################################### # 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 15916 _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' . . . 15916 1 2 '3D HNCA' . . . 15916 1 3 '3D CBCA(CO)NH' . . . 15916 1 4 '3D HBHA(CO)NH' . . . 15916 1 5 '3D (H)C(CO)NH_TOCSY' . . . 15916 1 6 '3D H(CCO)NH_TOCSY' . . . 15916 1 7 '3D H(C)CH-TOCSY' . . . 15916 1 8 '3D (H)CCH-TOCSY' . . . 15916 1 9 '3D 1H-15N NOESY' . . . 15916 1 10 '3D 1H-13C NOESY' . . . 15916 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 3 $FMC . . 15916 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 22 22 MET H H 1 8.03 0.0300 . 1 . . . . . 1 MET H . 15916 1 2 . 1 1 22 22 MET HA H 1 4.56 0.0300 . 1 . . . . . 1 MET HA . 15916 1 3 . 1 1 22 22 MET HB2 H 1 1.91 0.0300 . 2 . . . . . 1 MET HB2 . 15916 1 4 . 1 1 22 22 MET HB3 H 1 2.04 0.0300 . 2 . . . . . 1 MET HB3 . 15916 1 5 . 1 1 22 22 MET HG2 H 1 2.45 0.0300 . 2 . . . . . 1 MET HG2 . 15916 1 6 . 1 1 22 22 MET HG3 H 1 2.54 0.0300 . 2 . . . . . 1 MET HG3 . 15916 1 7 . 1 1 22 22 MET C C 13 175.53 0.4000 . 1 . . . . . 1 MET C . 15916 1 8 . 1 1 22 22 MET CA C 13 55.35 0.4000 . 1 . . . . . 1 MET CA . 15916 1 9 . 1 1 22 22 MET CB C 13 33.80 0.4000 . 1 . . . . . 1 MET CB . 15916 1 10 . 1 1 22 22 MET CG C 13 31.99 0.4000 . 1 . . . . . 1 MET CG . 15916 1 11 . 1 1 22 22 MET N N 15 119.02 0.4000 . 1 . . . . . 1 MET N . 15916 1 12 . 1 1 23 23 TYR H H 1 8.51 0.0300 . 1 . . . . . 2 TYR H . 15916 1 13 . 1 1 23 23 TYR HA H 1 4.40 0.0300 . 1 . . . . . 2 TYR HA . 15916 1 14 . 1 1 23 23 TYR HB2 H 1 2.55 0.0300 . 2 . . . . . 2 TYR HB2 . 15916 1 15 . 1 1 23 23 TYR HB3 H 1 2.23 0.0300 . 2 . . . . . 2 TYR HB3 . 15916 1 16 . 1 1 23 23 TYR HD1 H 1 6.78 0.0300 . 1 . . . . . 2 TYR HD1 . 15916 1 17 . 1 1 23 23 TYR HD2 H 1 6.78 0.0300 . 1 . . . . . 2 TYR HD2 . 15916 1 18 . 1 1 23 23 TYR HE1 H 1 6.68 0.0300 . 1 . . . . . 2 TYR HE1 . 15916 1 19 . 1 1 23 23 TYR HE2 H 1 6.68 0.0300 . 1 . . . . . 2 TYR HE2 . 15916 1 20 . 1 1 23 23 TYR C C 13 175.36 0.4000 . 1 . . . . . 2 TYR C . 15916 1 21 . 1 1 23 23 TYR CA C 13 57.74 0.4000 . 1 . . . . . 2 TYR CA . 15916 1 22 . 1 1 23 23 TYR CB C 13 39.74 0.4000 . 1 . . . . . 2 TYR CB . 15916 1 23 . 1 1 23 23 TYR CD1 C 13 133.90 0.4000 . 1 . . . . . 2 TYR CD1 . 15916 1 24 . 1 1 23 23 TYR CE1 C 13 117.80 0.4000 . 1 . . . . . 2 TYR CE1 . 15916 1 25 . 1 1 23 23 TYR N N 15 121.57 0.4000 . 1 . . . . . 2 TYR N . 15916 1 26 . 1 1 24 24 LYS H H 1 8.05 0.0300 . 1 . . . . . 3 LYS H . 15916 1 27 . 1 1 24 24 LYS HA H 1 5.16 0.0300 . 1 . . . . . 3 LYS HA . 15916 1 28 . 1 1 24 24 LYS HB2 H 1 1.72 0.0300 . 2 . . . . . 3 LYS HB2 . 15916 1 29 . 1 1 24 24 LYS HB3 H 1 1.50 0.0300 . 2 . . . . . 3 LYS HB3 . 15916 1 30 . 1 1 24 24 LYS HD2 H 1 1.53 0.0300 . 2 . . . . . 3 LYS HD2 . 15916 1 31 . 1 1 24 24 LYS HD3 H 1 1.53 0.0300 . 2 . . . . . 3 LYS HD3 . 15916 1 32 . 1 1 24 24 LYS HE2 H 1 2.77 0.0300 . 2 . . . . . 3 LYS HE2 . 15916 1 33 . 1 1 24 24 LYS HE3 H 1 2.77 0.0300 . 2 . . . . . 3 LYS HE3 . 15916 1 34 . 1 1 24 24 LYS HG2 H 1 1.22 0.0300 . 2 . . . . . 3 LYS HG2 . 15916 1 35 . 1 1 24 24 LYS HG3 H 1 1.13 0.0300 . 2 . . . . . 3 LYS HG3 . 15916 1 36 . 1 1 24 24 LYS C C 13 174.68 0.4000 . 1 . . . . . 3 LYS C . 15916 1 37 . 1 1 24 24 LYS CA C 13 55.09 0.4000 . 1 . . . . . 3 LYS CA . 15916 1 38 . 1 1 24 24 LYS CB C 13 35.94 0.4000 . 1 . . . . . 3 LYS CB . 15916 1 39 . 1 1 24 24 LYS CD C 13 29.75 0.4000 . 1 . . . . . 3 LYS CD . 15916 1 40 . 1 1 24 24 LYS CE C 13 41.93 0.4000 . 1 . . . . . 3 LYS CE . 15916 1 41 . 1 1 24 24 LYS CG C 13 23.93 0.4000 . 1 . . . . . 3 LYS CG . 15916 1 42 . 1 1 24 24 LYS N N 15 115.58 0.4000 . 1 . . . . . 3 LYS N . 15916 1 43 . 1 1 25 25 PHE H H 1 9.36 0.0300 . 1 . . . . . 4 PHE H . 15916 1 44 . 1 1 25 25 PHE HA H 1 5.75 0.0300 . 1 . . . . . 4 PHE HA . 15916 1 45 . 1 1 25 25 PHE HB2 H 1 2.82 0.0300 . 2 . . . . . 4 PHE HB2 . 15916 1 46 . 1 1 25 25 PHE HB3 H 1 2.82 0.0300 . 2 . . . . . 4 PHE HB3 . 15916 1 47 . 1 1 25 25 PHE HD1 H 1 7.21 0.0300 . 1 . . . . . 4 PHE HD1 . 15916 1 48 . 1 1 25 25 PHE HD2 H 1 7.21 0.0300 . 1 . . . . . 4 PHE HD2 . 15916 1 49 . 1 1 25 25 PHE C C 13 176.15 0.4000 . 1 . . . . . 4 PHE C . 15916 1 50 . 1 1 25 25 PHE CA C 13 57.58 0.4000 . 1 . . . . . 4 PHE CA . 15916 1 51 . 1 1 25 25 PHE CB C 13 41.91 0.4000 . 1 . . . . . 4 PHE CB . 15916 1 52 . 1 1 25 25 PHE CD1 C 13 131.40 0.4000 . 1 . . . . . 4 PHE CD1 . 15916 1 53 . 1 1 25 25 PHE N N 15 119.21 0.4000 . 1 . . . . . 4 PHE N . 15916 1 54 . 1 1 26 26 GLU H H 1 9.15 0.0300 . 1 . . . . . 5 GLU H . 15916 1 55 . 1 1 26 26 GLU HA H 1 5.74 0.0300 . 1 . . . . . 5 GLU HA . 15916 1 56 . 1 1 26 26 GLU HB2 H 1 1.91 0.0300 . 2 . . . . . 5 GLU HB2 . 15916 1 57 . 1 1 26 26 GLU HB3 H 1 1.91 0.0300 . 2 . . . . . 5 GLU HB3 . 15916 1 58 . 1 1 26 26 GLU HG2 H 1 2.12 0.0300 . 2 . . . . . 5 GLU HG2 . 15916 1 59 . 1 1 26 26 GLU HG3 H 1 2.12 0.0300 . 2 . . . . . 5 GLU HG3 . 15916 1 60 . 1 1 26 26 GLU C C 13 176.35 0.4000 . 1 . . . . . 5 GLU C . 15916 1 61 . 1 1 26 26 GLU CA C 13 54.20 0.4000 . 1 . . . . . 5 GLU CA . 15916 1 62 . 1 1 26 26 GLU CB C 13 33.45 0.4000 . 1 . . . . . 5 GLU CB . 15916 1 63 . 1 1 26 26 GLU CG C 13 36.34 0.4000 . 1 . . . . . 5 GLU CG . 15916 1 64 . 1 1 26 26 GLU N N 15 119.49 0.4000 . 1 . . . . . 5 GLU N . 15916 1 65 . 1 1 27 27 ILE H H 1 8.96 0.0300 . 1 . . . . . 6 ILE H . 15916 1 66 . 1 1 27 27 ILE HA H 1 5.27 0.0300 . 1 . . . . . 6 ILE HA . 15916 1 67 . 1 1 27 27 ILE HB H 1 1.91 0.0300 . 1 . . . . . 6 ILE HB . 15916 1 68 . 1 1 27 27 ILE HD11 H 1 0.66 0.0300 . 1 . . . . . 6 ILE HD1 . 15916 1 69 . 1 1 27 27 ILE HD12 H 1 0.66 0.0300 . 1 . . . . . 6 ILE HD1 . 15916 1 70 . 1 1 27 27 ILE HD13 H 1 0.66 0.0300 . 1 . . . . . 6 ILE HD1 . 15916 1 71 . 1 1 27 27 ILE HG12 H 1 1.65 0.0300 . 2 . . . . . 6 ILE HG12 . 15916 1 72 . 1 1 27 27 ILE HG13 H 1 0.81 0.0300 . 2 . . . . . 6 ILE HG13 . 15916 1 73 . 1 1 27 27 ILE HG21 H 1 1.06 0.0300 . 1 . . . . . 6 ILE HG2 . 15916 1 74 . 1 1 27 27 ILE HG22 H 1 1.06 0.0300 . 1 . . . . . 6 ILE HG2 . 15916 1 75 . 1 1 27 27 ILE HG23 H 1 1.06 0.0300 . 1 . . . . . 6 ILE HG2 . 15916 1 76 . 1 1 27 27 ILE C C 13 175.71 0.4000 . 1 . . . . . 6 ILE C . 15916 1 77 . 1 1 27 27 ILE CA C 13 60.56 0.4000 . 1 . . . . . 6 ILE CA . 15916 1 78 . 1 1 27 27 ILE CB C 13 40.25 0.4000 . 1 . . . . . 6 ILE CB . 