.0300 . 1 . . . . . 23 ALA HA . 15701 1 212 . 1 1 23 23 ALA HB1 H 1 1.36 0.0300 . 1 . . . . . 23 ALA HB . 15701 1 213 . 1 1 23 23 ALA HB2 H 1 1.36 0.0300 . 1 . . . . . 23 ALA HB . 15701 1 214 . 1 1 23 23 ALA HB3 H 1 1.36 0.0300 . 1 . . . . . 23 ALA HB . 15701 1 215 . 1 1 23 23 ALA C C 13 174.93 0.4000 . 1 . . . . . 23 ALA C . 15701 1 216 . 1 1 23 23 ALA CA C 13 52.66 0.4000 . 1 . . . . . 23 ALA CA . 15701 1 217 . 1 1 23 23 ALA CB C 13 19.11 0.4000 . 1 . . . . . 23 ALA CB . 15701 1 218 . 1 1 23 23 ALA N N 15 126.48 0.4000 . 1 . . . . . 23 ALA N . 15701 1 219 . 1 1 24 24 GLN H H 1 8.24 0.0300 . 1 . . . . . 24 GLN H . 15701 1 220 . 1 1 24 24 GLN HA H 1 4.34 0.0300 . 1 . . . . . 24 GLN HA . 15701 1 221 . 1 1 24 24 GLN HB2 H 1 2.18 0.0300 . 2 . . . . . 24 GLN HB2 . 15701 1 222 . 1 1 24 24 GLN HB3 H 1 1.97 0.0300 . 2 . . . . . 24 GLN HB3 . 15701 1 223 . 1 1 24 24 GLN HE21 H 1 6.85 0.0300 . 2 . . . . . 24 GLN HE21 . 15701 1 224 . 1 1 24 24 GLN HE22 H 1 7.46 0.0300 . 2 . . . . . 24 GLN HE22 . 15701 1 225 . 1 1 24 24 GLN HG2 H 1 2.39 0.0300 . 2 . . . . . 24 GLN HG2 . 15701 1 226 . 1 1 24 24 GLN HG3 H 1 2.39 0.0300 . 2 . . . . . 24 GLN HG3 . 15701 1 227 . 1 1 24 24 GLN C C 13 173.00 0.4000 . 1 . . . . . 24 GLN C . 15701 1 228 . 1 1 24 24 GLN CA C 13 55.65 0.4000 . 1 . . . . . 24 GLN CA . 15701 1 229 . 1 1 24 24 GLN CB C 13 29.65 0.4000 . 1 . . . . . 24 GLN CB . 15701 1 230 . 1 1 24 24 GLN CG C 13 33.85 0.4000 . 1 . . . . . 24 GLN CG . 15701 1 231 . 1 1 24 24 GLN N N 15 118.91 0.4000 . 1 . . . . . 24 GLN N . 15701 1 232 . 1 1 24 24 GLN NE2 N 15 111.77 0.4000 . 1 . . . . . 24 GLN NE2 . 15701 1 233 . 1 1 25 25 THR H H 1 7.83 0.0300 . 1 . . . . . 25 THR H . 15701 1 234 . 1 1 25 25 THR HA H 1 4.62 0.0300 . 1 . . . . . 25 THR HA . 15701 1 235 . 1 1 25 25 THR HB H 1 4.15 0.0300 . 1 . . . . . 25 THR HB . 15701 1 236 . 1 1 25 25 THR HG21 H 1 1.23 0.0300 . 1 . . . . . 25 THR HG2 . 15701 1 237 . 1 1 25 25 THR HG22 H 1 1.23 0.0300 . 1 . . . . . 25 THR HG2 . 15701 1 238 . 1 1 25 25 THR HG23 H 1 1.23 0.0300 . 1 . . . . . 25 THR HG2 . 15701 1 239 . 1 1 25 25 THR CA C 13 59.88 0.4000 . 1 . . . . . 25 THR CA . 15701 1 240 . 1 1 25 25 THR CB C 13 69.79 0.4000 . 1 . . . . . 25 THR CB . 15701 1 241 . 1 1 25 25 THR CG2 C 13 21.14 0.4000 . 1 . . . . . 25 THR CG2 . 15701 1 242 . 1 1 25 25 THR N N 15 117.99 0.4000 . 1 . . . . . 25 THR N . 15701 1 243 . 1 1 26 26 PRO HA H 1 4.50 0.0300 . 1 . . . . . 26 PRO HA . 15701 1 244 . 1 1 26 26 PRO HB2 H 1 2.25 0.0300 . 2 . . . . . 26 PRO HB2 . 15701 1 245 . 1 1 26 26 PRO HB3 H 1 1.83 0.0300 . 2 . . . . . 26 PRO HB3 . 15701 1 246 . 1 1 26 26 PRO HD2 H 1 3.76 0.0300 . 2 . . . . . 26 PRO HD2 . 15701 1 247 . 1 1 26 26 PRO HD3 H 1 3.72 0.0300 . 2 . . . . . 26 PRO HD3 . 15701 1 248 . 1 1 26 26 PRO HG2 H 1 1.97 0.0300 . 2 . . . . . 26 PRO HG2 . 15701 1 249 . 1 1 26 26 PRO HG3 H 1 1.97 0.0300 . 2 . . . . . 26 PRO HG3 . 15701 1 250 . 1 1 26 26 PRO C C 13 174.21 0.4000 . 1 . . . . . 26 PRO C . 15701 1 251 . 1 1 26 26 PRO CA C 13 62.76 0.4000 . 1 . . . . . 26 PRO CA . 15701 1 252 . 1 1 26 26 PRO CB C 13 32.04 0.4000 . 1 . . . . . 26 PRO CB . 15701 1 253 . 1 1 26 26 PRO CD C 13 50.94 0.4000 . 1 . . . . . 26 PRO CD . 15701 1 254 . 1 1 26 26 PRO CG C 13 27.35 0.4000 . 1 . . . . . 26 PRO CG . 15701 1 255 . 1 1 27 27 MET H H 1 8.58 0.0300 . 1 . . . . . 27 MET H . 15701 1 256 . 1 1 27 27 MET HA H 1 4.71 0.0300 . 1 . . . . . 27 MET HA . 15701 1 257 . 1 1 27 27 MET HB2 H 1 1.93 0.0300 . 2 . . . . . 27 MET HB2 . 15701 1 258 . 1 1 27 27 MET HB3 H 1 1.93 0.0300 . 2 . . . . . 27 MET HB3 . 15701 1 259 . 1 1 27 27 MET HE1 H 1 1.86 0.0300 . 1 . . . . . 27 MET HE . 15701 1 260 . 1 1 27 27 MET HE2 H 1 1.86 0.0300 . 1 . . . . . 27 MET HE . 15701 1 261 . 1 1 27 27 MET HE3 H 1 1.86 0.0300 . 1 . . . . . 27 MET HE . 15701 1 262 . 1 1 27 27 MET HG2 H 1 2.36 0.0300 . 2 . . . . . 27 MET HG2 . 15701 1 263 . 1 1 27 27 MET HG3 H 1 2.61 0.0300 . 2 . . . . . 27 MET HG3 . 15701 1 264 . 1 1 27 27 MET CA C 13 52.82 0.4000 . 1 . . . . . 27 MET CA . 15701 1 265 . 1 1 27 27 MET CB C 13 32.71 0.4000 . 1 . . . . . 27 MET CB . 15701 1 266 . 1 1 27 27 MET CE C 13 17.17 0.4000 . 1 . . . . . 27 MET CE . 15701 1 267 . 1 1 27 27 MET CG C 13 32.71 0.4000 . 1 . . . . . 27 MET CG . 15701 1 268 . 1 1 27 27 MET N N 15 120.94 0.4000 . 1 . . . . . 27 MET N . 15701 1 269 . 1 1 28 28 PRO HA H 1 4.44 0.0300 . 1 . . . . . 28 PRO HA . 15701 1 270 . 1 1 28 28 PRO HB2 H 1 2.41 0.0300 . 2 . . . . . 28 PRO HB2 . 15701 1 271 . 1 1 28 28 PRO HB3 H 1 1.92 0.0300 . 2 . . . . . 28 PRO HB3 . 15701 1 272 . 1 1 28 28 PRO HD2 H 1 3.88 0.0300 . 2 . . . . . 28 PRO HD2 . 15701 1 273 . 1 1 28 28 PRO HD3 H 1 3.55 0.0300 . 2 . . . . . 28 PRO HD3 . 15701 1 274 . 1 1 28 28 PRO HG2 H 1 2.03 0.0300 . 2 . . . . . 28 PRO HG2 . 15701 1 275 . 1 1 28 28 PRO HG3 H 1 2.03 0.0300 . 2 . . . . . 28 PRO HG3 . 15701 1 276 . 1 1 28 28 PRO C C 13 174.69 0.4000 . 1 . . . . . 28 PRO C . 15701 1 277 . 1 1 28 28 PRO CA C 13 63.11 0.4000 . 1 . . . . . 28 PRO CA . 15701 1 278 . 1 1 28 28 PRO CB C 13 32.30 0.4000 . 1 . . . . . 28 PRO CB . 15701 1 279 . 1 1 28 28 PRO CD C 13 50.68 0.4000 . 1 . . . . . 28 PRO CD . 15701 1 280 . 1 1 28 28 PRO CG C 13 27.95 0.4000 . 1 . . . . . 28 PRO CG . 15701 1 281 . 1 1 29 29 SER H H 1 8.60 0.0300 . 1 . . . . . 29 SER H . 15701 1 282 . 1 1 29 29 SER HA H 1 4.12 0.0300 . 1 . . . . . 29 SER HA . 15701 1 283 . 1 1 29 29 SER HB2 H 1 3.87 0.0300 . 2 . . . . . 29 SER HB2 . 15701 1 284 . 1 1 29 29 SER HB3 H 1 3.87 0.0300 . 2 . . . . . 29 SER HB3 . 15701 1 285 . 1 1 29 29 SER CA C 13 60.90 0.4000 . 1 . . . . . 29 SER CA . 15701 1 286 . 1 1 29 29 SER CB C 13 63.39 0.4000 . 1 . . . . . 29 SER CB . 15701 1 287 . 1 1 29 29 SER N N 15 117.27 0.4000 . 1 . . . . . 29 SER N . 15701 1 288 . 1 1 30 30 GLU HA H 1 4.11 0.0300 . 1 . . . . . 30 GLU HA . 15701 1 289 . 1 1 30 30 GLU HB2 H 1 1.78 0.0300 . 2 . . . . . 30 GLU HB2 . 15701 1 290 . 1 1 30 30 GLU HB3 H 1 1.78 0.0300 . 2 . . . . . 30 GLU HB3 . 15701 1 291 . 1 1 30 30 GLU HG2 H 1 1.96 0.0300 . 2 . . . . . 30 GLU HG2 . 15701 1 292 . 1 1 30 30 GLU HG3 H 1 1.89 0.0300 . 2 . . . . . 30 GLU HG3 . 15701 1 293 . 1 1 30 30 GLU C C 13 173.93 0.4000 . 1 . . . . . 30 GLU C . 15701 1 294 . 1 1 30 30 GLU CA C 13 58.00 0.4000 . 1 . . . . . 30 GLU CA . 