15916 1 79 . 1 1 27 27 ILE CD1 C 13 14.74 0.4000 . 1 . . . . . 6 ILE CD1 . 15916 1 80 . 1 1 27 27 ILE CG1 C 13 28.70 0.4000 . 1 . . . . . 6 ILE CG1 . 15916 1 81 . 1 1 27 27 ILE CG2 C 13 17.20 0.4000 . 1 . . . . . 6 ILE CG2 . 15916 1 82 . 1 1 27 27 ILE N N 15 123.28 0.4000 . 1 . . . . . 6 ILE N . 15916 1 83 . 1 1 28 28 TYR H H 1 9.22 0.0300 . 1 . . . . . 7 TYR H . 15916 1 84 . 1 1 28 28 TYR HA H 1 5.07 0.0300 . 1 . . . . . 7 TYR HA . 15916 1 85 . 1 1 28 28 TYR HB2 H 1 2.88 0.0300 . 2 . . . . . 7 TYR HB2 . 15916 1 86 . 1 1 28 28 TYR HB3 H 1 3.11 0.0300 . 2 . . . . . 7 TYR HB3 . 15916 1 87 . 1 1 28 28 TYR HD1 H 1 6.87 0.0300 . 1 . . . . . 7 TYR HD1 . 15916 1 88 . 1 1 28 28 TYR HD2 H 1 6.87 0.0300 . 1 . . . . . 7 TYR HD2 . 15916 1 89 . 1 1 28 28 TYR HE1 H 1 6.46 0.0300 . 1 . . . . . 7 TYR HE1 . 15916 1 90 . 1 1 28 28 TYR HE2 H 1 6.46 0.0300 . 1 . . . . . 7 TYR HE2 . 15916 1 91 . 1 1 28 28 TYR C C 13 171.99 0.4000 . 1 . . . . . 7 TYR C . 15916 1 92 . 1 1 28 28 TYR CA C 13 55.18 0.4000 . 1 . . . . . 7 TYR CA . 15916 1 93 . 1 1 28 28 TYR CB C 13 40.73 0.4000 . 1 . . . . . 7 TYR CB . 15916 1 94 . 1 1 28 28 TYR CD1 C 13 133.90 0.4000 . 1 . . . . . 7 TYR CD1 . 15916 1 95 . 1 1 28 28 TYR CE1 C 13 117.60 0.4000 . 1 . . . . . 7 TYR CE1 . 15916 1 96 . 1 1 28 28 TYR N N 15 123.48 0.4000 . 1 . . . . . 7 TYR N . 15916 1 97 . 1 1 29 29 GLN H H 1 8.67 0.0300 . 1 . . . . . 8 GLN H . 15916 1 98 . 1 1 29 29 GLN HA H 1 5.12 0.0300 . 1 . . . . . 8 GLN HA . 15916 1 99 . 1 1 29 29 GLN HB2 H 1 1.63 0.0300 . 2 . . . . . 8 GLN HB2 . 15916 1 100 . 1 1 29 29 GLN HB3 H 1 1.89 0.0300 . 2 . . . . . 8 GLN HB3 . 15916 1 101 . 1 1 29 29 GLN HE21 H 1 6.70 0.0300 . 2 . . . . . 8 GLN HE21 . 15916 1 102 . 1 1 29 29 GLN HE22 H 1 6.81 0.0300 . 2 . . . . . 8 GLN HE22 . 15916 1 103 . 1 1 29 29 GLN HG2 H 1 1.71 0.0300 . 2 . . . . . 8 GLN HG2 . 15916 1 104 . 1 1 29 29 GLN HG3 H 1 1.54 0.0300 . 2 . . . . . 8 GLN HG3 . 15916 1 105 . 1 1 29 29 GLN C C 13 176.03 0.4000 . 1 . . . . . 8 GLN C . 15916 1 106 . 1 1 29 29 GLN CA C 13 53.65 0.4000 . 1 . . . . . 8 GLN CA . 15916 1 107 . 1 1 29 29 GLN CB C 13 32.72 0.4000 . 1 . . . . . 8 GLN CB . 15916 1 108 . 1 1 29 29 GLN CG C 13 35.08 0.4000 . 1 . . . . . 8 GLN CG . 15916 1 109 . 1 1 29 29 GLN N N 15 118.72 0.4000 . 1 . . . . . 8 GLN N . 15916 1 110 . 1 1 29 29 GLN NE2 N 15 111.46 0.4000 . 1 . . . . . 8 GLN NE2 . 15916 1 111 . 1 1 30 30 ASP H H 1 8.78 0.0300 . 1 . . . . . 9 ASP H . 15916 1 112 . 1 1 30 30 ASP HA H 1 4.78 0.0300 . 1 . . . . . 9 ASP HA . 15916 1 113 . 1 1 30 30 ASP HB2 H 1 3.52 0.0300 . 2 . . . . . 9 ASP HB2 . 15916 1 114 . 1 1 30 30 ASP HB3 H 1 3.47 0.0300 . 2 . . . . . 9 ASP HB3 . 15916 1 115 . 1 1 30 30 ASP C C 13 176.03 0.4000 . 1 . . . . . 9 ASP C . 15916 1 116 . 1 1 30 30 ASP CA C 13 52.38 0.4000 . 1 . . . . . 9 ASP CA . 15916 1 117 . 1 1 30 30 ASP CB C 13 42.45 0.4000 . 1 . . . . . 9 ASP CB . 15916 1 118 . 1 1 30 30 ASP N N 15 124.99 0.4000 . 1 . . . . . 9 ASP N . 15916 1 119 . 1 1 31 31 LYS HA H 1 4.10 0.0300 . 1 . . . . . 10 LYS HA . 15916 1 120 . 1 1 31 31 LYS HB2 H 1 1.89 0.0300 . 2 . . . . . 10 LYS HB2 . 15916 1 121 . 1 1 31 31 LYS HB3 H 1 1.89 0.0300 . 2 . . . . . 10 LYS HB3 . 15916 1 122 . 1 1 31 31 LYS HD2 H 1 1.71 0.0300 . 2 . . . . . 10 LYS HD2 . 15916 1 123 . 1 1 31 31 LYS HD3 H 1 1.71 0.0300 . 2 . . . . . 10 LYS HD3 . 15916 1 124 . 1 1 31 31 LYS HE2 H 1 3.02 0.0300 . 2 . . . . . 10 LYS HE2 . 15916 1 125 . 1 1 31 31 LYS HE3 H 1 3.02 0.0300 . 2 . . . . . 10 LYS HE3 . 15916 1 126 . 1 1 31 31 LYS HG2 H 1 1.52 0.0300 . 2 . . . . . 10 LYS HG2 . 15916 1 127 . 1 1 31 31 LYS HG3 H 1 1.52 0.0300 . 2 . . . . . 10 LYS HG3 . 15916 1 128 . 1 1 31 31 LYS C C 13 177.15 0.4000 . 1 . . . . . 10 LYS C . 15916 1 129 . 1 1 31 31 LYS CA C 13 58.36 0.4000 . 1 . . . . . 10 LYS CA . 15916 1 130 . 1 1 31 31 LYS CB C 13 32.06 0.4000 . 1 . . . . . 10 LYS CB . 15916 1 131 . 1 1 31 31 LYS CD C 13 29.09 0.4000 . 1 . . . . . 10 LYS CD . 15916 1 132 . 1 1 31 31 LYS CE C 13 42.10 0.4000 . 1 . . . . . 10 LYS CE . 15916 1 133 . 1 1 31 31 LYS CG C 13 24.85 0.4000 . 1 . . . . . 10 LYS CG . 15916 1 134 . 1 1 32 32 ALA H H 1 8.09 0.0300 . 1 . . . . . 11 ALA H . 15916 1 135 . 1 1 32 32 ALA HA H 1 4.41 0.0300 . 1 . . . . . 11 ALA HA . 15916 1 136 . 1 1 32 32 ALA HB1 H 1 1.47 0.0300 . 1 . . . . . 11 ALA HB . 15916 1 137 . 1 1 32 32 ALA HB2 H 1 1.47 0.0300 . 1 . . . . . 11 ALA HB . 15916 1 138 . 1 1 32 32 ALA HB3 H 1 1.47 0.0300 . 1 . . . . . 11 ALA HB . 15916 1 139 . 1 1 32 32 ALA C C 13 177.76 0.4000 . 1 . . . . . 11 ALA C . 15916 1 140 . 1 1 32 32 ALA CA C 13 51.92 0.4000 . 1 . . . . . 11 ALA CA . 15916 1 141 . 1 1 32 32 ALA CB C 13 18.76 0.4000 . 1 . . . . . 11 ALA CB . 15916 1 142 . 1 1 32 32 ALA N N 15 122.11 0.4000 . 1 . . . . . 11 ALA N . 15916 1 143 . 1 1 33 33 GLY H H 1 8.10 0.0300 . 1 . . . . . 12 GLY H . 15916 1 144 . 1 1 33 33 GLY HA2 H 1 4.20 0.0300 . 2 . . . . . 12 GLY HA2 . 15916 1 145 . 1 1 33 33 GLY HA3 H 1 3.47 0.0300 . 2 . . . . . 12 GLY HA3 . 15916 1 146 . 1 1 33 33 GLY C C 13 177.48 0.4000 . 1 . . . . . 12 GLY C . 15916 1 147 . 1 1 33 33 GLY CA C 13 44.95 0.4000 . 1 . . . . . 12 GLY CA . 15916 1 148 . 1 1 33 33 GLY N N 15 107.67 0.4000 . 1 . . . . . 12 GLY N . 15916 1 149 . 1 1 34 34 GLU H H 1 8.36 0.0300 . 1 . . . . . 13 GLU H . 15916 1 150 . 1 1 34 34 GLU HA H 1 4.23 0.0300 . 1 . . . . . 13 GLU HA . 15916 1 151 . 1 1 34 34 GLU HB2 H 1 1.75 0.0300 . 2 . . . . . 13 GLU HB2 . 15916 1 152 . 1 1 34 34 GLU HB3 H 1 2.16 0.0300 . 2 . . . . . 13 GLU HB3 . 15916 1 153 . 1 1 34 34 GLU C C 13 174.82 0.4000 . 1 . . . . . 13 GLU C . 15916 1 154 . 1 1 34 34 GLU CA C 13 56.43 0.4000 . 1 . . . . . 13 GLU CA . 15916 1 155 . 1 1 34 34 GLU CB C 13 29.06 0.4000 . 1 . . . . . 13 GLU CB . 15916 1 156 . 1 1 34 34 GLU N N 15 122.79 0.4000 . 1 . . . . . 13 GLU N . 15916 1 157 . 1 1 35 35 TYR H H 1 9.14 0.0300 . 1 . . . . . 14 TYR H . 15916 1 158 . 1 1 35 35 TYR HA H 1 4.78 0.0300 . 1 . . . . . 14 TYR HA . 15916 1 159 . 1 1 35 35 TYR HB2 H 1 2.78 0.0300 . 2 . . . . . 14 TYR HB2 . 15916 1 160 . 1 1 35 35 TYR HB3 H 1 2.64 0.0300 . 2 . . . . . 14 TYR HB3 . 15916 1 161 . 1 1 35 35 TYR HD1 H 1 6.90 0.0300 . 1 . . . . . 14 TYR HD1 . 15916 1 162 . 1 1 35 35 TYR HD2 H 1 6.90 0.0300 . 1 . . . . . 14 TYR HD2 . 15916 1 163 . 1 1 35 35 TYR C C 13 175.00 0.4000 . 1 . . . . . 14 TYR C . 15916 1 164 . 1 1 35 35 TYR CA C 13 58.59 0.4000 . 1 . . . . . 14 TYR CA . 15916 1 165 . 1 1 35 35 TYR CB C 13 40.17 0.4000 . 1 . . . . . 14 TYR CB . 15916 1 166 . 1 1 35 35 TYR CD1 C 13 131.90 0.4000 . 1 . . . . . 14 TYR CD1 . 15916 1 167 . 1 1 35 35 TYR N N 15 118.85 0.4000 . 1 . . . . . 14 TYR N . 15916 1 168 . 1 1 36 36 ARG H H 1 8.96 0.0300 . 1 . . . . . 15 ARG H . 15916 1 169 . 1 1 36 36 ARG HA H 1 4.75 0.0300 . 1 . . . . . 15 ARG HA . 15916 1 170 . 1 1 36 36 ARG HB2 H 1 1.42 0.0300 . 2 . . . . . 15 ARG HB2 . 15916 1 171 . 1 1 36 36 ARG HB3 H 1 1.42 0.0300 . 2 . . . . . 15 ARG HB3 . 15916 1 172 . 1 1 36 36 ARG HD2 H 1 3.14 0.0300 . 2 . . . . . 15 ARG HD2 . 15916 1 173 . 1 1 36 36 ARG HD3 H 1 2.84 0.0300 . 2 . . . . . 15 ARG HD3 . 15916 1 174 . 1 1 36 36 ARG HE H 1 8.53 0.0300 . 1 . . . . . 15 ARG HE . 15916 1 175 . 1 1 36 36 ARG C C 13 173.76 0.4000 . 1 . . . . . 15 ARG C . 15916 1 176 . 1 1 36 36 ARG CA C 13 53.58 0.4000 . 1 . . . . . 15 ARG CA . 15916 1 177 . 1 1 36 36 ARG CB C 13 35.82 0.4000 . 1 . . . . . 15 ARG CB . 15916 1 178 . 1 1 36 36 ARG CD C 13 43.69 0.4000 . 1 . . . . . 15 ARG CD . 15916 1 179 . 1 1 36 36 ARG N N 15 120.57 0.4000 . 1 . . . . . 15 ARG N . 15916 1 180 . 1 1 36 36 ARG NE N 15 118.60 0.4000 . 1 . . . . . 15 ARG NE . 15916 1 181 . 1 1 37 37 PHE H H 1 8.79 0.0300 . 1 . . . . . 16 PHE H . 15916 1 182 . 1 1 37 37 PHE HA H 1 6.47 0.0300 . 1 . . . . . 16 PHE HA . 15916 1 183 . 1 1 37 37 PHE C C 13 173.44 0.4000 . 1 . . . . . 16 PHE C . 15916 1 184 . 1 1 37 37 PHE CA C 13 54.90 0.4000 . 1 . . . . . 16 PHE CA . 15916 1 185 . 1 1 37 37 PHE N N 15 111.48 0.4000 . 1 . . . . . 16 PHE N . 15916 1 186 . 1 1 38 38 ARG H H 1 9.32 0.0300 . 1 . . . . . 17 ARG H . 15916 1 187 . 1 1 38 38 ARG HA H 1 5.45 0.0300 . 1 . . . . . 17 ARG HA . 15916 1 188 . 1 1 38 38 ARG C C 13 173.49 0.4000 . 1 . . . . . 17 ARG C . 15916 1 189 . 1 1 38 38 ARG CA C 13 53.07 0.4000 . 1 . . . . . 17 ARG CA . 15916 1 190 . 1 1 38 38 ARG N N 15 114.98 0.4000 . 1 . . . . . 17 ARG N . 15916 1 191 . 1 1 39 39 PHE H H 1 7.74 0.0300 . 1 . . . . . 18 PHE H . 15916 1 192 . 1 1 39 39 PHE HA H 1 5.19 0.0300 . 1 . . . . . 18 PHE HA . 15916 1 193 . 1 1 39 39 PHE HB2 H 1 1.86 0.0300 . 2 . . . . . 18 PHE HB2 . 15916 1 194 . 1 1 39 39 PHE HB3 H 1 1.65 0.0300 . 2 . . . . . 18 PHE HB3 . 15916 1 195 . 1 1 39 39 PHE HD1 H 1 6.00 0.0300 . 1 . . . . . 18 PHE HD1 . 15916 1 196 . 1 1 39 39 PHE HD2 H 1 6.00 0.0300 . 1 . . . . . 18 PHE HD2 . 15916 1 197 . 1 1 39 39 PHE HE1 H 1 6.63 0.0300 . 1 . . . . . 18 PHE HE1 . 15916 1 198 . 1 1 39 39 PHE HE2 H 1 6.63 0.0300 . 1 . . . . . 18 PHE HE2 . 15916 1 199 . 1 1 39 39 PHE HZ H 1 6.33 0.0300 . 1 . . . . . 18 PHE HZ . 15916 1 200 . 1 1 39 39 PHE C C 13 173.61 0.4000 . 1 . . . . . 18 PHE C . 15916 1 201 . 1 1 39 39 PHE CA C 13 55.37 0.4000 . 1 . . . . . 18 PHE CA . 15916 1 202 . 1 1 39 39 PHE CB C 13 43.00 0.4000 . 1 . . . . . 18 PHE CB . 15916 1 203 . 1 1 39 39 PHE CD1 C 13 131.80 0.4000 . 1 . . . . . 18 PHE CD1 . 15916 1 204 . 1 1 39 39 PHE CE1 C 13 130.20 0.4000 . 1 . . . . . 18 PHE CE1 . 15916 1 205 . 1 1 39 39 PHE CZ C 13 128.20 0.4000 . 1 . . . . . 18 PHE CZ . 15916 1 206 . 1 1 39 39 PHE N N 15 122.61 0.4000 . 1 . . . . . 18 PHE N . 15916 1 207 . 1 1 40 40 LYS H H 1 8.96 0.0300 . 1 . . . . . 19 LYS H . 15916 1 208 . 1 1 40 40 LYS HA H 1 4.84 0.0300 . 1 . . . . . 19 LYS HA . 15916 1 209 . 1 1 40 40 LYS HB2 H 1 1.34 0.0300 . 2 . . . . . 19 LYS HB2 . 15916 1 210 . 1 1 40 40 LYS HB3 H 1 1.34 0.0300 . 2 . . . . . 19 LYS HB3 . 15916 1 211 . 1 1 40 40 LYS HD2 H 1 1.38 0.0300 . 2 . . . . . 19 LYS HD2 . 15916 1 212 . 1 1 40 40 LYS HD3 H 1 1.32 0.0300 . 2 . . . . . 19 LYS HD3 . 15916 1 213 . 1 1 40 40 LYS HE2 H 1 2.61 0.0300 . 2 . . . . . 19 LYS HE2 . 15916 1 214 . 1 1 40 40 LYS HE3 H 1 2.76 0.0300 . 2 . . . . . 19 LYS HE3 . 15916 1 215 . 1 1 40 40 LYS HG2 H 1 1.15 0.0300 . 2 . . . . . 19 LYS HG2 . 15916 1 216 . 1 1 40 40 LYS HG3 H 1 1.03 0.0300 . 2 . . . . . 19 LYS HG3 . 15916 1 217 . 1 1 40 40 LYS C C 13 174.26 0.4000 . 1 . . . . . 19 LYS C . 15916 1 218 . 1 1 40 40 LYS CA C 13 53.91 0.4000 . 1 . . . . . 19 LYS CA . 15916 1 219 . 1 1 40 40 LYS CB C 13 35.83 0.4000 . 1 . . . . . 19 LYS CB . 15916 1 220 . 1 1 40 40 LYS CD C 13 29.29 0.4000 . 1 . . . . . 19 LYS CD . 15916 1 221 . 1 1 40 40 LYS CE C 13 41.41 0.4000 . 1 . . . . . 19 LYS CE . 15916 1 222 . 1 1 40 40 LYS CG C 13 24.38 0.4000 . 1 . . . . . 19 LYS CG . 15916 1 223 . 1 1 40 40 LYS N N 15 127.37 0.4000 . 1 . . . . . 19 LYS N . 15916 1 224 . 1 1 41 41 ALA H H 1 8.16 0.0300 . 1 . . . . . 20 ALA H . 15916 1 225 . 1 1 41 41 ALA HA H 1 3.84 0.0300 . 1 . . . . . 20 ALA HA . 15916 1 226 . 1 1 41 41 ALA HB1 H 1 1.33 0.0300 . 1 . . . . . 20 ALA HB . 15916 1 227 . 1 1 41 41 ALA HB2 H 1 1.33 0.0300 . 1 . . . . . 20 ALA HB . 15916 1 228 . 1 1 41 41 ALA HB3 H 1 1.33 0.0300 . 1 . . . . . 20 ALA HB . 15916 1 229 . 1 1 41 41 ALA C C 13 179.10 0.4000 . 1 . . . . . 20 ALA C . 15916 1 230 . 1 1 41 41 ALA CA C 13 50.17 0.4000 . 1 . . . . . 20 ALA CA . 15916 1 231 . 1 1 41 41 ALA CB C 13 20.07 0.4000 . 1 . . . . . 20 ALA CB . 15916 1 232 . 1 1 41 41 ALA N N 15 121.96 0.4000 . 1 . . . . . 20 ALA N . 15916 1 233 . 1 1 42 42 SER H H 1 6.63 0.0300 . 1 . . . . . 21 SER H . 15916 1 234 . 1 1 42 42 SER HA H 1 3.68 0.0300 . 1 . . . . . 21 SER HA . 15916 1 235 . 1 1 42 42 SER HB2 H 1 3.41 0.0300 . 2 . . . . . 21 SER HB2 . 15916 1 236 . 1 1 42 42 SER HB3 H 1 3.41 0.0300 . 2 . . . . . 21 SER HB3 . 15916 1 237 . 1 1 42 42 SER CA C 13 60.44 0.4000 . 1 . . . . . 21 SER CA . 15916 1 238 . 1 1 42 42 SER CB C 13 62.46 0.4000 . 1 . . . . . 21 SER CB . 15916 1 239 . 1 1 42 42 SER N N 15 114.98 0.4000 . 1 . . . . . 21 SER N . 15916 1 240 . 1 1 43 43 ASN HA H 1 4.52 0.0300 . 1 . . . . . 22 ASN HA . 15916 1 241 . 1 1 43 43 ASN HB2 H 1 2.68 0.0300 . 2 . . . . . 22 ASN HB2 . 15916 1 242 . 1 1 43 43 ASN HB3 H 1 3.09 0.0300 . 2 . . . . . 22 ASN HB3 . 15916 1 243 . 1 1 43 43 ASN HD21 H 1 6.84 0.0300 . 2 . . . . . 22 ASN HD21 . 15916 1 244 . 1 1 43 43 ASN HD22 H 1 7.37 0.0300 . 2 . . . . . 22 ASN HD22 . 15916 1 245 . 1 1 43 43 ASN C C 13 176.14 0.4000 . 1 . . . . . 22 ASN C . 15916 1 246 . 1 1 43 43 ASN CA C 13 52.54 0.4000 . 1 . . . . . 22 ASN CA . 15916 1 247 . 