15701 1 295 . 1 1 30 30 GLU CB C 13 28.99 0.4000 . 1 . . . . . 30 GLU CB . 15701 1 296 . 1 1 30 30 GLU CG C 13 35.97 0.4000 . 1 . . . . . 30 GLU CG . 15701 1 297 . 1 1 31 31 TYR H H 1 7.90 0.0300 . 1 . . . . . 31 TYR H . 15701 1 298 . 1 1 31 31 TYR HA H 1 4.64 0.0300 . 1 . . . . . 31 TYR HA . 15701 1 299 . 1 1 31 31 TYR HB2 H 1 3.29 0.0300 . 2 . . . . . 31 TYR HB2 . 15701 1 300 . 1 1 31 31 TYR HB3 H 1 2.74 0.0300 . 2 . . . . . 31 TYR HB3 . 15701 1 301 . 1 1 31 31 TYR HD1 H 1 7.00 0.0300 . 1 . . . . . 31 TYR HD1 . 15701 1 302 . 1 1 31 31 TYR HD2 H 1 7.00 0.0300 . 1 . . . . . 31 TYR HD2 . 15701 1 303 . 1 1 31 31 TYR HE1 H 1 6.73 0.0300 . 1 . . . . . 31 TYR HE1 . 15701 1 304 . 1 1 31 31 TYR HE2 H 1 6.73 0.0300 . 1 . . . . . 31 TYR HE2 . 15701 1 305 . 1 1 31 31 TYR C C 13 173.37 0.4000 . 1 . . . . . 31 TYR C . 15701 1 306 . 1 1 31 31 TYR CA C 13 57.61 0.4000 . 1 . . . . . 31 TYR CA . 15701 1 307 . 1 1 31 31 TYR CB C 13 39.00 0.4000 . 1 . . . . . 31 TYR CB . 15701 1 308 . 1 1 31 31 TYR CD1 C 13 130.30 0.4000 . 1 . . . . . 31 TYR CD1 . 15701 1 309 . 1 1 31 31 TYR CD2 C 13 130.30 0.4000 . 1 . . . . . 31 TYR CD2 . 15701 1 310 . 1 1 31 31 TYR CE1 C 13 115.50 0.4000 . 1 . . . . . 31 TYR CE1 . 15701 1 311 . 1 1 31 31 TYR CE2 C 13 115.50 0.4000 . 1 . . . . . 31 TYR CE2 . 15701 1 312 . 1 1 31 31 TYR N N 15 117.75 0.4000 . 1 . . . . . 31 TYR N . 15701 1 313 . 1 1 32 32 GLN H H 1 7.75 0.0300 . 1 . . . . . 32 GLN H . 15701 1 314 . 1 1 32 32 GLN HA H 1 4.15 0.0300 . 1 . . . . . 32 GLN HA . 15701 1 315 . 1 1 32 32 GLN HB2 H 1 2.04 0.0300 . 2 . . . . . 32 GLN HB2 . 15701 1 316 . 1 1 32 32 GLN HB3 H 1 2.04 0.0300 . 2 . . . . . 32 GLN HB3 . 15701 1 317 . 1 1 32 32 GLN HG2 H 1 2.35 0.0300 . 2 . . . . . 32 GLN HG2 . 15701 1 318 . 1 1 32 32 GLN HG3 H 1 2.35 0.0300 . 2 . . . . . 32 GLN HG3 . 15701 1 319 . 1 1 32 32 GLN C C 13 173.10 0.4000 . 1 . . . . . 32 GLN C . 15701 1 320 . 1 1 32 32 GLN CA C 13 57.22 0.4000 . 1 . . . . . 32 GLN CA . 15701 1 321 . 1 1 32 32 GLN CB C 13 29.19 0.4000 . 1 . . . . . 32 GLN CB . 15701 1 322 . 1 1 32 32 GLN CG C 13 33.67 0.4000 . 1 . . . . . 32 GLN CG . 15701 1 323 . 1 1 32 32 GLN N N 15 119.88 0.4000 . 1 . . . . . 32 GLN N . 15701 1 324 . 1 1 33 33 ASN H H 1 8.52 0.0300 . 1 . . . . . 33 ASN H . 15701 1 325 . 1 1 33 33 ASN HA H 1 4.69 0.0300 . 1 . . . . . 33 ASN HA . 15701 1 326 . 1 1 33 33 ASN HB2 H 1 2.93 0.0300 . 2 . . . . . 33 ASN HB2 . 15701 1 327 . 1 1 33 33 ASN HB3 H 1 2.75 0.0300 . 2 . . . . . 33 ASN HB3 . 15701 1 328 . 1 1 33 33 ASN HD21 H 1 6.92 0.0300 . 2 . . . . . 33 ASN HD21 . 15701 1 329 . 1 1 33 33 ASN HD22 H 1 7.58 0.0300 . 2 . . . . . 33 ASN HD22 . 15701 1 330 . 1 1 33 33 ASN CA C 13 53.37 0.4000 . 1 . . . . . 33 ASN CA . 15701 1 331 . 1 1 33 33 ASN CB C 13 38.39 0.4000 . 1 . . . . . 33 ASN CB . 15701 1 332 . 1 1 33 33 ASN N N 15 117.22 0.4000 . 1 . . . . . 33 ASN N . 15701 1 333 . 1 1 33 33 ASN ND2 N 15 113.20 0.4000 . 1 . . . . . 33 ASN ND2 . 15701 1 334 . 1 1 34 34 MET HA H 1 4.62 0.0300 . 1 . . . . . 34 MET HA . 15701 1 335 . 1 1 34 34 MET HB2 H 1 2.09 0.0300 . 2 . . . . . 34 MET HB2 . 15701 1 336 . 1 1 34 34 MET HB3 H 1 2.03 0.0300 . 2 . . . . . 34 MET HB3 . 15701 1 337 . 1 1 34 34 MET HE1 H 1 1.86 0.0300 . 1 . . . . . 34 MET HE . 15701 1 338 . 1 1 34 34 MET HE2 H 1 1.86 0.0300 . 1 . . . . . 34 MET HE . 15701 1 339 . 1 1 34 34 MET HE3 H 1 1.86 0.0300 . 1 . . . . . 34 MET HE . 15701 1 340 . 1 1 34 34 MET HG2 H 1 2.50 0.0300 . 2 . . . . . 34 MET HG2 . 15701 1 341 . 1 1 34 34 MET HG3 H 1 2.31 0.0300 . 2 . . . . . 34 MET HG3 . 15701 1 342 . 1 1 34 34 MET C C 13 172.40 0.4000 . 1 . . . . . 34 MET C . 15701 1 343 . 1 1 34 34 MET CA C 13 55.83 0.4000 . 1 . . . . . 34 MET CA . 15701 1 344 . 1 1 34 34 MET CB C 13 34.15 0.4000 . 1 . . . . . 34 MET CB . 15701 1 345 . 1 1 34 34 MET CE C 13 17.17 0.4000 . 1 . . . . . 34 MET CE . 15701 1 346 . 1 1 34 34 MET CG C 13 32.02 0.4000 . 1 . . . . . 34 MET CG . 15701 1 347 . 1 1 35 35 THR H H 1 8.28 0.0300 . 1 . . . . . 35 THR H . 15701 1 348 . 1 1 35 35 THR HA H 1 5.03 0.0300 . 1 . . . . . 35 THR HA . 15701 1 349 . 1 1 35 35 THR HB H 1 3.92 0.0300 . 1 . . . . . 35 THR HB . 15701 1 350 . 1 1 35 35 THR HG21 H 1 1.00 0.0300 . 1 . . . . . 35 THR HG2 . 15701 1 351 . 1 1 35 35 THR HG22 H 1 1.00 0.0300 . 1 . . . . . 35 THR HG2 . 15701 1 352 . 1 1 35 35 THR HG23 H 1 1.00 0.0300 . 1 . . . . . 35 THR HG2 . 15701 1 353 . 1 1 35 35 THR C C 13 171.20 0.4000 . 1 . . . . . 35 THR C . 15701 1 354 . 1 1 35 35 THR CA C 13 60.37 0.4000 . 1 . . . . . 35 THR CA . 15701 1 355 . 1 1 35 35 THR CB C 13 71.11 0.4000 . 1 . . . . . 35 THR CB . 15701 1 356 . 1 1 35 35 THR CG2 C 13 21.81 0.4000 . 1 . . . . . 35 THR CG2 . 15701 1 357 . 1 1 35 35 THR N N 15 116.75 0.4000 . 1 . . . . . 35 THR N . 15701 1 358 . 1 1 36 36 VAL H H 1 9.24 0.0300 . 1 . . . . . 36 VAL H . 15701 1 359 . 1 1 36 36 VAL HA H 1 4.56 0.0300 . 1 . . . . . 36 VAL HA . 15701 1 360 . 1 1 36 36 VAL HB H 1 2.10 0.0300 . 1 . . . . . 36 VAL HB . 15701 1 361 . 1 1 36 36 VAL HG11 H 1 0.86 0.0300 . 2 . . . . . 36 VAL HG1 . 15701 1 362 . 1 1 36 36 VAL HG12 H 1 0.86 0.0300 . 2 . . . . . 36 VAL HG1 . 15701 1 363 . 1 1 36 36 VAL HG13 H 1 0.86 0.0300 . 2 . . . . . 36 VAL HG1 . 15701 1 364 . 1 1 36 36 VAL HG21 H 1 0.86 0.0300 . 2 . . . . . 36 VAL HG2 . 15701 1 365 . 1 1 36 36 VAL HG22 H 1 0.86 0.0300 . 2 . . . . . 36 VAL HG2 . 15701 1 366 . 1 1 36 36 VAL HG23 H 1 0.86 0.0300 . 2 . . . . . 36 VAL HG2 . 15701 1 367 . 1 1 36 36 VAL C C 13 170.52 0.4000 . 1 . . . . . 36 VAL C . 15701 1 368 . 1 1 36 36 VAL CA C 13 59.74 0.4000 . 1 . . . . . 36 VAL CA . 15701 1 369 . 1 1 36 36 VAL CB C 13 36.04 0.4000 . 1 . . . . . 36 VAL CB . 15701 1 370 . 1 1 36 36 VAL CG1 C 13 22.20 0.4000 . 1 . . . . . 36 VAL CG1 . 15701 1 371 . 1 1 36 36 VAL CG2 C 13 20.59 0.4000 . 1 . . . . . 36 VAL CG2 . 15701 1 372 . 1 1 36 36 VAL N N 15 117.88 0.4000 . 1 . . . . . 36 VAL N . 15701 1 373 . 1 1 37 37 ASP H H 1 8.33 0.0300 . 1 . . . . . 37 ASP H . 15701 1 374 . 1 1 37 37 ASP HA H 1 5.47 0.0300 . 1 . . . . . 37 ASP HA . 15701 1 375 . 1 1 37 37 ASP HB2 H 1 2.57 0.0300 . 2 . . . . . 37 ASP HB2 . 15701 1 376 . 1 1 37 37 ASP HB3 H 1 2.57 0.0300 . 2 . . . . . 37 ASP HB3 . 15701 1 377 . 1 1 37 37 ASP C C 13 173.81 0.4000 . 1 . . . . . 37 ASP C . 15701 1 378 . 