1 1 43 43 ASN CB C 13 37.55 0.4000 . 1 . . . . . 22 ASN CB . 15916 1 248 . 1 1 43 43 ASN ND2 N 15 110.00 0.4000 . 1 . . . . . 22 ASN ND2 . 15916 1 249 . 1 1 44 44 GLY H H 1 7.94 0.0300 . 1 . . . . . 23 GLY H . 15916 1 250 . 1 1 44 44 GLY HA2 H 1 4.18 0.0300 . 2 . . . . . 23 GLY HA2 . 15916 1 251 . 1 1 44 44 GLY HA3 H 1 3.49 0.0300 . 2 . . . . . 23 GLY HA3 . 15916 1 252 . 1 1 44 44 GLY C C 13 173.91 0.4000 . 1 . . . . . 23 GLY C . 15916 1 253 . 1 1 44 44 GLY CA C 13 44.97 0.4000 . 1 . . . . . 23 GLY CA . 15916 1 254 . 1 1 44 44 GLY N N 15 107.55 0.4000 . 1 . . . . . 23 GLY N . 15916 1 255 . 1 1 45 45 GLU H H 1 7.73 0.0300 . 1 . . . . . 24 GLU H . 15916 1 256 . 1 1 45 45 GLU HA H 1 4.17 0.0300 . 1 . . . . . 24 GLU HA . 15916 1 257 . 1 1 45 45 GLU HB2 H 1 2.01 0.0300 . 2 . . . . . 24 GLU HB2 . 15916 1 258 . 1 1 45 45 GLU HB3 H 1 1.93 0.0300 . 2 . . . . . 24 GLU HB3 . 15916 1 259 . 1 1 45 45 GLU HG2 H 1 2.20 0.0300 . 2 . . . . . 24 GLU HG2 . 15916 1 260 . 1 1 45 45 GLU HG3 H 1 2.10 0.0300 . 2 . . . . . 24 GLU HG3 . 15916 1 261 . 1 1 45 45 GLU C C 13 173.91 0.4000 . 1 . . . . . 24 GLU C . 15916 1 262 . 1 1 45 45 GLU CA C 13 56.64 0.4000 . 1 . . . . . 24 GLU CA . 15916 1 263 . 1 1 45 45 GLU CB C 13 30.04 0.4000 . 1 . . . . . 24 GLU CB . 15916 1 264 . 1 1 45 45 GLU CG C 13 36.38 0.4000 . 1 . . . . . 24 GLU CG . 15916 1 265 . 1 1 45 45 GLU N N 15 120.82 0.4000 . 1 . . . . . 24 GLU N . 15916 1 266 . 1 1 46 46 THR HA H 1 4.15 0.0300 . 1 . . . . . 25 THR HA . 15916 1 267 . 1 1 46 46 THR HB H 1 4.04 0.0300 . 1 . . . . . 25 THR HB . 15916 1 268 . 1 1 46 46 THR HG21 H 1 1.06 0.0300 . 1 . . . . . 25 THR HG2 . 15916 1 269 . 1 1 46 46 THR HG22 H 1 1.06 0.0300 . 1 . . . . . 25 THR HG2 . 15916 1 270 . 1 1 46 46 THR HG23 H 1 1.06 0.0300 . 1 . . . . . 25 THR HG2 . 15916 1 271 . 1 1 46 46 THR C C 13 174.65 0.4000 . 1 . . . . . 25 THR C . 15916 1 272 . 1 1 46 46 THR CA C 13 63.82 0.4000 . 1 . . . . . 25 THR CA . 15916 1 273 . 1 1 46 46 THR CB C 13 68.99 0.4000 . 1 . . . . . 25 THR CB . 15916 1 274 . 1 1 46 46 THR CG2 C 13 23.53 0.4000 . 1 . . . . . 25 THR CG2 . 15916 1 275 . 1 1 47 47 MET H H 1 9.49 0.0300 . 1 . . . . . 26 MET H . 15916 1 276 . 1 1 47 47 MET HA H 1 4.66 0.0300 . 1 . . . . . 26 MET HA . 15916 1 277 . 1 1 47 47 MET HB2 H 1 2.41 0.0300 . 2 . . . . . 26 MET HB2 . 15916 1 278 . 1 1 47 47 MET HB3 H 1 2.25 0.0300 . 2 . . . . . 26 MET HB3 . 15916 1 279 . 1 1 47 47 MET HE1 H 1 2.34 0.0300 . 1 . . . . . 26 MET HE . 15916 1 280 . 1 1 47 47 MET HE2 H 1 2.34 0.0300 . 1 . . . . . 26 MET HE . 15916 1 281 . 1 1 47 47 MET HE3 H 1 2.34 0.0300 . 1 . . . . . 26 MET HE . 15916 1 282 . 1 1 47 47 MET HG2 H 1 2.81 0.0300 . 2 . . . . . 26 MET HG2 . 15916 1 283 . 1 1 47 47 MET HG3 H 1 2.67 0.0300 . 2 . . . . . 26 MET HG3 . 15916 1 284 . 1 1 47 47 MET C C 13 176.14 0.4000 . 1 . . . . . 26 MET C . 15916 1 285 . 1 1 47 47 MET CA C 13 57.35 0.4000 . 1 . . . . . 26 MET CA . 15916 1 286 . 1 1 47 47 MET CB C 13 35.09 0.4000 . 1 . . . . . 26 MET CB . 15916 1 287 . 1 1 47 47 MET CE C 13 17.41 0.4000 . 1 . . . . . 26 MET CE . 15916 1 288 . 1 1 47 47 MET CG C 13 32.42 0.4000 . 1 . . . . . 26 MET CG . 15916 1 289 . 1 1 47 47 MET N N 15 127.15 0.4000 . 1 . . . . . 26 MET N . 15916 1 290 . 1 1 48 48 PHE H H 1 7.27 0.0300 . 1 . . . . . 27 PHE H . 15916 1 291 . 1 1 48 48 PHE HA H 1 5.17 0.0300 . 1 . . . . . 27 PHE HA . 15916 1 292 . 1 1 48 48 PHE HB2 H 1 3.16 0.0300 . 2 . . . . . 27 PHE HB2 . 15916 1 293 . 1 1 48 48 PHE HB3 H 1 3.37 0.0300 . 2 . . . . . 27 PHE HB3 . 15916 1 294 . 1 1 48 48 PHE HD1 H 1 6.74 0.0300 . 1 . . . . . 27 PHE HD1 . 15916 1 295 . 1 1 48 48 PHE HD2 H 1 6.74 0.0300 . 1 . . . . . 27 PHE HD2 . 15916 1 296 . 1 1 48 48 PHE HE1 H 1 6.65 0.0300 . 1 . . . . . 27 PHE HE1 . 15916 1 297 . 1 1 48 48 PHE HE2 H 1 6.65 0.0300 . 1 . . . . . 27 PHE HE2 . 15916 1 298 . 1 1 48 48 PHE C C 13 172.44 0.4000 . 1 . . . . . 27 PHE C . 15916 1 299 . 1 1 48 48 PHE CA C 13 56.58 0.4000 . 1 . . . . . 27 PHE CA . 15916 1 300 . 1 1 48 48 PHE CB C 13 40.99 0.4000 . 1 . . . . . 27 PHE CB . 15916 1 301 . 1 1 48 48 PHE CD1 C 13 131.40 0.4000 . 1 . . . . . 27 PHE CD1 . 15916 1 302 . 1 1 48 48 PHE CE1 C 13 130.30 0.4000 . 1 . . . . . 27 PHE CE1 . 15916 1 303 . 1 1 48 48 PHE N N 15 110.31 0.4000 . 1 . . . . . 27 PHE N . 15916 1 304 . 1 1 49 49 SER H H 1 8.98 0.0300 . 1 . . . . . 28 SER H . 15916 1 305 . 1 1 49 49 SER HA H 1 5.33 0.0300 . 1 . . . . . 28 SER HA . 15916 1 306 . 1 1 49 49 SER HB2 H 1 3.96 0.0300 . 2 . . . . . 28 SER HB2 . 15916 1 307 . 1 1 49 49 SER HB3 H 1 4.04 0.0300 . 2 . . . . . 28 SER HB3 . 15916 1 308 . 1 1 49 49 SER C C 13 173.22 0.4000 . 1 . . . . . 28 SER C . 15916 1 309 . 1 1 49 49 SER CA C 13 57.67 0.4000 . 1 . . . . . 28 SER CA . 15916 1 310 . 1 1 49 49 SER CB C 13 65.91 0.4000 . 1 . . . . . 28 SER CB . 15916 1 311 . 1 1 49 49 SER N N 15 114.68 0.4000 . 1 . . . . . 28 SER N . 15916 1 312 . 1 1 50 50 SER H H 1 8.98 0.0300 . 1 . . . . . 29 SER H . 15916 1 313 . 1 1 50 50 SER HA H 1 4.77 0.0300 . 1 . . . . . 29 SER HA . 15916 1 314 . 1 1 50 50 SER C C 13 174.23 0.4000 . 1 . . . . . 29 SER C . 15916 1 315 . 1 1 50 50 SER CA C 13 58.70 0.4000 . 1 . . . . . 29 SER CA . 15916 1 316 . 1 1 50 50 SER N N 15 119.53 0.4000 . 1 . . . . . 29 SER N . 15916 1 317 . 1 1 51 51 GLU H H 1 8.20 0.0300 . 1 . . . . . 30 GLU H . 15916 1 318 . 1 1 51 51 GLU HA H 1 4.42 0.0300 . 1 . . . . . 30 GLU HA . 15916 1 319 . 1 1 51 51 GLU HB2 H 1 2.14 0.0300 . 2 . . . . . 30 GLU HB2 . 15916 1 320 . 1 1 51 51 GLU HB3 H 1 1.79 0.0300 . 2 . . . . . 30 GLU HB3 . 15916 1 321 . 1 1 51 51 GLU HG2 H 1 2.32 0.0300 . 2 . . . . . 30 GLU HG2 . 15916 1 322 . 1 1 51 51 GLU HG3 H 1 2.19 0.0300 . 2 . . . . . 30 GLU HG3 . 15916 1 323 . 1 1 51 51 GLU C C 13 175.71 0.4000 . 1 . . . . . 30 GLU C . 15916 1 324 . 1 1 51 51 GLU CA C 13 55.65 0.4000 . 1 . . . . . 30 GLU CA . 15916 1 325 . 1 1 51 51 GLU CB C 13 29.58 0.4000 . 1 . . . . . 30 GLU CB . 15916 1 326 . 1 1 51 51 GLU CG C 13 36.53 0.4000 . 1 . . . . . 30 GLU CG . 15916 1 327 . 1 1 51 51 GLU N N 15 117.22 0.4000 . 1 . . . . . 30 GLU N . 15916 1 328 . 1 1 52 52 GLY H H 1 8.41 0.0300 . 1 . . . . . 31 GLY H . 15916 1 329 . 1 1 52 52 GLY HA2 H 1 3.58 0.0300 . 2 . . . . . 31 GLY HA2 . 15916 1 330 . 1 1 52 52 GLY HA3 H 1 4.25 0.0300 . 2 . . . . . 31 GLY HA3 . 15916 1 331 . 1 1 52 52 GLY C C 13 174.02 0.4000 . 1 . . . . . 31 GLY C . 15916 1 332 . 1 1 52 52 GLY CA C 13 45.53 0.4000 . 1 . . . . . 31 GLY CA . 15916 1 333 . 1 1 52 52 GLY N N 15 105.54 0.4000 . 1 . . . . . 31 GLY N . 15916 1 334 . 1 1 53 53 TYR H H 1 9.67 0.0300 . 1 . . . . . 32 TYR H . 15916 1 335 . 1 1 53 53 TYR HA H 1 4.78 0.0300 . 1 . . . . . 32 TYR HA . 15916 1 336 . 1 1 53 53 TYR HB2 H 1 3.19 0.0300 . 2 . . . . . 32 TYR HB2 . 15916 1 337 . 1 1 53 53 TYR HB3 H 1 2.84 0.0300 . 2 . . . . . 32 TYR HB3 . 15916 1 338 . 1 1 53 53 TYR HD1 H 1 7.40 0.0300 . 1 . . . . . 32 TYR HD1 . 15916 1 339 . 1 1 53 53 TYR HD2 H 1 7.40 0.0300 . 1 . . . . . 32 TYR HD2 . 15916 1 340 . 1 1 53 53 TYR HE1 H 1 6.97 0.0300 . 1 . . . . . 32 TYR HE1 . 15916 1 341 . 1 1 53 53 TYR HE2 H 1 6.97 0.0300 . 1 . . . . . 32 TYR HE2 . 15916 1 342 . 1 1 53 53 TYR C C 13 173.80 0.4000 . 1 . . . . . 32 TYR C . 15916 1 343 . 1 1 53 53 TYR CA C 13 56.79 0.4000 . 1 . . . . . 32 TYR CA . 15916 1 344 . 1 1 53 53 TYR CB C 13 41.20 0.4000 . 1 . . . . . 32 TYR CB . 15916 1 345 . 1 1 53 53 TYR CD1 C 13 134.00 0.4000 . 1 . . . . . 32 TYR CD1 . 15916 1 346 . 1 1 53 53 TYR CE1 C 13 118.10 0.4000 . 1 . . . . . 32 TYR CE1 . 15916 1 347 . 1 1 53 53 TYR N N 15 121.60 0.4000 . 1 . . . . . 32 TYR N . 15916 1 348 . 1 1 54 54 LYS HA H 1 4.29 0.0300 . 1 . . . . . 33 LYS HA . 15916 1 349 . 1 1 54 54 LYS HB2 H 1 1.98 0.0300 . 2 . . . . . 33 LYS HB2 . 15916 1 350 . 1 1 54 54 LYS HB3 H 1 1.98 0.0300 . 2 . . . . . 33 LYS HB3 . 15916 1 351 . 1 1 54 54 LYS HD2 H 1 1.76 0.0300 . 2 . . . . . 33 LYS HD2 . 15916 1 352 . 1 1 54 54 LYS HD3 H 1 1.76 0.0300 . 2 . . . . . 33 LYS HD3 . 15916 1 353 . 1 1 54 54 LYS HE2 H 1 3.05 0.0300 . 2 . . . . . 33 LYS HE2 . 15916 1 354 . 1 1 54 54 LYS HE3 H 1 3.05 0.0300 . 2 . . . . . 33 LYS HE3 . 15916 1 355 . 1 1 54 54 LYS HG2 H 1 1.62 0.0300 . 2 . . . . . 33 LYS HG2 . 15916 1 356 . 1 1 54 54 LYS HG3 H 1 1.62 0.0300 . 2 . . . . . 33 LYS HG3 . 15916 1 357 . 1 1 54 54 LYS C C 13 176.78 0.4000 . 1 . . . . . 33 LYS C . 15916 1 358 . 1 1 54 54 LYS CA C 13 58.64 0.4000 . 1 . . . . . 33 LYS CA . 15916 1 359 . 1 1 54 54 LYS CB C 13 32.53 0.4000 . 1 . . . . . 33 LYS CB . 15916 1 360 . 1 1 54 54 LYS CD C 13 28.84 0.4000 . 1 . . . . . 33 LYS CD . 15916 1 361 . 1 1 54 54 LYS CE C 13 41.90 0.4000 . 1 . . . . . 33 LYS CE . 15916 1 362 . 1 1 54 54 LYS CG C 13 25.35 0.4000 . 1 . . . . . 33 LYS CG . 15916 1 363 . 1 1 55 55 ALA H H 1 8.19 0.0300 . 1 . . . . . 34 ALA H . 15916 1 364 . 1 1 55 55 ALA HA H 1 4.89 0.0300 . 1 . . . . . 34 ALA HA . 15916 1 365 . 1 1 55 55 ALA HB1 H 1 1.48 0.0300 . 1 . . . . . 34 ALA HB . 15916 1 366 . 1 1 55 55 ALA HB2 H 1 1.48 0.0300 . 1 . . . . . 34 ALA HB . 15916 1 367 . 1 1 55 55 ALA HB3 H 1 1.48 0.0300 . 1 . . . . . 34 ALA HB . 15916 1 368 . 1 1 55 55 ALA C C 13 177.00 0.4000 . 1 . . . . . 34 ALA C . 15916 1 369 . 1 1 55 55 ALA CA C 13 49.92 0.4000 . 1 . . . . . 34 ALA CA . 15916 1 370 . 1 1 55 55 ALA CB C 13 20.57 0.4000 . 1 . . . . . 34 ALA CB . 15916 1 371 . 1 1 55 55 ALA N N 15 119.18 0.4000 . 1 . . . . . 34 ALA N . 15916 1 372 . 1 1 56 56 LYS H H 1 8.39 0.0300 . 1 . . . . . 35 LYS H . 15916 1 373 . 1 1 56 56 LYS HA H 1 2.96 0.0300 . 1 . . . . . 35 LYS HA . 15916 1 374 . 1 1 56 56 LYS HB2 H 1 1.30 0.0300 . 2 . . . . . 35 LYS HB2 . 15916 1 375 . 1 1 56 56 LYS HB3 H 1 1.30 0.0300 . 2 . . . . . 35 LYS HB3 . 15916 1 376 . 1 1 56 56 LYS HD2 H 1 1.49 0.0300 . 2 . . . . . 35 LYS HD2 . 15916 1 377 . 1 1 56 56 LYS HD3 H 1 1.49 0.0300 . 2 . . . . . 35 LYS HD3 . 15916 1 378 . 1 1 56 56 LYS HG2 H 1 1.20 0.0300 . 2 . . . . . 35 LYS HG2 . 15916 1 379 . 1 1 56 56 LYS HG3 H 1 1.20 0.0300 . 2 . . . . . 35 LYS HG3 . 15916 1 380 . 1 1 56 56 LYS C C 13 178.35 0.4000 . 1 . . . . . 35 LYS C . 15916 1 381 . 1 1 56 56 LYS CA C 13 59.97 0.4000 . 1 . . . . . 35 LYS CA . 15916 1 382 . 1 1 56 56 LYS CB C 13 30.76 0.4000 . 1 . . . . . 35 LYS CB . 15916 1 383 . 1 1 56 56 LYS CD C 13 29.09 0.4000 . 1 . . . . . 35 LYS CD . 15916 1 384 . 1 1 56 56 LYS CG C 13 24.96 0.4000 . 1 . . . . . 35 LYS CG . 15916 1 385 . 1 1 56 56 LYS N N 15 127.75 0.4000 . 1 . . . . . 35 LYS N . 15916 1 386 . 1 1 57 57 ALA H H 1 8.73 0.0300 . 1 . . . . . 36 ALA H . 15916 1 387 . 1 1 57 57 ALA HA H 1 3.82 0.0300 . 1 . . . . . 36 ALA HA . 15916 1 388 . 1 1 57 57 ALA HB1 H 1 1.31 0.0300 . 1 . . . . . 36 ALA HB . 15916 1 389 . 1 1 57 57 ALA HB2 H 1 1.31 0.0300 . 1 . . . . . 36 ALA HB . 15916 1 390 . 1 1 57 57 ALA HB3 H 1 1.31 0.0300 . 1 . . . . . 36 ALA HB . 15916 1 391 . 1 1 57 57 ALA C C 13 179.89 0.4000 . 1 . . . . . 36 ALA C . 15916 1 392 . 1 1 57 57 ALA CA C 13 55.19 0.4000 . 1 . . . . . 36 ALA CA . 15916 1 393 . 1 1 57 57 ALA CB C 13 18.32 0.4000 . 1 . . . . . 36 ALA CB . 15916 1 394 . 1 1 57 57 ALA N N 15 118.01 0.4000 . 1 . . . . . 36 ALA N . 15916 1 395 . 1 1 58 58 SER H H 1 7.16 0.0300 . 1 . . . . . 37 SER H . 15916 1 396 . 1 1 58 58 SER HA H 1 4.26 0.0300 . 1 . . . . . 37 SER HA . 15916 1 397 . 1 1 58 58 SER HB2 H 1 4.17 0.0300 . 2 . . . . . 37 SER HB2 . 15916 1 398 . 1 1 58 58 SER HB3 H 1 4.17 0.0300 . 2 . . . . . 37 SER HB3 . 15916 1 399 . 1 1 58 58 SER C C 13 175.94 0.4000 . 1 . . . . . 37 SER C . 15916 1 400 . 1 1 58 58 SER CA C 13 61.33 0.4000 . 1 . . . . . 37 SER CA . 15916 1 401 . 1 1 58 58 SER CB C 13 62.95 0.4000 . 1 . . . . . 37 SER CB . 15916 1 402 . 1 1 58 58 SER N N 15 112.15 0.4000 . 1 . . . . . 37 SER N . 15916 1 403 . 1 1 59 59 ALA H H 1 6.94 0.0300 . 1 . . . . . 38 ALA H . 15916 1 404 . 1 1 59 59 ALA HA H 1 3.23 0.0300 . 1 . . . . . 38 ALA HA . 15916 1 405 . 1 1 59 59 ALA HB1 H 1 1.27 0.0300 . 1 . . . . . 38 ALA HB . 15916 1 406 . 1 1 59 59 ALA HB2 H 1 1.27 0.0300 . 1 . . . . . 38 ALA HB . 15916 1 407 . 1 1 59 59 ALA HB3 H 1 1.27 0.0300 . 1 . . . . . 38 ALA HB . 15916 1 408 . 1 1 59 59 ALA C C 13 177.89 0.4000 . 1 . . . . . 38 ALA C . 15916 1 409 . 1 1 59 59 ALA CA C 13 54.40 0.4000 . 1 . . . . . 38 ALA CA . 15916 1 410 . 1 1 59 59 ALA CB C 13 16.96 0.4000 . 1 . . . . . 38 ALA CB . 15916 1 411 . 1 1 59 59 ALA N N 15 125.53 0.4000 . 1 . . . . . 38 ALA N . 15916 1 412 . 1 1 60 60 ILE H H 1 7.63 0.0300 . 1 . . . . . 39 ILE H . 15916 1 413 . 1 1 60 60 ILE HA H 1 3.27 0.0300 . 1 . . . . . 39 ILE HA . 15916 1 414 . 1 1 60 60 ILE HB H 1 1.63 0.0300 . 