1 1 37 37 ASP CA C 13 53.14 0.4000 . 1 . . . . . 37 ASP CA . 15701 1 379 . 1 1 37 37 ASP CB C 13 40.96 0.4000 . 1 . . . . . 37 ASP CB . 15701 1 380 . 1 1 37 37 ASP N N 15 123.58 0.4000 . 1 . . . . . 37 ASP N . 15701 1 381 . 1 1 38 38 ILE H H 1 9.31 0.0300 . 1 . . . . . 38 ILE H . 15701 1 382 . 1 1 38 38 ILE HA H 1 5.06 0.0300 . 1 . . . . . 38 ILE HA . 15701 1 383 . 1 1 38 38 ILE HB H 1 1.53 0.0300 . 1 . . . . . 38 ILE HB . 15701 1 384 . 1 1 38 38 ILE HD11 H 1 0.51 0.0300 . 1 . . . . . 38 ILE HD1 . 15701 1 385 . 1 1 38 38 ILE HD12 H 1 0.51 0.0300 . 1 . . . . . 38 ILE HD1 . 15701 1 386 . 1 1 38 38 ILE HD13 H 1 0.51 0.0300 . 1 . . . . . 38 ILE HD1 . 15701 1 387 . 1 1 38 38 ILE HG12 H 1 1.46 0.0300 . 2 . . . . . 38 ILE HG12 . 15701 1 388 . 1 1 38 38 ILE HG13 H 1 1.46 0.0300 . 2 . . . . . 38 ILE HG13 . 15701 1 389 . 1 1 38 38 ILE HG21 H 1 0.68 0.0300 . 1 . . . . . 38 ILE HG2 . 15701 1 390 . 1 1 38 38 ILE HG22 H 1 0.68 0.0300 . 1 . . . . . 38 ILE HG2 . 15701 1 391 . 1 1 38 38 ILE HG23 H 1 0.68 0.0300 . 1 . . . . . 38 ILE HG2 . 15701 1 392 . 1 1 38 38 ILE C C 13 171.70 0.4000 . 1 . . . . . 38 ILE C . 15701 1 393 . 1 1 38 38 ILE CA C 13 59.26 0.4000 . 1 . . . . . 38 ILE CA . 15701 1 394 . 1 1 38 38 ILE CB C 13 43.15 0.4000 . 1 . . . . . 38 ILE CB . 15701 1 395 . 1 1 38 38 ILE CD1 C 13 14.87 0.4000 . 1 . . . . . 38 ILE CD1 . 15701 1 396 . 1 1 38 38 ILE CG1 C 13 25.27 0.4000 . 1 . . . . . 38 ILE CG1 . 15701 1 397 . 1 1 38 38 ILE CG2 C 13 18.96 0.4000 . 1 . . . . . 38 ILE CG2 . 15701 1 398 . 1 1 38 38 ILE N N 15 116.25 0.4000 . 1 . . . . . 38 ILE N . 15701 1 399 . 1 1 39 39 LEU H H 1 8.84 0.0300 . 1 . . . . . 39 LEU H . 15701 1 400 . 1 1 39 39 LEU HA H 1 4.83 0.0300 . 1 . . . . . 39 LEU HA . 15701 1 401 . 1 1 39 39 LEU HB2 H 1 1.54 0.0300 . 2 . . . . . 39 LEU HB2 . 15701 1 402 . 1 1 39 39 LEU HB3 H 1 1.23 0.0300 . 2 . . . . . 39 LEU HB3 . 15701 1 403 . 1 1 39 39 LEU HD11 H 1 0.80 0.0300 . 2 . . . . . 39 LEU HD1 . 15701 1 404 . 1 1 39 39 LEU HD12 H 1 0.80 0.0300 . 2 . . . . . 39 LEU HD1 . 15701 1 405 . 1 1 39 39 LEU HD13 H 1 0.80 0.0300 . 2 . . . . . 39 LEU HD1 . 15701 1 406 . 1 1 39 39 LEU HD21 H 1 0.72 0.0300 . 2 . . . . . 39 LEU HD2 . 15701 1 407 . 1 1 39 39 LEU HD22 H 1 0.72 0.0300 . 2 . . . . . 39 LEU HD2 . 15701 1 408 . 1 1 39 39 LEU HD23 H 1 0.72 0.0300 . 2 . . . . . 39 LEU HD2 . 15701 1 409 . 1 1 39 39 LEU HG H 1 1.26 0.0300 . 1 . . . . . 39 LEU HG . 15701 1 410 . 1 1 39 39 LEU C C 13 172.35 0.4000 . 1 . . . . . 39 LEU C . 15701 1 411 . 1 1 39 39 LEU CA C 13 53.06 0.4000 . 1 . . . . . 39 LEU CA . 15701 1 412 . 1 1 39 39 LEU CB C 13 45.38 0.4000 . 1 . . . . . 39 LEU CB . 15701 1 413 . 1 1 39 39 LEU CD1 C 13 25.24 0.4000 . 1 . . . . . 39 LEU CD1 . 15701 1 414 . 1 1 39 39 LEU CD2 C 13 23.80 0.4000 . 1 . . . . . 39 LEU CD2 . 15701 1 415 . 1 1 39 39 LEU CG C 13 27.35 0.4000 . 1 . . . . . 39 LEU CG . 15701 1 416 . 1 1 39 39 LEU N N 15 121.57 0.4000 . 1 . . . . . 39 LEU N . 15701 1 417 . 1 1 40 40 CYS H H 1 8.46 0.0300 . 1 . . . . . 40 CYS H . 15701 1 418 . 1 1 40 40 CYS HA H 1 4.39 0.0300 . 1 . . . . . 40 CYS HA . 15701 1 419 . 1 1 40 40 CYS HB2 H 1 3.26 0.0300 . 2 . . . . . 40 CYS HB2 . 15701 1 420 . 1 1 40 40 CYS HB3 H 1 2.63 0.0300 . 2 . . . . . 40 CYS HB3 . 15701 1 421 . 1 1 40 40 CYS C C 13 174.41 0.4000 . 1 . . . . . 40 CYS C . 15701 1 422 . 1 1 40 40 CYS CA C 13 58.53 0.4000 . 1 . . . . . 40 CYS CA . 15701 1 423 . 1 1 40 40 CYS CB C 13 33.41 0.4000 . 1 . . . . . 40 CYS CB . 15701 1 424 . 1 1 40 40 CYS N N 15 127.49 0.4000 . 1 . . . . . 40 CYS N . 15701 1 425 . 1 1 41 41 ASN H H 1 9.28 0.0300 . 1 . . . . . 41 ASN H . 15701 1 426 . 1 1 41 41 ASN HA H 1 4.62 0.0300 . 1 . . . . . 41 ASN HA . 15701 1 427 . 1 1 41 41 ASN HB2 H 1 2.79 0.0300 . 2 . . . . . 41 ASN HB2 . 15701 1 428 . 1 1 41 41 ASN HB3 H 1 2.56 0.0300 . 2 . . . . . 41 ASN HB3 . 15701 1 429 . 1 1 41 41 ASN HD21 H 1 6.63 0.0300 . 2 . . . . . 41 ASN HD21 . 15701 1 430 . 1 1 41 41 ASN HD22 H 1 6.96 0.0300 . 2 . . . . . 41 ASN HD22 . 15701 1 431 . 1 1 41 41 ASN C C 13 172.28 0.4000 . 1 . . . . . 41 ASN C . 15701 1 432 . 1 1 41 41 ASN CA C 13 54.86 0.4000 . 1 . . . . . 41 ASN CA . 15701 1 433 . 1 1 41 41 ASN CB C 13 38.71 0.4000 . 1 . . . . . 41 ASN CB . 15701 1 434 . 1 1 41 41 ASN N N 15 126.32 0.4000 . 1 . . . . . 41 ASN N . 15701 1 435 . 1 1 41 41 ASN ND2 N 15 111.90 0.4000 . 1 . . . . . 41 ASN ND2 . 15701 1 436 . 1 1 42 42 ASP H H 1 9.36 0.0300 . 1 . . . . . 42 ASP H . 15701 1 437 . 1 1 42 42 ASP HA H 1 4.94 0.0300 . 1 . . . . . 42 ASP HA . 15701 1 438 . 1 1 42 42 ASP HB2 H 1 2.77 0.0300 . 2 . . . . . 42 ASP HB2 . 15701 1 439 . 1 1 42 42 ASP HB3 H 1 2.62 0.0300 . 2 . . . . . 42 ASP HB3 . 15701 1 440 . 1 1 42 42 ASP C C 13 174.40 0.4000 . 1 . . . . . 42 ASP C . 15701 1 441 . 1 1 42 42 ASP CA C 13 56.65 0.4000 . 1 . . . . . 42 ASP CA . 15701 1 442 . 1 1 42 42 ASP CB C 13 41.91 0.4000 . 1 . . . . . 42 ASP CB . 15701 1 443 . 1 1 42 42 ASP N N 15 123.07 0.4000 . 1 . . . . . 42 ASP N . 15701 1 444 . 1 1 43 43 CYS H H 1 9.26 0.0300 . 1 . . . . . 43 CYS H . 15701 1 445 . 1 1 43 43 CYS HA H 1 4.94 0.0300 . 1 . . . . . 43 CYS HA . 15701 1 446 . 1 1 43 43 CYS HB2 H 1 3.20 0.0300 . 2 . . . . . 43 CYS HB2 . 15701 1 447 . 1 1 43 43 CYS HB3 H 1 2.68 0.0300 . 2 . . . . . 43 CYS HB3 . 15701 1 448 . 1 1 43 43 CYS C C 13 174.14 0.4000 . 1 . . . . . 43 CYS C . 15701 1 449 . 1 1 43 43 CYS CA C 13 58.59 0.4000 . 1 . . . . . 43 CYS CA . 15701 1 450 . 1 1 43 43 CYS CB C 13 31.96 0.4000 . 1 . . . . . 43 CYS CB . 15701 1 451 . 1 1 43 43 CYS N N 15 121.59 0.4000 . 1 . . . . . 43 CYS N . 15701 1 452 . 1 1 44 44 ASN H H 1 7.65 0.0300 . 1 . . . . . 44 ASN H . 15701 1 453 . 1 1 44 44 ASN HA H 1 4.77 0.0300 . 1 . . . . . 44 ASN HA . 15701 1 454 . 1 1 44 44 ASN HB2 H 1 3.07 0.0300 . 2 . . . . . 44 ASN HB2 . 15701 1 455 . 1 1 44 44 ASN HB3 H 1 2.94 0.0300 . 2 . . . . . 44 ASN HB3 . 15701 1 456 . 1 1 44 44 ASN HD21 H 1 6.75 0.0300 . 2 . . . . . 44 ASN HD21 . 15701 1 457 . 1 1 44 44 ASN HD22 H 1 7.44 0.0300 . 2 . . . . . 44 ASN HD22 . 15701 1 458 . 1 1 44 44 ASN C C 13 171.35 0.4000 . 1 . . . . . 44 ASN C . 15701 1 459 . 1 1 44 44 ASN CA C 13 55.45 0.4000 . 1 . . . . . 44 ASN CA . 15701 1 460 . 1 1 44 44 ASN CB C 13 37.97 0.4000 . 1 . . . . . 44 ASN CB . 15701 1 461 . 1 1 44 44 ASN N N 15 118.00 0.4000 . 1 . . . . . 44 ASN N . 15701 1 462 . 1 1 44 44 ASN ND2 N 15 112.20 0.4000 . 1 . . . . . 44 ASN ND2 . 15701 1 463 . 1 1 45 45 GLY H H 1 9.22 0.0300 . 1 . . . . . 45 GLY H . 15701 1 464 . 1 1 45 45 GLY HA2 H 1 4.21 0.0300 . 2 . . . . . 45 GLY HA2 . 15701 1 465 . 1 1 45 45 GLY HA3 H 1 3.51 0.0300 . 2 . . . . . 45 GLY HA3 . 15701 1 466 . 1 1 45 45 GLY C C 13 170.73 0.4000 . 1 . . . . . 45 GLY C . 15701 1 467 . 1 1 45 45 GLY CA C 13 44.13 0.4000 . 1 . . . . . 45 GLY CA . 15701 1 468 . 1 1 45 45 GLY N N 15 111.32 0.4000 . 1 . . . . . 45 GLY N . 15701 1 469 . 1 1 46 46 ARG H H 1 8.60 0.0300 . 1 . . . . . 46 ARG H . 15701 1 470 . 1 1 46 46 ARG HA H 1 5.42 0.0300 . 1 . . . . . 46 ARG HA . 15701 1 471 . 1 1 46 46 ARG HB2 H 1 1.82 0.0300 . 2 . . . . . 46 ARG HB2 . 15701 1 472 . 1 1 46 46 ARG HB3 H 1 1.61 0.0300 . 2 . . . . . 46 ARG HB3 . 15701 1 473 . 1 1 46 46 ARG HD2 H 1 3.12 0.0300 . 2 . . . . . 46 ARG HD2 . 15701 1 474 . 1 1 46 46 ARG HD3 H 1 3.12 0.0300 . 2 . . . . . 46 ARG HD3 . 15701 1 475 . 1 1 46 46 ARG HG2 H 1 1.59 0.0300 . 2 . . . . . 46 ARG HG2 . 15701 1 476 . 1 1 46 46 ARG HG3 H 1 1.48 0.0300 . 2 . . . . . 46 ARG HG3 . 15701 1 477 . 1 1 46 46 ARG C C 13 172.90 0.4000 . 1 . . . . . 46 ARG C . 15701 1 478 . 1 1 46 46 ARG CA C 13 54.46 0.4000 . 1 . . . . . 46 ARG CA . 15701 1 479 . 1 1 46 46 ARG CB C 13 32.27 0.4000 . 1 . . . . . 46 ARG CB . 15701 1 480 . 1 1 46 46 ARG CD C 13 43.08 0.4000 . 1 . . . . . 46 ARG CD . 15701 1 481 . 1 1 46 46 ARG CG C 13 28.27 0.4000 . 1 . . . . . 46 ARG CG . 15701 1 482 . 1 1 46 46 ARG N N 15 124.92 0.4000 . 1 . . . . . 46 ARG N . 15701 1 483 . 1 1 47 47 SER H H 1 8.35 0.0300 . 1 . . . . . 47 SER H . 15701 1 484 . 1 1 47 47 SER HA H 1 4.79 0.0300 . 1 . . . . . 47 SER HA . 15701 1 485 . 1 1 47 47 SER HB2 H 1 3.73 0.0300 . 2 . . . . . 47 SER HB2 . 15701 1 486 . 1 1 47 47 SER HB3 H 1 3.57 0.0300 . 2 . . . . . 47 SER HB3 . 15701 1 487 . 1 1 47 47 SER C C 13 170.83 0.4000 . 1 . . . . . 47 SER C . 15701 1 488 . 1 1 47 47 SER CA C 13 57.72 0.4000 . 1 . . . . . 47 SER CA . 15701 1 489 . 1 1 47 47 SER CB C 13 66.39 0.4000 . 1 . . . . . 47 SER CB . 15701 1 490 . 1 1 47 47 SER N N 15 115.75 0.4000 . 1 . . . . . 47 SER N . 15701 1 491 . 1 1 48 48 THR H H 1 8.57 0.0300 . 1 . . . . . 48 THR H . 15701 1 492 . 1 1 48 48 THR HA H 1 5.21 0.0300 . 1 . . . . . 48 THR HA . 15701 1 493 . 1 1 48 48 THR HB H 1 3.74 0.0300 . 1 . . . . . 48 THR HB . 15701 1 494 . 1 1 48 48 THR HG21 H 1 1.12 0.0300 . 1 . . . . . 48 THR HG2 . 15701 1 495 . 1 1 48 48 THR HG22 H 1 1.12 0.0300 . 1 . . . . . 48 THR HG2 . 15701 1 496 . 1 1 48 48 THR HG23 H 1 1.12 0.0300 . 1 . . . . . 48 THR HG2 . 15701 1 497 . 1 1 48 48 THR C C 13 171.92 0.4000 . 1 . . . . . 48 THR C . 15701 1 498 . 1 1 48 48 THR CA C 13 62.35 0.4000 . 1 . . . . . 48 THR CA . 15701 1 499 . 1 1 48 48 THR CB C 13 70.32 0.4000 . 1 . . . . . 48 THR CB . 15701 1 500 . 1 1 48 48 THR CG2 C 13 21.88 0.4000 . 1 . . . . . 48 THR CG2 . 15701 1 501 . 1 1 48 48 THR N N 15 120.42 0.4000 . 1 . . . . . 48 THR N . 15701 1 502 . 1 1 49 49 VAL H H 1 9.02 0.0300 . 1 . . . . . 49 VAL H . 15701 1 503 . 1 1 49 49 VAL HA H 1 4.80 0.0300 . 1 . . . . . 49 VAL HA . 15701 1 504 . 1 1 49 49 VAL HB H 1 2.24 0.0300 . 1 . . . . . 49 VAL HB . 15701 1 505 . 1 1 49 49 VAL HG11 H 1 0.88 0.0300 . 2 . . . . . 49 VAL HG1 . 15701 1 506 . 1 1 49 49 VAL HG12 H 1 0.88 0.0300 . 2 . . . . . 49 VAL HG1 . 15701 1 507 . 1 1 49 49 VAL HG13 H 1 0.88 0.0300 . 2 . . . . . 49 VAL HG1 . 15701 1 508 . 1 1 49 49 VAL HG21 H 1 0.68 0.0300 . 2 . . . . . 49 VAL HG2 . 15701 1 509 . 1 1 49 49 VAL HG22 H 1 0.68 0.0300 . 2 . . . . . 49 VAL HG2 . 15701 1 510 . 1 1 49 49 VAL HG23 H 1 0.68 0.0300 . 2 . . . . . 49 VAL HG2 . 15701 1 511 . 1 1 49 49 VAL C C 13 171.70 0.4000 . 1 . . . . . 49 VAL C . 15701 1 512 . 1 1 49 49 VAL CA C 13 58.54 0.4000 . 1 . . . . . 49 VAL CA . 15701 1 513 . 1 1 49 49 VAL CB C 13 36.42 0.4000 . 1 . . . . . 49 VAL CB . 15701 1 514 . 1 1 49 49 VAL CG1 C 13 21.96 0.4000 . 1 . . . . . 49 VAL CG1 . 15701 1 515 . 1 1 49 49 VAL CG2 C 13 19.23 0.4000 . 1 . . . . . 49 VAL CG2 . 15701 1 516 . 1 1 49 49 VAL N N 15 119.32 0.4000 . 1 . . . . . 49 VAL N . 15701 1 517 . 1 1 50 50 GLN H H 1 8.32 0.0300 . 1 . . . . . 50 GLN H . 15701 1 518 . 1 1 50 50 GLN HA H 1 4.45 0.0300 . 1 . . . . . 50 GLN HA . 15701 1 519 . 1 1 50 50 GLN HB2 H 1 2.03 0.0300 . 2 . . . . . 50 GLN HB2 . 15701 1 520 . 1 1 50 50 GLN HB3 H 1 2.03 0.0300 . 2 . . . . . 50 GLN HB3 . 15701 1 521 . 1 1 50 50 GLN HE21 H 1 6.88 0.0300 . 2 . . . . . 50 GLN HE21 . 15701 1 522 . 1 1 50 50 GLN HE22 H 1 7.67 0.0300 . 2 . . . . . 50 GLN HE22 . 15701 1 523 . 1 1 50 50 GLN HG2 H 1 2.44 0.0300 . 2 . . . . . 50 GLN HG2 . 15701 1 524 . 1 1 50 50 GLN HG3 H 1 2.44 0.0300 . 2 . . . . . 50 GLN HG3 . 15701 1 525 . 1 1 50 50 GLN C C 13 173.27 0.4000 . 1 . . . . . 50 GLN C . 15701 1 526 . 1 1 50 50 GLN CA C 13 55.86 0.4000 . 1 . . . . . 50 GLN CA . 15701 1 527 . 1 1 50 50 GLN CB C 13 29.25 0.4000 . 1 . . . . . 50 GLN CB . 15701 1 528 . 1 1 50 50 GLN CG C 13 34.24 0.4000 . 1 . . . . . 50 GLN CG . 15701 1 529 . 1 1 50 50 GLN N N 15 119.39 0.4000 . 1 . . . . . 50 GLN N . 15701 1 530 . 1 1 50 50 GLN NE2 N 15 112.20 0.4000 . 1 . . . . . 50 GLN NE2 . 15701 1 531 . 1 1 51 51 PHE H H 1 8.69 0.0300 . 1 . . . . . 51 PHE H . 15701 1 532 . 1 1 51 51 PHE HA H 1 4.43 0.0300 . 1 . . . . . 51 PHE HA . 15701 1 533 . 1 1 51 51 PHE HB2 H 1 2.89 0.0300 . 2 . . . . . 51 PHE HB2 . 15701 1 534 . 1 1 51 51 PHE HB3 H 1 2.81 0.0300 . 2 . . . . . 51 PHE HB3 . 15701 1 535 . 1 1 51 51 PHE HD1 H 1 6.99 0.0300 . 1 . . . . . 51 PHE HD1 . 15701 1 536 . 1 1 51 51 PHE HD2 H 1 6.99 0.0300 . 1 . . . . . 51 PHE HD2 . 15701 1 537 . 1 1 51 51 PHE HE1 H 1 7.05 0.0300 . 1 . . . . . 51 PHE HE1 . 15701 1 538 . 1 1 51 51 PHE HE2 H 1 7.05 0.0300 . 1 . . . . . 51 PHE HE2 . 15701 1 539 . 1 1 51 51 PHE C C 13 171.97 0.4000 . 1 . . . . . 51 PHE C . 15701 1 540 . 1 1 51 51 PHE CA C 13 58.85 0.4000 . 1 . . . . . 51 PHE CA . 15701 1 541 . 1 1 51 51 PHE CB C 13 40.10 0.4000 . 1 . . . . . 51 PHE CB . 15701 1 542 . 1 1 51 51 PHE CD1 C 13 129.10 0.4000 . 1 . . . . . 51 PHE CD1 . 15701 1 543 . 1 1 51 51 PHE CD2 C 13 129.10 0.4000 . 1 . . . . . 51 PHE CD2 . 15701 1 544 . 1 1 51 51 PHE CE1 C 13 128.70 0.4000 . 1 . . . . . 51 PHE CE1 . 