1 . . . . . 39 ILE HB . 15916 1 415 . 1 1 60 60 ILE HD11 H 1 0.68 0.0300 . 1 . . . . . 39 ILE HD1 . 15916 1 416 . 1 1 60 60 ILE HD12 H 1 0.68 0.0300 . 1 . . . . . 39 ILE HD1 . 15916 1 417 . 1 1 60 60 ILE HD13 H 1 0.68 0.0300 . 1 . . . . . 39 ILE HD1 . 15916 1 418 . 1 1 60 60 ILE HG12 H 1 1.45 0.0300 . 2 . . . . . 39 ILE HG12 . 15916 1 419 . 1 1 60 60 ILE HG13 H 1 0.84 0.0300 . 2 . . . . . 39 ILE HG13 . 15916 1 420 . 1 1 60 60 ILE HG21 H 1 0.78 0.0300 . 1 . . . . . 39 ILE HG2 . 15916 1 421 . 1 1 60 60 ILE HG22 H 1 0.78 0.0300 . 1 . . . . . 39 ILE HG2 . 15916 1 422 . 1 1 60 60 ILE HG23 H 1 0.78 0.0300 . 1 . . . . . 39 ILE HG2 . 15916 1 423 . 1 1 60 60 ILE C C 13 177.57 0.4000 . 1 . . . . . 39 ILE C . 15916 1 424 . 1 1 60 60 ILE CA C 13 65.24 0.4000 . 1 . . . . . 39 ILE CA . 15916 1 425 . 1 1 60 60 ILE CB C 13 37.68 0.4000 . 1 . . . . . 39 ILE CB . 15916 1 426 . 1 1 60 60 ILE CD1 C 13 13.00 0.4000 . 1 . . . . . 39 ILE CD1 . 15916 1 427 . 1 1 60 60 ILE CG1 C 13 29.77 0.4000 . 1 . . . . . 39 ILE CG1 . 15916 1 428 . 1 1 60 60 ILE CG2 C 13 16.89 0.4000 . 1 . . . . . 39 ILE CG2 . 15916 1 429 . 1 1 60 60 ILE N N 15 117.33 0.4000 . 1 . . . . . 39 ILE N . 15916 1 430 . 1 1 61 61 HIS H H 1 7.99 0.0300 . 1 . . . . . 40 HIS H . 15916 1 431 . 1 1 61 61 HIS HA H 1 4.19 0.0300 . 1 . . . . . 40 HIS HA . 15916 1 432 . 1 1 61 61 HIS HB2 H 1 3.09 0.0300 . 2 . . . . . 40 HIS HB2 . 15916 1 433 . 1 1 61 61 HIS HB3 H 1 3.09 0.0300 . 2 . . . . . 40 HIS HB3 . 15916 1 434 . 1 1 61 61 HIS HD2 H 1 6.94 0.0300 . 1 . . . . . 40 HIS HD2 . 15916 1 435 . 1 1 61 61 HIS HE1 H 1 7.64 0.0300 . 1 . . . . . 40 HIS HE1 . 15916 1 436 . 1 1 61 61 HIS C C 13 178.28 0.4000 . 1 . . . . . 40 HIS C . 15916 1 437 . 1 1 61 61 HIS CA C 13 59.41 0.4000 . 1 . . . . . 40 HIS CA . 15916 1 438 . 1 1 61 61 HIS CB C 13 30.69 0.4000 . 1 . . . . . 40 HIS CB . 15916 1 439 . 1 1 61 61 HIS CD2 C 13 119.40 0.4000 . 1 . . . . . 40 HIS CD2 . 15916 1 440 . 1 1 61 61 HIS CE1 C 13 138.60 0.4000 . 1 . . . . . 40 HIS CE1 . 15916 1 441 . 1 1 61 61 HIS N N 15 118.79 0.4000 . 1 . . . . . 40 HIS N . 15916 1 442 . 1 1 62 62 ALA H H 1 7.49 0.0300 . 1 . . . . . 41 ALA H . 15916 1 443 . 1 1 62 62 ALA HA H 1 4.05 0.0300 . 1 . . . . . 41 ALA HA . 15916 1 444 . 1 1 62 62 ALA HB1 H 1 1.72 0.0300 . 1 . . . . . 41 ALA HB . 15916 1 445 . 1 1 62 62 ALA HB2 H 1 1.72 0.0300 . 1 . . . . . 41 ALA HB . 15916 1 446 . 1 1 62 62 ALA HB3 H 1 1.72 0.0300 . 1 . . . . . 41 ALA HB . 15916 1 447 . 1 1 62 62 ALA C C 13 179.14 0.4000 . 1 . . . . . 41 ALA C . 15916 1 448 . 1 1 62 62 ALA CA C 13 55.70 0.4000 . 1 . . . . . 41 ALA CA . 15916 1 449 . 1 1 62 62 ALA CB C 13 18.83 0.4000 . 1 . . . . . 41 ALA CB . 15916 1 450 . 1 1 62 62 ALA N N 15 122.76 0.4000 . 1 . . . . . 41 ALA N . 15916 1 451 . 1 1 63 63 ILE H H 1 7.61 0.0300 . 1 . . . . . 42 ILE H . 15916 1 452 . 1 1 63 63 ILE HA H 1 2.49 0.0300 . 1 . . . . . 42 ILE HA . 15916 1 453 . 1 1 63 63 ILE HB H 1 1.35 0.0300 . 1 . . . . . 42 ILE HB . 15916 1 454 . 1 1 63 63 ILE HD11 H 1 0.33 0.0300 . 1 . . . . . 42 ILE HD1 . 15916 1 455 . 1 1 63 63 ILE HD12 H 1 0.33 0.0300 . 1 . . . . . 42 ILE HD1 . 15916 1 456 . 1 1 63 63 ILE HD13 H 1 0.33 0.0300 . 1 . . . . . 42 ILE HD1 . 15916 1 457 . 1 1 63 63 ILE HG12 H 1 -0.69 0.0300 . 2 . . . . . 42 ILE HG12 . 15916 1 458 . 1 1 63 63 ILE HG13 H 1 0.41 0.0300 . 2 . . . . . 42 ILE HG13 . 15916 1 459 . 1 1 63 63 ILE HG21 H 1 -0.44 0.0300 . 1 . . . . . 42 ILE HG2 . 15916 1 460 . 1 1 63 63 ILE HG22 H 1 -0.44 0.0300 . 1 . . . . . 42 ILE HG2 . 15916 1 461 . 1 1 63 63 ILE HG23 H 1 -0.44 0.0300 . 1 . . . . . 42 ILE HG2 . 15916 1 462 . 1 1 63 63 ILE C C 13 177.91 0.4000 . 1 . . . . . 42 ILE C . 15916 1 463 . 1 1 63 63 ILE CA C 13 65.74 0.4000 . 1 . . . . . 42 ILE CA . 15916 1 464 . 1 1 63 63 ILE CB C 13 37.44 0.4000 . 1 . . . . . 42 ILE CB . 15916 1 465 . 1 1 63 63 ILE CD1 C 13 14.30 0.4000 . 1 . . . . . 42 ILE CD1 . 15916 1 466 . 1 1 63 63 ILE CG1 C 13 27.56 0.4000 . 1 . . . . . 42 ILE CG1 . 15916 1 467 . 1 1 63 63 ILE CG2 C 13 15.45 0.4000 . 1 . . . . . 42 ILE CG2 . 15916 1 468 . 1 1 63 63 ILE N N 15 119.12 0.4000 . 1 . . . . . 42 ILE N . 15916 1 469 . 1 1 64 64 GLU H H 1 8.16 0.0300 . 1 . . . . . 43 GLU H . 15916 1 470 . 1 1 64 64 GLU HA H 1 3.67 0.0300 . 1 . . . . . 43 GLU HA . 15916 1 471 . 1 1 64 64 GLU HB2 H 1 1.93 0.0300 . 2 . . . . . 43 GLU HB2 . 15916 1 472 . 1 1 64 64 GLU HB3 H 1 1.93 0.0300 . 2 . . . . . 43 GLU HB3 . 15916 1 473 . 1 1 64 64 GLU HG2 H 1 2.22 0.0300 . 2 . . . . . 43 GLU HG2 . 15916 1 474 . 1 1 64 64 GLU HG3 H 1 2.22 0.0300 . 2 . . . . . 43 GLU HG3 . 15916 1 475 . 1 1 64 64 GLU C C 13 179.11 0.4000 . 1 . . . . . 43 GLU C . 15916 1 476 . 1 1 64 64 GLU CA C 13 59.07 0.4000 . 1 . . . . . 43 GLU CA . 15916 1 477 . 1 1 64 64 GLU CB C 13 28.83 0.4000 . 1 . . . . . 43 GLU CB . 15916 1 478 . 1 1 64 64 GLU CG C 13 36.12 0.4000 . 1 . . . . . 43 GLU CG . 15916 1 479 . 1 1 64 64 GLU N N 15 117.63 0.4000 . 1 . . . . . 43 GLU N . 15916 1 480 . 1 1 65 65 SER H H 1 7.98 0.0300 . 1 . . . . . 44 SER H . 15916 1 481 . 1 1 65 65 SER HA H 1 4.03 0.0300 . 1 . . . . . 44 SER HA . 15916 1 482 . 1 1 65 65 SER HB2 H 1 4.04 0.0300 . 2 . . . . . 44 SER HB2 . 15916 1 483 . 1 1 65 65 SER HB3 H 1 3.95 0.0300 . 2 . . . . . 44 SER HB3 . 15916 1 484 . 1 1 65 65 SER C C 13 177.42 0.4000 . 1 . . . . . 44 SER C . 15916 1 485 . 1 1 65 65 SER CA C 13 61.62 0.4000 . 1 . . . . . 44 SER CA . 15916 1 486 . 1 1 65 65 SER CB C 13 62.80 0.4000 . 1 . . . . . 44 SER CB . 15916 1 487 . 1 1 65 65 SER N N 15 115.15 0.4000 . 1 . . . . . 44 SER N . 15916 1 488 . 1 1 66 66 ILE H H 1 8.22 0.0300 . 1 . . . . . 45 ILE H . 15916 1 489 . 1 1 66 66 ILE HA H 1 3.34 0.0300 . 1 . . . . . 45 ILE HA . 15916 1 490 . 1 1 66 66 ILE HB H 1 1.90 0.0300 . 1 . . . . . 45 ILE HB . 15916 1 491 . 1 1 66 66 ILE HD11 H 1 1.02 0.0300 . 1 . . . . . 45 ILE HD1 . 15916 1 492 . 1 1 66 66 ILE HD12 H 1 1.02 0.0300 . 1 . . . . . 45 ILE HD1 . 15916 1 493 . 1 1 66 66 ILE HD13 H 1 1.02 0.0300 . 1 . . . . . 45 ILE HD1 . 15916 1 494 . 1 1 66 66 ILE HG21 H 1 0.68 0.0300 . 1 . . . . . 45 ILE HG2 . 15916 1 495 . 1 1 66 66 ILE HG22 H 1 0.68 0.0300 . 1 . . . . . 45 ILE HG2 . 15916 1 496 . 1 1 66 66 ILE HG23 H 1 0.68 0.0300 . 1 . . . . . 45 ILE HG2 . 15916 1 497 . 1 1 66 66 ILE C C 13 178.91 0.4000 . 1 . . . . . 