15701 1 545 . 1 1 51 51 PHE CE2 C 13 128.70 0.4000 . 1 . . . . . 51 PHE CE2 . 15701 1 546 . 1 1 51 51 PHE N N 15 125.01 0.4000 . 1 . . . . . 51 PHE N . 15701 1 547 . 1 1 52 52 HIS H H 1 6.48 0.0300 . 1 . . . . . 52 HIS H . 15701 1 548 . 1 1 52 52 HIS HA H 1 4.10 0.0300 . 1 . . . . . 52 HIS HA . 15701 1 549 . 1 1 52 52 HIS HB2 H 1 3.10 0.0300 . 2 . . . . . 52 HIS HB2 . 15701 1 550 . 1 1 52 52 HIS HB3 H 1 2.81 0.0300 . 2 . . . . . 52 HIS HB3 . 15701 1 551 . 1 1 52 52 HIS HD2 H 1 7.17 0.0300 . 1 . . . . . 52 HIS HD2 . 15701 1 552 . 1 1 52 52 HIS HE1 H 1 7.50 0.0300 . 1 . . . . . 52 HIS HE1 . 15701 1 553 . 1 1 52 52 HIS CA C 13 57.23 0.4000 . 1 . . . . . 52 HIS CA . 15701 1 554 . 1 1 52 52 HIS CB C 13 34.13 0.4000 . 1 . . . . . 52 HIS CB . 15701 1 555 . 1 1 52 52 HIS CD2 C 13 116.30 0.4000 . 1 . . . . . 52 HIS CD2 . 15701 1 556 . 1 1 52 52 HIS CE1 C 13 134.90 0.4000 . 1 . . . . . 52 HIS CE1 . 15701 1 557 . 1 1 52 52 HIS N N 15 126.10 0.4000 . 1 . . . . . 52 HIS N . 15701 1 558 . 1 1 53 53 ILE HA H 1 3.76 0.0300 . 1 . . . . . 53 ILE HA . 15701 1 559 . 1 1 53 53 ILE HB H 1 1.67 0.0300 . 1 . . . . . 53 ILE HB . 15701 1 560 . 1 1 53 53 ILE HD11 H 1 0.88 0.0300 . 1 . . . . . 53 ILE HD1 . 15701 1 561 . 1 1 53 53 ILE HD12 H 1 0.88 0.0300 . 1 . . . . . 53 ILE HD1 . 15701 1 562 . 1 1 53 53 ILE HD13 H 1 0.88 0.0300 . 1 . . . . . 53 ILE HD1 . 15701 1 563 . 1 1 53 53 ILE HG12 H 1 1.38 0.0300 . 2 . . . . . 53 ILE HG12 . 15701 1 564 . 1 1 53 53 ILE HG13 H 1 1.11 0.0300 . 2 . . . . . 53 ILE HG13 . 15701 1 565 . 1 1 53 53 ILE HG21 H 1 0.83 0.0300 . 1 . . . . . 53 ILE HG2 . 15701 1 566 . 1 1 53 53 ILE HG22 H 1 0.83 0.0300 . 1 . . . . . 53 ILE HG2 . 15701 1 567 . 1 1 53 53 ILE HG23 H 1 0.83 0.0300 . 1 . . . . . 53 ILE HG2 . 15701 1 568 . 1 1 53 53 ILE CA C 13 62.78 0.4000 . 1 . . . . . 53 ILE CA . 15701 1 569 . 1 1 53 53 ILE CB C 13 38.92 0.4000 . 1 . . . . . 53 ILE CB . 15701 1 570 . 1 1 53 53 ILE CD1 C 13 13.94 0.4000 . 1 . . . . . 53 ILE CD1 . 15701 1 571 . 1 1 53 53 ILE CG1 C 13 28.05 0.4000 . 1 . . . . . 53 ILE CG1 . 15701 1 572 . 1 1 53 53 ILE CG2 C 13 18.18 0.4000 . 1 . . . . . 53 ILE CG2 . 15701 1 573 . 1 1 54 54 LEU HA H 1 4.37 0.0300 . 1 . . . . . 54 LEU HA . 15701 1 574 . 1 1 54 54 LEU HB2 H 1 1.70 0.0300 . 2 . . . . . 54 LEU HB2 . 15701 1 575 . 1 1 54 54 LEU HB3 H 1 1.45 0.0300 . 2 . . . . . 54 LEU HB3 . 15701 1 576 . 1 1 54 54 LEU HD11 H 1 0.68 0.0300 . 2 . . . . . 54 LEU HD1 . 15701 1 577 . 1 1 54 54 LEU HD12 H 1 0.68 0.0300 . 2 . . . . . 54 LEU HD1 . 15701 1 578 . 1 1 54 54 LEU HD13 H 1 0.68 0.0300 . 2 . . . . . 54 LEU HD1 . 15701 1 579 . 1 1 54 54 LEU HD21 H 1 0.81 0.0300 . 2 . . . . . 54 LEU HD2 . 15701 1 580 . 1 1 54 54 LEU HD22 H 1 0.81 0.0300 . 2 . . . . . 54 LEU HD2 . 15701 1 581 . 1 1 54 54 LEU HD23 H 1 0.81 0.0300 . 2 . . . . . 54 LEU HD2 . 15701 1 582 . 1 1 54 54 LEU HG H 1 1.66 0.0300 . 1 . . . . . 54 LEU HG . 15701 1 583 . 1 1 54 54 LEU C C 13 174.46 0.4000 . 1 . . . . . 54 LEU C . 15701 1 584 . 1 1 54 54 LEU CA C 13 55.43 0.4000 . 1 . . . . . 54 LEU CA . 15701 1 585 . 1 1 54 54 LEU CB C 13 41.76 0.4000 . 1 . . . . . 54 LEU CB . 15701 1 586 . 1 1 54 54 LEU CD1 C 13 25.09 0.4000 . 1 . . . . . 54 LEU CD1 . 15701 1 587 . 1 1 54 54 LEU CD2 C 13 22.34 0.4000 . 1 . . . . . 54 LEU CD2 . 15701 1 588 . 1 1 54 54 LEU CG C 13 27.11 0.4000 . 1 . . . . . 54 LEU CG . 15701 1 589 . 1 1 55 55 GLY H H 1 7.10 0.0300 . 1 . . . . . 55 GLY H . 15701 1 590 . 1 1 55 55 GLY HA2 H 1 4.28 0.0300 . 2 . . . . . 55 GLY HA2 . 15701 1 591 . 1 1 55 55 GLY HA3 H 1 3.76 0.0300 . 2 . . . . . 55 GLY HA3 . 15701 1 592 . 1 1 55 55 GLY C C 13 182.88 0.4000 . 1 . . . . . 55 GLY C . 15701 1 593 . 1 1 55 55 GLY CA C 13 45.07 0.4000 . 1 . . . . . 55 GLY CA . 15701 1 594 . 1 1 55 55 GLY N N 15 106.00 0.4000 . 1 . . . . . 55 GLY N . 15701 1 595 . 1 1 56 56 MET H H 1 8.65 0.0300 . 1 . . . . . 56 MET H . 15701 1 596 . 1 1 56 56 MET HA H 1 4.50 0.0300 . 1 . . . . . 56 MET HA . 15701 1 597 . 1 1 56 56 MET HB2 H 1 1.86 0.0300 . 2 . . . . . 56 MET HB2 . 15701 1 598 . 1 1 56 56 MET HB3 H 1 1.66 0.0300 . 2 . . . . . 56 MET HB3 . 15701 1 599 . 1 1 56 56 MET HE1 H 1 2.00 0.0300 . 1 . . . . . 56 MET HE . 15701 1 600 . 1 1 56 56 MET HE2 H 1 2.00 0.0300 . 1 . . . . . 56 MET HE . 15701 1 601 . 1 1 56 56 MET HE3 H 1 2.00 0.0300 . 1 . . . . . 56 MET HE . 15701 1 602 . 1 1 56 56 MET HG2 H 1 2.52 0.0300 . 2 . . . . . 56 MET HG2 . 15701 1 603 . 1 1 56 56 MET HG3 H 1 2.42 0.0300 . 2 . . . . . 56 MET HG3 . 15701 1 604 . 1 1 56 56 MET C C 13 170.32 0.4000 . 1 . . . . . 56 MET C . 15701 1 605 . 1 1 56 56 MET CA C 13 55.11 0.4000 . 1 . . . . . 56 MET CA . 15701 1 606 . 1 1 56 56 MET CB C 13 35.27 0.4000 . 1 . . . . . 56 MET CB . 15701 1 607 . 1 1 56 56 MET CE C 13 16.93 0.4000 . 1 . . . . . 56 MET CE . 15701 1 608 . 1 1 56 56 MET CG C 13 32.76 0.4000 . 1 . . . . . 56 MET CG . 15701 1 609 . 1 1 56 56 MET N N 15 120.63 0.4000 . 1 . . . . . 56 MET N . 15701 1 610 . 1 1 57 57 LYS H H 1 7.85 0.0300 . 1 . . . . . 57 LYS H . 15701 1 611 . 1 1 57 57 LYS HA H 1 3.52 0.0300 . 1 . . . . . 57 LYS HA . 15701 1 612 . 1 1 57 57 LYS HB2 H 1 0.97 0.0300 . 2 . . . . . 57 LYS HB2 . 15701 1 613 . 1 1 57 57 LYS HB3 H 1 0.68 0.0300 . 2 . . . . . 57 LYS HB3 . 15701 1 614 . 1 1 57 57 LYS HD2 H 1 1.35 0.0300 . 2 . . . . . 57 LYS HD2 . 15701 1 615 . 1 1 57 57 LYS HD3 H 1 1.31 0.0300 . 2 . . . . . 57 LYS HD3 . 15701 1 616 . 1 1 57 57 LYS HE2 H 1 2.74 0.0300 . 2 . . . . . 57 LYS HE2 . 15701 1 617 . 1 1 57 57 LYS HE3 H 1 2.74 0.0300 . 2 . . . . . 57 LYS HE3 . 15701 1 618 . 1 1 57 57 LYS HG2 H 1 0.56 0.0300 . 2 . . . . . 57 LYS HG2 . 15701 1 619 . 1 1 57 57 LYS HG3 H 1 0.31 0.0300 . 2 . . . . . 57 LYS HG3 . 15701 1 620 . 1 1 57 57 LYS C C 13 172.23 0.4000 . 1 . . . . . 57 LYS C . 15701 1 621 . 1 1 57 57 LYS CA C 13 54.85 0.4000 . 1 . . . . . 57 LYS CA . 15701 1 622 . 1 1 57 57 LYS CB C 13 33.42 0.4000 . 1 . . . . . 57 LYS CB . 15701 1 623 . 1 1 57 57 LYS CD C 13 29.33 0.4000 . 1 . . . . . 57 LYS CD . 15701 1 624 . 1 1 57 57 LYS CE C 13 41.65 0.4000 . 1 . . . . . 57 LYS CE . 15701 1 625 . 1 1 57 57 LYS CG C 13 23.84 0.4000 . 1 . . . . . 57 LYS CG . 15701 1 626 . 1 1 57 57 LYS N N 15 125.14 0.4000 . 1 . . . . . 57 LYS N . 15701 1 627 . 1 1 58 58 CYS H H 1 8.68 0.0300 . 1 . . . . . 58 CYS H . 15701 1 628 . 1 1 58 58 CYS HA H 1 3.63 0.0300 . 1 . . . . . 58 CYS HA . 15701 1 629 . 1 1 58 58 CYS HB2 H 1 2.84 0.0300 . 2 . . . . . 58 CYS HB2 . 15701 1 630 . 1 1 58 58 CYS HB3 H 1 2.55 0.0300 . 2 . . . . . 58 CYS HB3 . 15701 1 631 . 1 1 58 58 CYS C C 13 175.08 0.4000 . 1 . . . . . 58 CYS C . 15701 1 632 . 1 1 58 58 CYS CA C 13 60.10 0.4000 . 1 . . . . . 58 CYS CA . 15701 1 633 . 1 1 58 58 CYS CB C 13 30.62 0.4000 . 1 . . . . . 58 CYS CB . 15701 1 634 . 1 1 58 58 CYS N N 15 126.47 0.4000 . 1 . . . . . 58 CYS N . 15701 1 635 . 1 1 59 59 LYS H H 1 7.45 0.0300 . 1 . . . . . 59 LYS H . 15701 1 636 . 1 1 59 59 LYS HA H 1 4.02 0.0300 . 1 . . . . . 59 LYS HA . 15701 1 637 . 1 1 59 59 LYS HB2 H 1 1.86 0.0300 . 2 . . . . . 59 LYS HB2 . 15701 1 638 . 1 1 59 59 LYS HB3 H 1 1.68 0.0300 . 2 . . . . . 59 LYS HB3 . 15701 1 639 . 1 1 59 59 LYS HD2 H 1 1.74 0.0300 . 2 . . . . . 59 LYS HD2 . 15701 1 640 . 1 1 59 59 LYS HD3 H 1 1.74 0.0300 . 2 . . . . . 59 LYS HD3 . 15701 1 641 . 1 1 59 59 LYS HE2 H 1 3.06 0.0300 . 2 . . . . . 59 LYS HE2 . 15701 1 642 . 1 1 59 59 LYS HE3 H 1 3.06 0.0300 . 2 . . . . . 59 LYS HE3 . 15701 1 643 . 1 1 59 59 LYS HG2 H 1 1.52 0.0300 . 2 . . . . . 59 LYS HG2 . 15701 1 644 . 1 1 59 59 LYS HG3 H 1 1.46 0.0300 . 2 . . . . . 59 LYS HG3 . 15701 1 645 . 1 1 59 59 LYS C C 13 173.46 0.4000 . 1 . . . . . 59 LYS C . 15701 1 646 . 1 1 59 59 LYS CA C 13 57.85 0.4000 . 1 . . . . . 59 LYS CA . 15701 1 647 . 1 1 59 59 LYS CB C 13 33.08 0.4000 . 1 . . . . . 59 LYS CB . 15701 1 648 . 1 1 59 59 LYS CD C 13 29.20 0.4000 . 1 . . . . . 59 LYS CD . 15701 1 649 . 1 1 59 59 LYS CE C 13 41.96 0.4000 . 1 . . . . . 59 LYS CE . 15701 1 650 . 1 1 59 59 LYS CG C 13 25.55 0.4000 . 1 . . . . . 59 LYS CG . 15701 1 651 . 1 1 59 59 LYS N N 15 128.51 0.4000 . 1 . . . . . 59 LYS N . 15701 1 652 . 1 1 60 60 ILE H H 1 9.12 0.0300 . 1 . . . . . 60 ILE H . 15701 1 653 . 1 1 60 60 ILE HA H 1 3.84 0.0300 . 1 . . . . . 60 ILE HA . 15701 1 654 . 1 1 60 60 ILE HB H 1 1.92 0.0300 . 1 . . . . . 60 ILE HB . 15701 1 655 . 1 1 60 60 ILE HD11 H 1 0.78 0.0300 . 1 . . . . . 60 ILE HD1 . 15701 1 656 . 1 1 60 60 ILE HD12 H 1 0.78 0.0300 . 1 . . . . . 60 ILE HD1 . 15701 1 657 . 1 1 60 60 ILE HD13 H 1 0.78 0.0300 . 1 . . . . . 60 ILE HD1 . 15701 1 658 . 1 1 60 60 ILE HG12 H 1 1.36 0.0300 . 2 . . . . . 60 ILE HG12 . 15701 1 659 . 1 1 60 60 ILE HG13 H 1 1.03 0.0300 . 2 . . . . . 60 ILE HG13 . 15701 1 660 . 1 1 60 60 ILE HG21 H 1 0.83 0.0300 . 1 . . . . . 60 ILE HG2 . 15701 1 661 . 1 1 60 60 ILE HG22 H 1 0.83 0.0300 . 1 . . . . . 60 ILE HG2 . 15701 1 662 . 1 1 60 60 ILE HG23 H 1 0.83 0.0300 . 1 . . . . . 60 ILE HG2 . 15701 1 663 . 1 1 60 60 ILE C C 13 174.92 0.4000 . 1 . . . . . 60 ILE C . 15701 1 664 . 1 1 60 60 ILE CA C 13 63.99 0.4000 . 1 . . . . . 60 ILE CA . 15701 1 665 . 1 1 60 60 ILE CB C 13 38.51 0.4000 . 1 . . . . . 60 ILE CB . 15701 1 666 . 1 1 60 60 ILE CD1 C 13 14.15 0.4000 . 1 . . . . . 60 ILE CD1 . 15701 1 667 . 1 1 60 60 ILE CG1 C 13 28.33 0.4000 . 1 . . . . . 60 ILE CG1 . 15701 1 668 . 1 1 60 60 ILE CG2 C 13 18.40 0.4000 . 1 . . . . . 60 ILE CG2 . 15701 1 669 . 1 1 60 60 ILE N N 15 122.83 0.4000 . 1 . . . . . 60 ILE N . 15701 1 670 . 1 1 61 61 CYS H H 1 8.90 0.0300 . 1 . . . . . 61 CYS H . 15701 1 671 . 1 1 61 61 CYS HA H 1 4.96 0.0300 . 1 . . . . . 61 CYS HA . 15701 1 672 . 1 1 61 61 CYS HB2 H 1 3.17 0.0300 . 2 . . . . . 61 CYS HB2 . 15701 1 673 . 1 1 61 61 CYS HB3 H 1 2.42 0.0300 . 2 . . . . . 61 CYS HB3 . 15701 1 674 . 1 1 61 61 CYS C C 13 173.53 0.4000 . 1 . . . . . 61 CYS C . 15701 1 675 . 1 1 61 61 CYS CA C 13 58.75 0.4000 . 1 . . . . . 61 CYS CA . 15701 1 676 . 1 1 61 61 CYS CB C 13 32.74 0.4000 . 1 . . . . . 61 CYS CB . 15701 1 677 . 1 1 61 61 CYS N N 15 120.65 0.4000 . 1 . . . . . 61 CYS N . 15701 1 678 . 1 1 62 62 GLU H H 1 7.24 0.0300 . 1 . . . . . 62 GLU H . 15701 1 679 . 1 1 62 62 GLU HA H 1 3.83 0.0300 . 1 . . . . . 62 GLU HA . 15701 1 680 . 1 1 62 62 GLU HB2 H 1 2.14 0.0300 . 2 . . . . . 62 GLU HB2 . 15701 1 681 . 1 1 62 62 GLU HB3 H 1 2.45 0.0300 . 2 . . . . . 62 GLU HB3 . 15701 1 682 . 1 1 62 62 GLU HG2 H 1 2.03 0.0300 . 2 . . . . . 62 GLU HG2 . 15701 1 683 . 1 1 62 62 GLU HG3 H 1 1.92 0.0300 . 2 . . . . . 62 GLU HG3 . 15701 1 684 . 1 1 62 62 GLU C C 13 170.72 0.4000 . 1 . . . . . 62 GLU C . 15701 1 685 . 1 1 62 62 GLU CA C 13 58.96 0.4000 . 1 . . . . . 62 GLU CA . 15701 1 686 . 1 1 62 62 GLU CB C 13 26.79 0.4000 . 1 . . . . . 62 GLU CB . 15701 1 687 . 1 1 62 62 GLU CG C 13 36.92 0.4000 . 1 . . . . . 62 GLU CG . 15701 1 688 . 1 1 62 62 GLU N N 15 114.65 0.4000 . 1 . . . . . 62 GLU N . 15701 1 689 . 1 1 63 63 SER H H 1 8.13 0.0300 . 1 . . . . . 63 SER H . 15701 1 690 . 1 1 63 63 SER HA H 1 4.39 0.0300 . 1 . . . . . 63 SER HA . 15701 1 691 . 1 1 63 63 SER HB2 H 1 3.87 0.0300 . 2 . . . . . 63 SER HB2 . 15701 1 692 . 1 1 63 63 SER HB3 H 1 3.87 0.0300 . 2 . . . . . 63 SER HB3 . 15701 1 693 . 1 1 63 63 SER CA C 13 58.13 0.4000 . 1 . . . . . 63 SER CA . 15701 1 694 . 1 1 63 63 SER CB C 13 64.18 0.4000 . 1 . . . . . 63 SER CB . 15701 1 695 . 1 1 63 63 SER N N 15 114.69 0.4000 . 1 . . . . . 63 SER N . 15701 1 696 . 1 1 64 64 TYR HA H 1 4.61 0.0300 . 1 . . . . . 64 TYR HA . 15701 1 697 . 1 1 64 64 TYR HB2 H 1 3.11 0.0300 . 2 . . . . . 64 TYR HB2 . 15701 1 698 . 1 1 64 64 TYR HB3 H 1 3.11 0.0300 . 2 . . . . . 64 TYR HB3 . 15701 1 699 . 1 1 64 64 TYR HD1 H 1 6.75 0.0300 . 1 . . . . . 64 TYR HD1 . 15701 1 700 . 1 1 64 64 TYR HD2 H 1 6.75 0.0300 . 1 . . . . . 64 TYR HD2 . 15701 1 701 . 1 1 64 64 TYR HE1 H 1 6.50 0.0300 . 1 . . . . . 64 TYR HE1 . 15701 1 702 . 1 1 64 64 TYR HE2 H 1 6.50 0.0300 . 1 . . . . . 64 TYR HE2 . 15701 1 703 . 1 1 64 64 TYR C C 13 174.14 0.4000 . 1 . . . . . 64 TYR C . 15701 1 704 . 1 1 64 64 TYR CA C 13 59.03 0.4000 . 1 . . . . . 64 TYR CA . 15701 1 705 . 1 1 64 64 TYR CB C 13 38.35 0.4000 . 1 . . . . . 64 TYR CB . 15701 1 706 . 1 1 64 64 TYR CD1 C 13 130.20 0.4000 . 1 . . . . . 64 TYR CD1 . 15701 1 707 . 1 1 64 64 TYR CD2 C 13 130.20 0.4000 . 1 . . . . . 64 TYR CD2 . 15701 1 708 . 1 1 64 64 TYR CE1 C 13 114.90 0.4000 . 1 . . . . . 64 TYR CE1 . 15701 1 709 . 1 1 64 64 TYR CE2 C 13 114.90 0.4000 . 1 . . . . . 64 TYR CE2 . 15701 1 710 . 1 1 65 65 ASN H H 1 9.41 0.0300 . 1 . . . . . 65 ASN H . 15701 1 711 . 