45 ILE C . 15916 1 498 . 1 1 66 66 ILE CA C 13 65.76 0.4000 . 1 . . . . . 45 ILE CA . 15916 1 499 . 1 1 66 66 ILE CB C 13 37.94 0.4000 . 1 . . . . . 45 ILE CB . 15916 1 500 . 1 1 66 66 ILE CD1 C 13 16.47 0.4000 . 1 . . . . . 45 ILE CD1 . 15916 1 501 . 1 1 66 66 ILE CG2 C 13 17.14 0.4000 . 1 . . . . . 45 ILE CG2 . 15916 1 502 . 1 1 66 66 ILE N N 15 123.68 0.4000 . 1 . . . . . 45 ILE N . 15916 1 503 . 1 1 67 67 LYS H H 1 8.51 0.0300 . 1 . . . . . 46 LYS H . 15916 1 504 . 1 1 67 67 LYS HA H 1 3.62 0.0300 . 1 . . . . . 46 LYS HA . 15916 1 505 . 1 1 67 67 LYS HB2 H 1 1.78 0.0300 . 2 . . . . . 46 LYS HB2 . 15916 1 506 . 1 1 67 67 LYS HB3 H 1 1.78 0.0300 . 2 . . . . . 46 LYS HB3 . 15916 1 507 . 1 1 67 67 LYS HD2 H 1 1.51 0.0300 . 2 . . . . . 46 LYS HD2 . 15916 1 508 . 1 1 67 67 LYS HD3 H 1 1.51 0.0300 . 2 . . . . . 46 LYS HD3 . 15916 1 509 . 1 1 67 67 LYS HE2 H 1 2.86 0.0300 . 2 . . . . . 46 LYS HE2 . 15916 1 510 . 1 1 67 67 LYS HE3 H 1 2.96 0.0300 . 2 . . . . . 46 LYS HE3 . 15916 1 511 . 1 1 67 67 LYS C C 13 178.92 0.4000 . 1 . . . . . 46 LYS C . 15916 1 512 . 1 1 67 67 LYS CA C 13 60.98 0.4000 . 1 . . . . . 46 LYS CA . 15916 1 513 . 1 1 67 67 LYS CB C 13 32.32 0.4000 . 1 . . . . . 46 LYS CB . 15916 1 514 . 1 1 67 67 LYS CD C 13 29.70 0.4000 . 1 . . . . . 46 LYS CD . 15916 1 515 . 1 1 67 67 LYS CE C 13 41.56 0.4000 . 1 . . . . . 46 LYS CE . 15916 1 516 . 1 1 67 67 LYS N N 15 120.39 0.4000 . 1 . . . . . 46 LYS N . 15916 1 517 . 1 1 68 68 ARG H H 1 7.88 0.0300 . 1 . . . . . 47 ARG H . 15916 1 518 . 1 1 68 68 ARG HA H 1 4.20 0.0300 . 1 . . . . . 47 ARG HA . 15916 1 519 . 1 1 68 68 ARG HB2 H 1 1.72 0.0300 . 2 . . . . . 47 ARG HB2 . 15916 1 520 . 1 1 68 68 ARG HB3 H 1 1.72 0.0300 . 2 . . . . . 47 ARG HB3 . 15916 1 521 . 1 1 68 68 ARG HD2 H 1 3.13 0.0300 . 2 . . . . . 47 ARG HD2 . 15916 1 522 . 1 1 68 68 ARG HD3 H 1 3.13 0.0300 . 2 . . . . . 47 ARG HD3 . 15916 1 523 . 1 1 68 68 ARG HG2 H 1 1.57 0.0300 . 2 . . . . . 47 ARG HG2 . 15916 1 524 . 1 1 68 68 ARG HG3 H 1 1.57 0.0300 . 2 . . . . . 47 ARG HG3 . 15916 1 525 . 1 1 68 68 ARG C C 13 178.39 0.4000 . 1 . . . . . 47 ARG C . 15916 1 526 . 1 1 68 68 ARG CA C 13 58.01 0.4000 . 1 . . . . . 47 ARG CA . 15916 1 527 . 1 1 68 68 ARG CB C 13 31.49 0.4000 . 1 . . . . . 47 ARG CB . 15916 1 528 . 1 1 68 68 ARG CD C 13 43.21 0.4000 . 1 . . . . . 47 ARG CD . 15916 1 529 . 1 1 68 68 ARG CG C 13 27.14 0.4000 . 1 . . . . . 47 ARG CG . 15916 1 530 . 1 1 68 68 ARG N N 15 114.37 0.4000 . 1 . . . . . 47 ARG N . 15916 1 531 . 1 1 69 69 ASN H H 1 7.80 0.0300 . 1 . . . . . 48 ASN H . 15916 1 532 . 1 1 69 69 ASN HA H 1 4.90 0.0300 . 1 . . . . . 48 ASN HA . 15916 1 533 . 1 1 69 69 ASN HB2 H 1 2.00 0.0300 . 2 . . . . . 48 ASN HB2 . 15916 1 534 . 1 1 69 69 ASN HB3 H 1 2.00 0.0300 . 2 . . . . . 48 ASN HB3 . 15916 1 535 . 1 1 69 69 ASN C C 13 176.55 0.4000 . 1 . . . . . 48 ASN C . 15916 1 536 . 1 1 69 69 ASN CA C 13 54.29 0.4000 . 1 . . . . . 48 ASN CA . 15916 1 537 . 1 1 69 69 ASN CB C 13 41.07 0.4000 . 1 . . . . . 48 ASN CB . 15916 1 538 . 1 1 69 69 ASN N N 15 111.80 0.4000 . 1 . . . . . 48 ASN N . 15916 1 539 . 1 1 70 70 SER H H 1 8.44 0.0300 . 1 . . . . . 49 SER H . 15916 1 540 . 1 1 70 70 SER HA H 1 3.64 0.0300 . 1 . . . . . 49 SER HA . 15916 1 541 . 1 1 70 70 SER C C 13 176.35 0.4000 . 1 . . . . . 49 SER C . 15916 1 542 . 1 1 70 70 SER CA C 13 63.32 0.4000 . 1 . . . . . 49 SER CA . 15916 1 543 . 1 1 70 70 SER N N 15 117.00 0.4000 . 1 . . . . . 49 SER N . 15916 1 544 . 1 1 71 71 ALA H H 1 8.45 0.0300 . 1 . . . . . 50 ALA H . 15916 1 545 . 1 1 71 71 ALA HA H 1 4.00 0.0300 . 1 . . . . . 50 ALA HA . 15916 1 546 . 1 1 71 71 ALA HB1 H 1 1.47 0.0300 . 1 . . . . . 50 ALA HB . 15916 1 547 . 1 1 71 71 ALA HB2 H 1 1.47 0.0300 . 1 . . . . . 50 ALA HB . 15916 1 548 . 1 1 71 71 ALA HB3 H 1 1.47 0.0300 . 1 . . . . . 50 ALA HB . 15916 1 549 . 1 1 71 71 ALA C C 13 179.39 0.4000 . 1 . . . . . 50 ALA C . 15916 1 550 . 1 1 71 71 ALA CA C 13 55.78 0.4000 . 1 . . . . . 50 ALA CA . 15916 1 551 . 1 1 71 71 ALA CB C 13 18.20 0.4000 . 1 . . . . . 50 ALA CB . 15916 1 552 . 1 1 71 71 ALA N N 15 123.47 0.4000 . 1 . . . . . 50 ALA N . 15916 1 553 . 1 1 72 72 GLY H H 1 7.90 0.0300 . 1 . . . . . 51 GLY H . 15916 1 554 . 1 1 72 72 GLY HA2 H 1 3.67 0.0300 . 2 . . . . . 51 GLY HA2 . 15916 1 555 . 1 1 72 72 GLY HA3 H 1 4.32 0.0300 . 2 . . . . . 51 GLY HA3 . 15916 1 556 . 1 1 72 72 GLY C C 13 174.25 0.4000 . 1 . . . . . 51 GLY C . 15916 1 557 . 1 1 72 72 GLY CA C 13 44.48 0.4000 . 1 . . . . . 51 GLY CA . 15916 1 558 . 1 1 72 72 GLY N N 15 103.28 0.4000 . 1 . . . . . 51 GLY N . 15916 1 559 . 1 1 73 73 ALA H H 1 7.48 0.0300 . 1 . . . . . 52 ALA H . 15916 1 560 . 1 1 73 73 ALA HA H 1 4.47 0.0300 . 1 . . . . . 52 ALA HA . 15916 1 561 . 1 1 73 73 ALA HB1 H 1 1.65 0.0300 . 1 . . . . . 52 ALA HB . 15916 1 562 . 1 1 73 73 ALA HB2 H 1 1.65 0.0300 . 1 . . . . . 52 ALA HB . 15916 1 563 . 1 1 73 73 ALA HB3 H 1 1.65 0.0300 . 1 . . . . . 52 ALA HB . 15916 1 564 . 1 1 73 73 ALA C C 13 174.94 0.4000 . 1 . . . . . 52 ALA C . 15916 1 565 . 1 1 73 73 ALA CA C 13 52.30 0.4000 . 1 . . . . . 52 ALA CA . 15916 1 566 . 1 1 73 73 ALA CB C 13 20.91 0.4000 . 1 . . . . . 52 ALA CB . 15916 1 567 . 1 1 73 73 ALA N N 15 123.92 0.4000 . 1 . . . . . 52 ALA N . 15916 1 568 . 1 1 74 74 ASP H H 1 8.36 0.0300 . 1 . . . . . 53 ASP H . 15916 1 569 . 1 1 74 74 ASP HA H 1 4.82 0.0300 . 1 . . . . . 53 ASP HA . 15916 1 570 . 1 1 74 74 ASP HB2 H 1 2.65 0.0300 . 2 . . . . . 53 ASP HB2 . 15916 1 571 . 1 1 74 74 ASP HB3 H 1 2.65 0.0300 . 2 . . . . . 53 ASP HB3 . 15916 1 572 . 1 1 74 74 ASP C C 13 175.42 0.4000 . 1 . . . . . 53 ASP C . 15916 1 573 . 1 1 74 74 ASP CA C 13 54.21 0.4000 . 1 . . . . . 53 ASP CA . 15916 1 574 . 1 1 74 74 ASP CB C 13 42.50 0.4000 . 1 . . . . . 53 ASP CB . 15916 1 575 . 1 1 74 74 ASP N N 15 122.73 0.4000 . 1 . . . . . 53 ASP N . 15916 1 576 . 1 1 75 75 THR H H 1 8.63 0.0300 . 1 . . . . . 54 THR H . 15916 1 577 . 1 1 75 75 THR HA H 1 5.18 0.0300 . 1 . . . . . 54 THR HA . 15916 1 578 . 1 1 75 75 THR HB H 1 3.95 0.0300 . 1 . . . . . 54 THR HB . 15916 1 579 . 1 1 75 75 THR HG21 H 1 1.01 0.0300 . 1 . . . . . 54 THR HG2 . 15916 1 580 . 1 1 75 75 THR HG22 H 1 1.01 0.0300 . 1 . . . . . 54 THR HG2 . 15916 1 581 . 1 1 75 75 THR HG23 H 1 1.01 0.0300 . 1 . . . . . 