1 1 65 65 ASN HA H 1 5.01 0.0300 . 1 . . . . . 65 ASN HA . 15701 1 712 . 1 1 65 65 ASN HB2 H 1 3.02 0.0300 . 2 . . . . . 65 ASN HB2 . 15701 1 713 . 1 1 65 65 ASN HB3 H 1 2.66 0.0300 . 2 . . . . . 65 ASN HB3 . 15701 1 714 . 1 1 65 65 ASN HD21 H 1 8.08 0.0300 . 2 . . . . . 65 ASN HD21 . 15701 1 715 . 1 1 65 65 ASN HD22 H 1 7.08 0.0300 . 2 . . . . . 65 ASN HD22 . 15701 1 716 . 1 1 65 65 ASN C C 13 170.80 0.4000 . 1 . . . . . 65 ASN C . 15701 1 717 . 1 1 65 65 ASN CA C 13 51.73 0.4000 . 1 . . . . . 65 ASN CA . 15701 1 718 . 1 1 65 65 ASN CB C 13 35.88 0.4000 . 1 . . . . . 65 ASN CB . 15701 1 719 . 1 1 65 65 ASN N N 15 124.59 0.4000 . 1 . . . . . 65 ASN N . 15701 1 720 . 1 1 65 65 ASN ND2 N 15 113.90 0.4000 . 1 . . . . . 65 ASN ND2 . 15701 1 721 . 1 1 66 66 THR H H 1 8.04 0.0300 . 1 . . . . . 66 THR H . 15701 1 722 . 1 1 66 66 THR HA H 1 4.96 0.0300 . 1 . . . . . 66 THR HA . 15701 1 723 . 1 1 66 66 THR HB H 1 3.91 0.0300 . 1 . . . . . 66 THR HB . 15701 1 724 . 1 1 66 66 THR HG21 H 1 0.93 0.0300 . 1 . . . . . 66 THR HG2 . 15701 1 725 . 1 1 66 66 THR HG22 H 1 0.93 0.0300 . 1 . . . . . 66 THR HG2 . 15701 1 726 . 1 1 66 66 THR HG23 H 1 0.93 0.0300 . 1 . . . . . 66 THR HG2 . 15701 1 727 . 1 1 66 66 THR C C 13 169.06 0.4000 . 1 . . . . . 66 THR C . 15701 1 728 . 1 1 66 66 THR CA C 13 58.65 0.4000 . 1 . . . . . 66 THR CA . 15701 1 729 . 1 1 66 66 THR CB C 13 72.83 0.4000 . 1 . . . . . 66 THR CB . 15701 1 730 . 1 1 66 66 THR CG2 C 13 21.88 0.4000 . 1 . . . . . 66 THR CG2 . 15701 1 731 . 1 1 66 66 THR N N 15 110.13 0.4000 . 1 . . . . . 66 THR N . 15701 1 732 . 1 1 67 67 ALA H H 1 8.56 0.0300 . 1 . . . . . 67 ALA H . 15701 1 733 . 1 1 67 67 ALA HA H 1 4.69 0.0300 . 1 . . . . . 67 ALA HA . 15701 1 734 . 1 1 67 67 ALA HB1 H 1 1.41 0.0300 . 1 . . . . . 67 ALA HB . 15701 1 735 . 1 1 67 67 ALA HB2 H 1 1.41 0.0300 . 1 . . . . . 67 ALA HB . 15701 1 736 . 1 1 67 67 ALA HB3 H 1 1.41 0.0300 . 1 . . . . . 67 ALA HB . 15701 1 737 . 1 1 67 67 ALA C C 13 173.64 0.4000 . 1 . . . . . 67 ALA C . 15701 1 738 . 1 1 67 67 ALA CA C 13 51.07 0.4000 . 1 . . . . . 67 ALA CA . 15701 1 739 . 1 1 67 67 ALA CB C 13 22.56 0.4000 . 1 . . . . . 67 ALA CB . 15701 1 740 . 1 1 67 67 ALA N N 15 120.40 0.4000 . 1 . . . . . 67 ALA N . 15701 1 741 . 1 1 68 68 GLN H H 1 8.91 0.0300 . 1 . . . . . 68 GLN H . 15701 1 742 . 1 1 68 68 GLN HA H 1 4.38 0.0300 . 1 . . . . . 68 GLN HA . 15701 1 743 . 1 1 68 68 GLN HB2 H 1 2.12 0.0300 . 2 . . . . . 68 GLN HB2 . 15701 1 744 . 1 1 68 68 GLN HB3 H 1 1.96 0.0300 . 2 . . . . . 68 GLN HB3 . 15701 1 745 . 1 1 68 68 GLN HE21 H 1 6.82 0.0300 . 2 . . . . . 68 GLN HE21 . 15701 1 746 . 1 1 68 68 GLN HE22 H 1 7.60 0.0300 . 2 . . . . . 68 GLN HE22 . 15701 1 747 . 1 1 68 68 GLN HG2 H 1 2.44 0.0300 . 2 . . . . . 68 GLN HG2 . 15701 1 748 . 1 1 68 68 GLN HG3 H 1 2.34 0.0300 . 2 . . . . . 68 GLN HG3 . 15701 1 749 . 1 1 68 68 GLN C C 13 173.32 0.4000 . 1 . . . . . 68 GLN C . 15701 1 750 . 1 1 68 68 GLN CA C 13 57.61 0.4000 . 1 . . . . . 68 GLN CA . 15701 1 751 . 1 1 68 68 GLN CB C 13 29.25 0.4000 . 1 . . . . . 68 GLN CB . 15701 1 752 . 1 1 68 68 GLN CG C 13 34.84 0.4000 . 1 . . . . . 68 GLN CG . 15701 1 753 . 1 1 68 68 GLN N N 15 120.57 0.4000 . 1 . . . . . 68 GLN N . 15701 1 754 . 1 1 68 68 GLN NE2 N 15 110.70 0.4000 . 1 . . . . . 68 GLN NE2 . 15701 1 755 . 1 1 69 69 ALA H H 1 8.92 0.0300 . 1 . . . . . 69 ALA H . 15701 1 756 . 1 1 69 69 ALA HA H 1 4.37 0.0300 . 1 . . . . . 69 ALA HA . 15701 1 757 . 1 1 69 69 ALA HB1 H 1 1.21 0.0300 . 1 . . . . . 69 ALA HB . 15701 1 758 . 1 1 69 69 ALA HB2 H 1 1.21 0.0300 . 1 . . . . . 69 ALA HB . 15701 1 759 . 1 1 69 69 ALA HB3 H 1 1.21 0.0300 . 1 . . . . . 69 ALA HB . 15701 1 760 . 1 1 69 69 ALA C C 13 174.63 0.4000 . 1 . . . . . 69 ALA C . 15701 1 761 . 1 1 69 69 ALA CA C 13 52.08 0.4000 . 1 . . . . . 69 ALA CA . 15701 1 762 . 1 1 69 69 ALA CB C 13 19.75 0.4000 . 1 . . . . . 69 ALA CB . 15701 1 763 . 1 1 69 69 ALA N N 15 128.72 0.4000 . 1 . . . . . 69 ALA N . 15701 1 764 . 1 1 70 70 GLY H H 1 8.33 0.0300 . 1 . . . . . 70 GLY H . 15701 1 765 . 1 1 70 70 GLY HA2 H 1 4.00 0.0300 . 2 . . . . . 70 GLY HA2 . 15701 1 766 . 1 1 70 70 GLY HA3 H 1 4.00 0.0300 . 2 . . . . . 70 GLY HA3 . 15701 1 767 . 1 1 70 70 GLY C C 13 171.58 0.4000 . 1 . . . . . 70 GLY C . 15701 1 768 . 1 1 70 70 GLY CA C 13 45.20 0.4000 . 1 . . . . . 70 GLY CA . 15701 1 769 . 1 1 70 70 GLY N N 15 108.44 0.4000 . 1 . . . . . 70 GLY N . 15701 1 770 . 1 1 71 71 GLY H H 1 8.33 0.0300 . 1 . . . . . 71 GLY H . 15701 1 771 . 1 1 71 71 GLY HA2 H 1 3.94 0.0300 . 2 . . . . . 71 GLY HA2 . 15701 1 772 . 1 1 71 71 GLY HA3 H 1 3.94 0.0300 . 2 . . . . . 71 GLY HA3 . 15701 1 773 . 1 1 71 71 GLY C C 13 171.15 0.4000 . 1 . . . . . 71 GLY C . 15701 1 774 . 1 1 71 71 GLY CA C 13 45.17 0.4000 . 1 . . . . . 71 GLY CA . 15701 1 775 . 1 1 71 71 GLY N N 15 108.43 0.4000 . 1 . . . . . 71 GLY N . 15701 1 776 . 1 1 72 72 ARG H H 1 8.21 0.0300 . 1 . . . . . 72 ARG H . 15701 1 777 . 1 1 72 72 ARG HA H 1 4.34 0.0300 . 1 . . . . . 72 ARG HA . 15701 1 778 . 1 1 72 72 ARG HB2 H 1 1.75 0.0300 . 2 . . . . . 72 ARG HB2 . 15701 1 779 . 1 1 72 72 ARG HB3 H 1 1.70 0.0300 . 2 . . . . . 72 ARG HB3 . 15701 1 780 . 1 1 72 72 ARG HD2 H 1 3.08 0.0300 . 2 . . . . . 72 ARG HD2 . 15701 1 781 . 1 1 72 72 ARG HD3 H 1 3.08 0.0300 . 2 . . . . . 72 ARG HD3 . 15701 1 782 . 1 1 72 72 ARG HG2 H 1 1.57 0.0300 . 2 . . . . . 72 ARG HG2 . 15701 1 783 . 1 1 72 72 ARG HG3 H 1 1.57 0.0300 . 2 . . . . . 72 ARG HG3 . 15701 1 784 . 1 1 72 72 ARG C C 13 173.35 0.4000 . 1 . . . . . 72 ARG C . 15701 1 785 . 1 1 72 72 ARG CA C 13 55.70 0.4000 . 1 . . . . . 72 ARG CA . 15701 1 786 . 1 1 72 72 ARG CB C 13 30.90 0.4000 . 1 . . . . . 72 ARG CB . 15701 1 787 . 1 1 72 72 ARG CD C 13 43.30 0.4000 . 1 . . . . . 72 ARG CD . 15701 1 788 . 1 1 72 72 ARG CG C 13 27.04 0.4000 . 1 . . . . . 72 ARG CG . 15701 1 789 . 1 1 72 72 ARG N N 15 120.59 0.4000 . 1 . . . . . 72 ARG N . 15701 1 790 . 1 1 73 73 ARG H H 1 8.45 0.0300 . 1 . . . . . 73 ARG H . 15701 1 791 . 1 1 73 73 ARG HA H 1 4.35 0.0300 . 1 . . . . . 73 ARG HA . 15701 1 792 . 1 1 73 73 ARG HB2 H 1 1.74 0.0300 . 2 . . . . . 73 ARG HB2 . 15701 1 793 . 1 1 73 73 ARG HB3 H 1 1.74 0.0300 . 2 . . . . . 73 ARG HB3 . 15701 1 794 . 1 1 73 73 ARG HD2 H 1 3.13 0.0300 . 2 . . . . . 73 ARG HD2 . 