54 THR HG2 . 15916 1 582 . 1 1 75 75 THR C C 13 173.88 0.4000 . 1 . . . . . 54 THR C . 15916 1 583 . 1 1 75 75 THR CA C 13 62.29 0.4000 . 1 . . . . . 54 THR CA . 15916 1 584 . 1 1 75 75 THR CB C 13 69.99 0.4000 . 1 . . . . . 54 THR CB . 15916 1 585 . 1 1 75 75 THR CG2 C 13 22.35 0.4000 . 1 . . . . . 54 THR CG2 . 15916 1 586 . 1 1 75 75 THR N N 15 116.85 0.4000 . 1 . . . . . 54 THR N . 15916 1 587 . 1 1 76 76 VAL H H 1 9.44 0.0300 . 1 . . . . . 55 VAL H . 15916 1 588 . 1 1 76 76 VAL HA H 1 4.27 0.0300 . 1 . . . . . 55 VAL HA . 15916 1 589 . 1 1 76 76 VAL HB H 1 2.13 0.0300 . 1 . . . . . 55 VAL HB . 15916 1 590 . 1 1 76 76 VAL HG11 H 1 0.97 0.0300 . 2 . . . . . 55 VAL HG1 . 15916 1 591 . 1 1 76 76 VAL HG12 H 1 0.97 0.0300 . 2 . . . . . 55 VAL HG1 . 15916 1 592 . 1 1 76 76 VAL HG13 H 1 0.97 0.0300 . 2 . . . . . 55 VAL HG1 . 15916 1 593 . 1 1 76 76 VAL HG21 H 1 0.97 0.0300 . 2 . . . . . 55 VAL HG2 . 15916 1 594 . 1 1 76 76 VAL HG22 H 1 0.97 0.0300 . 2 . . . . . 55 VAL HG2 . 15916 1 595 . 1 1 76 76 VAL HG23 H 1 0.97 0.0300 . 2 . . . . . 55 VAL HG2 . 15916 1 596 . 1 1 76 76 VAL C C 13 173.70 0.4000 . 1 . . . . . 55 VAL C . 15916 1 597 . 1 1 76 76 VAL CA C 13 61.20 0.4000 . 1 . . . . . 55 VAL CA . 15916 1 598 . 1 1 76 76 VAL CB C 13 34.29 0.4000 . 1 . . . . . 55 VAL CB . 15916 1 599 . 1 1 76 76 VAL CG1 C 13 21.06 0.4000 . 1 . . . . . 55 VAL CG1 . 15916 1 600 . 1 1 76 76 VAL CG2 C 13 21.06 0.4000 . 1 . . . . . 55 VAL CG2 . 15916 1 601 . 1 1 76 76 VAL N N 15 128.75 0.4000 . 1 . . . . . 55 VAL N . 15916 1 602 . 1 1 77 77 ASP H H 1 9.01 0.0300 . 1 . . . . . 56 ASP H . 15916 1 603 . 1 1 77 77 ASP HA H 1 4.95 0.0300 . 1 . . . . . 56 ASP HA . 15916 1 604 . 1 1 77 77 ASP HB2 H 1 2.38 0.0300 . 2 . . . . . 56 ASP HB2 . 15916 1 605 . 1 1 77 77 ASP HB3 H 1 3.09 0.0300 . 2 . . . . . 56 ASP HB3 . 15916 1 606 . 1 1 77 77 ASP C C 13 176.54 0.4000 . 1 . . . . . 56 ASP C . 15916 1 607 . 1 1 77 77 ASP CA C 13 52.54 0.4000 . 1 . . . . . 56 ASP CA . 15916 1 608 . 1 1 77 77 ASP CB C 13 40.32 0.4000 . 1 . . . . . 56 ASP CB . 15916 1 609 . 1 1 77 77 ASP N N 15 126.74 0.4000 . 1 . . . . . 56 ASP N . 15916 1 610 . 1 1 78 78 LEU H H 1 9.23 0.0300 . 1 . . . . . 57 LEU H . 15916 1 611 . 1 1 78 78 LEU HA H 1 4.56 0.0300 . 1 . . . . . 57 LEU HA . 15916 1 612 . 1 1 78 78 LEU HB2 H 1 1.84 0.0300 . 2 . . . . . 57 LEU HB2 . 15916 1 613 . 1 1 78 78 LEU HB3 H 1 2.25 0.0300 . 2 . . . . . 57 LEU HB3 . 15916 1 614 . 1 1 78 78 LEU HD11 H 1 0.86 0.0300 . 2 . . . . . 57 LEU HD1 . 15916 1 615 . 1 1 78 78 LEU HD12 H 1 0.86 0.0300 . 2 . . . . . 57 LEU HD1 . 15916 1 616 . 1 1 78 78 LEU HD13 H 1 0.86 0.0300 . 2 . . . . . 57 LEU HD1 . 15916 1 617 . 1 1 78 78 LEU HD21 H 1 0.87 0.0300 . 2 . . . . . 57 LEU HD2 . 15916 1 618 . 1 1 78 78 LEU HD22 H 1 0.87 0.0300 . 2 . . . . . 57 LEU HD2 . 15916 1 619 . 1 1 78 78 LEU HD23 H 1 0.87 0.0300 . 2 . . . . . 57 LEU HD2 . 15916 1 620 . 1 1 78 78 LEU C C 13 179.23 0.4000 . 1 . . . . . 57 LEU C . 15916 1 621 . 1 1 78 78 LEU CA C 13 55.81 0.4000 . 1 . . . . . 57 LEU CA . 15916 1 622 . 1 1 78 78 LEU CB C 13 40.85 0.4000 . 1 . . . . . 57 LEU CB . 15916 1 623 . 1 1 78 78 LEU CD1 C 13 22.65 0.4000 . 1 . . . . . 57 LEU CD1 . 15916 1 624 . 1 1 78 78 LEU CD2 C 13 26.15 0.4000 . 1 . . . . . 57 LEU CD2 . 15916 1 625 . 1 1 78 78 LEU N N 15 125.86 0.4000 . 1 . . . . . 57 LEU N . 15916 1 626 . 1 1 79 79 THR H H 1 8.75 0.0300 . 1 . . . . . 58 THR H . 15916 1 627 . 1 1 79 79 THR HA H 1 4.58 0.0300 . 1 . . . . . 58 THR HA . 15916 1 628 . 1 1 79 79 THR HB H 1 4.55 0.0300 . 1 . . . . . 58 THR HB . 15916 1 629 . 1 1 79 79 THR HG21 H 1 1.45 0.0300 . 1 . . . . . 58 THR HG2 . 15916 1 630 . 1 1 79 79 THR HG22 H 1 1.45 0.0300 . 1 . . . . . 58 THR HG2 . 15916 1 631 . 1 1 79 79 THR HG23 H 1 1.45 0.0300 . 1 . . . . . 58 THR HG2 . 15916 1 632 . 1 1 79 79 THR C C 13 175.57 0.4000 . 1 . . . . . 58 THR C . 15916 1 633 . 1 1 79 79 THR CA C 13 63.33 0.4000 . 1 . . . . . 58 THR CA . 15916 1 634 . 1 1 79 79 THR CB C 13 69.50 0.4000 . 1 . . . . . 58 THR CB . 15916 1 635 . 1 1 79 79 THR CG2 C 13 22.76 0.4000 . 1 . . . . . 58 THR CG2 . 15916 1 636 . 1 1 79 79 THR N N 15 111.06 0.4000 . 1 . . . . . 58 THR N . 15916 1 637 . 1 1 80 80 THR H H 1 7.47 0.0300 . 1 . . . . . 59 THR H . 15916 1 638 . 1 1 80 80 THR HA H 1 4.46 0.0300 . 1 . . . . . 59 THR HA . 15916 1 639 . 1 1 80 80 THR HB H 1 4.34 0.0300 . 1 . . . . . 59 THR HB . 15916 1 640 . 1 1 80 80 THR HG21 H 1 1.17 0.0300 . 1 . . . . . 59 THR HG2 . 15916 1 641 . 1 1 80 80 THR HG22 H 1 1.17 0.0300 . 1 . . . . . 59 THR HG2 . 15916 1 642 . 1 1 80 80 THR HG23 H 1 1.17 0.0300 . 1 . . . . . 59 THR HG2 . 15916 1 643 . 1 1 80 80 THR C C 13 174.57 0.4000 . 1 . . . . . 59 THR C . 15916 1 644 . 1 1 80 80 THR CA C 13 61.42 0.4000 . 1 . . . . . 59 THR CA . 15916 1 645 . 1 1 80 80 THR CB C 13 69.49 0.4000 . 1 . . . . . 59 THR CB . 15916 1 646 . 1 1 80 80 THR CG2 C 13 21.51 0.4000 . 1 . . . . . 59 THR CG2 . 15916 1 647 . 1 1 80 80 THR N N 15 112.17 0.4000 . 1 . . . . . 59 THR N . 15916 1 648 . 1 1 82 82 THR HA H 1 4.38 0.0300 . 1 . . . . . 61 THR HA . 15916 1 649 . 1 1 82 82 THR HB H 1 4.27 0.0300 . 1 . . . . . 61 THR HB . 15916 1 650 . 1 1 82 82 THR HG21 H 1 1.23 0.0300 . 1 . . . . . 61 THR HG2 . 15916 1 651 . 1 1 82 82 THR HG22 H 1 1.23 0.0300 . 1 . . . . . 61 THR HG2 . 15916 1 652 . 1 1 82 82 THR HG23 H 1 1.23 0.0300 . 1 . . . . . 61 THR HG2 . 15916 1 653 . 1 1 82 82 THR C C 13 173.36 0.4000 . 1 . . . . . 61 THR C . 15916 1 654 . 1 1 82 82 THR CA C 13 61.61 0.4000 . 1 . . . . . 61 THR CA . 15916 1 655 . 1 1 82 82 THR CB C 13 70.06 0.4000 . 1 . . . . . 61 THR CB . 15916 1 656 . 1 1 82 82 THR CG2 C 13 21.54 0.4000 . 1 . . . . . 61 THR CG2 . 15916 1 657 . 1 1 83 83 ALA H H 1 8.04 0.0300 . 1 . . . . . 62 ALA H . 15916 1 658 . 1 1 83 83 ALA HA H 1 4.16 0.0300 . 1 . . . . . 62 ALA HA . 15916 1 659 . 1 1 83 83 ALA HB1 H 1 1.35 0.0300 . 1 . . . . . 62 ALA HB . 15916 1 660 . 1 1 83 83 ALA HB2 H 1 1.35 0.0300 . 1 . . . . . 62 ALA HB . 15916 1 661 . 1 1 83 83 ALA HB3 H 1 1.35 0.0300 . 1 . . . . . 62 ALA HB . 15916 1 662 . 1 1 83 83 ALA CA C 13 53.89 0.4000 . 1 . . . . . 62 ALA CA . 15916 1 663 . 1 1 83 83 ALA CB C 13 20.19 0.4000 . 1 . . . . . 62 ALA CB . 15916 1 664 . 1 1 83 83 ALA N N 15 132.21 0.4000 . 1 . . . . . 62 ALA N . 15916 1 stop_ save_