15701 1 795 . 1 1 73 73 ARG HD3 H 1 3.13 0.0300 . 2 . . . . . 73 ARG HD3 . 15701 1 796 . 1 1 73 73 ARG HG2 H 1 1.57 0.0300 . 2 . . . . . 73 ARG HG2 . 15701 1 797 . 1 1 73 73 ARG HG3 H 1 1.57 0.0300 . 2 . . . . . 73 ARG HG3 . 15701 1 798 . 1 1 73 73 ARG C C 13 173.20 0.4000 . 1 . . . . . 73 ARG C . 15701 1 799 . 1 1 73 73 ARG CA C 13 55.56 0.4000 . 1 . . . . . 73 ARG CA . 15701 1 800 . 1 1 73 73 ARG CB C 13 30.69 0.4000 . 1 . . . . . 73 ARG CB . 15701 1 801 . 1 1 73 73 ARG CD C 13 43.30 0.4000 . 1 . . . . . 73 ARG CD . 15701 1 802 . 1 1 73 73 ARG CG C 13 27.41 0.4000 . 1 . . . . . 73 ARG CG . 15701 1 803 . 1 1 73 73 ARG N N 15 123.80 0.4000 . 1 . . . . . 73 ARG N . 15701 1 804 . 1 1 74 74 ILE H H 1 8.36 0.0300 . 1 . . . . . 74 ILE H . 15701 1 805 . 1 1 74 74 ILE HA H 1 4.16 0.0300 . 1 . . . . . 74 ILE HA . 15701 1 806 . 1 1 74 74 ILE HB H 1 1.81 0.0300 . 1 . . . . . 74 ILE HB . 15701 1 807 . 1 1 74 74 ILE HD11 H 1 0.80 0.0300 . 1 . . . . . 74 ILE HD1 . 15701 1 808 . 1 1 74 74 ILE HD12 H 1 0.80 0.0300 . 1 . . . . . 74 ILE HD1 . 15701 1 809 . 1 1 74 74 ILE HD13 H 1 0.80 0.0300 . 1 . . . . . 74 ILE HD1 . 15701 1 810 . 1 1 74 74 ILE HG12 H 1 1.41 0.0300 . 2 . . . . . 74 ILE HG12 . 15701 1 811 . 1 1 74 74 ILE HG13 H 1 1.12 0.0300 . 2 . . . . . 74 ILE HG13 . 15701 1 812 . 1 1 74 74 ILE HG21 H 1 0.85 0.0300 . 1 . . . . . 74 ILE HG2 . 15701 1 813 . 1 1 74 74 ILE HG22 H 1 0.85 0.0300 . 1 . . . . . 74 ILE HG2 . 15701 1 814 . 1 1 74 74 ILE HG23 H 1 0.85 0.0300 . 1 . . . . . 74 ILE HG2 . 15701 1 815 . 1 1 74 74 ILE C C 13 173.23 0.4000 . 1 . . . . . 74 ILE C . 15701 1 816 . 1 1 74 74 ILE CA C 13 61.03 0.4000 . 1 . . . . . 74 ILE CA . 15701 1 817 . 1 1 74 74 ILE CB C 13 38.92 0.4000 . 1 . . . . . 74 ILE CB . 15701 1 818 . 1 1 74 74 ILE CD1 C 13 13.01 0.4000 . 1 . . . . . 74 ILE CD1 . 15701 1 819 . 1 1 74 74 ILE CG1 C 13 27.25 0.4000 . 1 . . . . . 74 ILE CG1 . 15701 1 820 . 1 1 74 74 ILE CG2 C 13 17.58 0.4000 . 1 . . . . . 74 ILE CG2 . 15701 1 821 . 1 1 74 74 ILE N N 15 123.33 0.4000 . 1 . . . . . 74 ILE N . 15701 1 822 . 1 1 75 75 SER H H 1 8.34 0.0300 . 1 . . . . . 75 SER H . 15701 1 823 . 1 1 75 75 SER HA H 1 4.45 0.0300 . 1 . . . . . 75 SER HA . 15701 1 824 . 1 1 75 75 SER HB2 H 1 3.79 0.0300 . 2 . . . . . 75 SER HB2 . 15701 1 825 . 1 1 75 75 SER HB3 H 1 3.79 0.0300 . 2 . . . . . 75 SER HB3 . 15701 1 826 . 1 1 75 75 SER C C 13 171.62 0.4000 . 1 . . . . . 75 SER C . 15701 1 827 . 1 1 75 75 SER CA C 13 57.89 0.4000 . 1 . . . . . 75 SER CA . 15701 1 828 . 1 1 75 75 SER CB C 13 64.00 0.4000 . 1 . . . . . 75 SER CB . 15701 1 829 . 1 1 75 75 SER N N 15 119.95 0.4000 . 1 . . . . . 75 SER N . 15701 1 830 . 1 1 76 76 LEU H H 1 8.40 0.0300 . 1 . . . . . 76 LEU H . 15701 1 831 . 1 1 76 76 LEU HA H 1 4.30 0.0300 . 1 . . . . . 76 LEU HA . 15701 1 832 . 1 1 76 76 LEU HB2 H 1 1.58 0.0300 . 2 . . . . . 76 LEU HB2 . 15701 1 833 . 1 1 76 76 LEU HB3 H 1 1.58 0.0300 . 2 . . . . . 76 LEU HB3 . 15701 1 834 . 1 1 76 76 LEU HD11 H 1 0.88 0.0300 . 2 . . . . . 76 LEU HD1 . 15701 1 835 . 1 1 76 76 LEU HD12 H 1 0.88 0.0300 . 2 . . . . . 76 LEU HD1 . 15701 1 836 . 1 1 76 76 LEU HD13 H 1 0.88 0.0300 . 2 . . . . . 76 LEU HD1 . 15701 1 837 . 1 1 76 76 LEU HD21 H 1 0.79 0.0300 . 2 . . . . . 76 LEU HD2 . 15701 1 838 . 1 1 76 76 LEU HD22 H 1 0.79 0.0300 . 2 . . . . . 76 LEU HD2 . 15701 1 839 . 1 1 76 76 LEU HD23 H 1 0.79 0.0300 . 2 . . . . . 76 LEU HD2 . 15701 1 840 . 1 1 76 76 LEU C C 13 173.73 0.4000 . 1 . . . . . 76 LEU C . 15701 1 841 . 1 1 76 76 LEU CA C 13 55.51 0.4000 . 1 . . . . . 76 LEU CA . 15701 1 842 . 1 1 76 76 LEU CB C 13 42.29 0.4000 . 1 . . . . . 76 LEU CB . 15701 1 843 . 1 1 76 76 LEU CD1 C 13 24.97 0.4000 . 1 . . . . . 76 LEU CD1 . 15701 1 844 . 1 1 76 76 LEU CD2 C 13 23.76 0.4000 . 1 . . . . . 76 LEU CD2 . 15701 1 845 . 1 1 76 76 LEU N N 15 124.86 0.4000 . 1 . . . . . 76 LEU N . 15701 1 846 . 1 1 77 77 ASP H H 1 8.24 0.0300 . 1 . . . . . 77 ASP H . 15701 1 847 . 1 1 77 77 ASP HA H 1 4.53 0.0300 . 1 . . . . . 77 ASP HA . 15701 1 848 . 1 1 77 77 ASP HB2 H 1 2.65 0.0300 . 2 . . . . . 77 ASP HB2 . 15701 1 849 . 1 1 77 77 ASP HB3 H 1 2.57 0.0300 . 2 . . . . . 77 ASP HB3 . 15701 1 850 . 1 1 77 77 ASP C C 13 173.19 0.4000 . 1 . . . . . 77 ASP C . 15701 1 851 . 1 1 77 77 ASP CA C 13 54.54 0.4000 . 1 . . . . . 77 ASP CA . 15701 1 852 . 1 1 77 77 ASP CB C 13 41.25 0.4000 . 1 . . . . . 77 ASP CB . 15701 1 853 . 1 1 77 77 ASP N N 15 119.92 0.4000 . 1 . . . . . 77 ASP N . 15701 1 854 . 1 1 78 78 GLN H H 1 8.12 0.0300 . 1 . . . . . 78 GLN H . 15701 1 855 . 1 1 78 78 GLN HA H 1 4.31 0.0300 . 1 . . . . . 78 GLN HA . 15701 1 856 . 1 1 78 78 GLN HB2 H 1 1.95 0.0300 . 2 . . . . . 78 GLN HB2 . 15701 1 857 . 1 1 78 78 GLN HB3 H 1 1.95 0.0300 . 2 . . . . . 78 GLN HB3 . 15701 1 858 . 1 1 78 78 GLN HE21 H 1 6.81 0.0300 . 2 . . . . . 78 GLN HE21 . 15701 1 859 . 1 1 78 78 GLN HE22 H 1 7.58 0.0300 . 2 . . . . . 78 GLN HE22 . 15701 1 860 . 1 1 78 78 GLN HG2 H 1 2.30 0.0300 . 2 . . . . . 78 GLN HG2 . 15701 1 861 . 1 1 78 78 GLN HG3 H 1 2.30 0.0300 . 2 . . . . . 78 GLN HG3 . 15701 1 862 . 1 1 78 78 GLN C C 13 171.81 0.4000 . 1 . . . . . 78 GLN C . 15701 1 863 . 1 1 78 78 GLN CA C 13 55.45 0.4000 . 1 . . . . . 78 GLN CA . 15701 1 864 . 1 1 78 78 GLN CB C 13 29.92 0.4000 . 1 . . . . . 78 GLN CB . 15701 1 865 . 1 1 78 78 GLN CG C 13 33.86 0.4000 . 1 . . . . . 78 GLN CG . 15701 1 866 . 1 1 78 78 GLN N N 15 120.08 0.4000 . 1 . . . . . 78 GLN N . 15701 1 867 . 1 1 78 78 GLN NE2 N 15 112.20 0.4000 . 1 . . . . . 78 GLN NE2 . 15701 1 868 . 1 1 79 79 GLN H H 1 7.94 0.0300 . 1 . . . . . 79 GLN H . 15701 1 869 . 1 1 79 79 GLN HA H 1 4.02 0.0300 . 1 . . . . . 79 GLN HA . 15701 1 870 . 1 1 79 79 GLN HB2 H 1 1.97 0.0300 . 2 . . . . . 79 GLN HB2 . 15701 1 871 . 1 1 79 79 GLN HB3 H 1 1.97 0.0300 . 2 . . . . . 79 GLN HB3 . 15701 1 872 . 1 1 79 79 GLN HG2 H 1 2.27 0.0300 . 2 . . . . . 79 GLN HG2 . 15701 1 873 . 1 1 79 79 GLN HG3 H 1 2.13 0.0300 . 2 . . . . . 79 GLN HG3 . 15701 1 874 . 1 1 79 79 GLN CA C 13 58.60 0.4000 . 1 . . . . . 79 GLN CA . 15701 1 875 . 1 1 79 79 GLN CB C 13 30.03 0.4000 . 1 . . . . . 79 GLN CB . 15701 1 876 . 1 1 79 79 GLN CG C 13 36.42 0.4000 . 1 . . . . . 79 GLN CG . 15701 1 877 . 1 1 79 79 GLN N N 15 115.07 0.4000 . 1 . . . . . 79 GLN N . 15701 1 stop_ save_