################################### # 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 15100 _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 1H-15N NOESY' . . . 15100 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 4 $SPARKY . . 15100 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 31 31 MET H H 1 8.21 0.02 . 1 . . . . 1 MET H . 15100 1 2 . 1 1 31 31 MET HA H 1 4.43 0.02 . 1 . . . . 1 MET HA . 15100 1 3 . 1 1 31 31 MET HB2 H 1 1.99 0.02 . 2 . . . . 1 MET HB2 . 15100 1 4 . 1 1 31 31 MET HB3 H 1 2.08 0.02 . 2 . . . . 1 MET HB3 . 15100 1 5 . 1 1 31 31 MET HG2 H 1 2.46 0.02 . 1 . . . . 1 MET HG2 . 15100 1 6 . 1 1 31 31 MET HG3 H 1 2.46 0.02 . 1 . . . . 1 MET HG3 . 15100 1 7 . 1 1 31 31 MET C C 13 175.4 0.2 . 1 . . . . 1 MET C . 15100 1 8 . 1 1 31 31 MET CA C 13 55.3 0.2 . 1 . . . . 1 MET CA . 15100 1 9 . 1 1 31 31 MET CB C 13 32.8 0.2 . 1 . . . . 1 MET CB . 15100 1 10 . 1 1 31 31 MET CG C 13 31.9 0.2 . 1 . . . . 1 MET CG . 15100 1 11 . 1 1 31 31 MET N N 15 120.8 0.2 . 1 . . . . 1 MET N . 15100 1 12 . 1 1 32 32 GLU H H 1 8.37 0.02 . 1 . . . . 2 GLU H . 15100 1 13 . 1 1 32 32 GLU HA H 1 4.28 0.02 . 1 . . . . 2 GLU HA . 15100 1 14 . 1 1 32 32 GLU HB2 H 1 1.9 0.02 . 1 . . . . 2 GLU HB2 . 15100 1 15 . 1 1 32 32 GLU HB3 H 1 1.9 0.02 . 1 . . . . 2 GLU HB3 . 15100 1 16 . 1 1 32 32 GLU HG2 H 1 2.16 0.02 . 2 . . . . 2 GLU HG2 . 15100 1 17 . 1 1 32 32 GLU HG3 H 1 2.25 0.02 . 2 . . . . 2 GLU HG3 . 15100 1 18 . 1 1 32 32 GLU C C 13 175.1 0.2 . 1 . . . . 2 GLU C . 15100 1 19 . 1 1 32 32 GLU CA C 13 56.1 0.2 . 1 . . . . 2 GLU CA . 15100 1 20 . 1 1 32 32 GLU CB C 13 30.7 0.2 . 1 . . . . 2 GLU CB . 15100 1 21 . 1 1 32 32 GLU CG C 13 36.5 0.2 . 1 . . . . 2 GLU CG . 15100 1 22 . 1 1 32 32 GLU N N 15 122.2 0.2 . 1 . . . . 2 GLU N . 15100 1 23 . 1 1 33 33 LEU H H 1 8.53 0.02 . 1 . . . . 3 LEU H . 15100 1 24 . 1 1 33 33 LEU HA H 1 4.6 0.02 . 1 . . . . 3 LEU HA . 15100 1 25 . 1 1 33 33 LEU HB2 H 1 1.3 0.02 . 2 . . . . 3 LEU HB2 . 15100 1 26 . 1 1 33 33 LEU HB3 H 1 1.57 0.02 . 2 . . . . 3 LEU HB3 . 15100 1 27 . 1 1 33 33 LEU HG H 1 1.63 0.02 . 1 . . . . 3 LEU HG . 15100 1 28 . 1 1 33 33 LEU HD11 H 1 0.75 0.02 . 1 . . . . 3 LEU HD1 . 15100 1 29 . 1 1 33 33 LEU HD12 H 1 0.75 0.02 . 1 . . . . 3 LEU HD1 . 15100 1 30 . 1 1 33 33 LEU HD13 H 1 0.75 0.02 . 1 . . . . 3 LEU HD1 . 15100 1 31 . 1 1 33 33 LEU HD21 H 1 0.87 0.02 . 1 . . . . 3 LEU HD2 . 15100 1 32 . 1 1 33 33 LEU HD22 H 1 0.87 0.02 . 1 . . . . 3 LEU HD2 . 15100 1 33 . 1 1 33 33 LEU HD23 H 1 0.87 0.02 . 1 . . . . 3 LEU HD2 . 15100 1 34 . 1 1 33 33 LEU C C 13 175.7 0.2 . 1 . . . . 3 LEU C . 15100 1 35 . 1 1 33 33 LEU CA C 13 53.7 0.2 . 1 . . . . 3 LEU CA . 15100 1 36 . 1 1 33 33 LEU CB C 13 44.8 0.2 . 1 . . . . 3 LEU CB . 15100 1 37 . 1 1 33 33 LEU CG C 13 26.9 0.2 . 1 . . . . 3 LEU CG . 15100 1 38 . 1 1 33 33 LEU CD1 C 13 25.9 0.02 . 1 . . . . 3 LEU CD1 . 15100 1 39 . 1 1 33 33 LEU CD2 C 13 23.4 0.02 . 1 . . . . 3 LEU CD2 . 15100 1 40 . 1 1 33 33 LEU N N 15 123.5 0.2 . 1 . . . . 3 LEU N . 15100 1 41 . 1 1 34 34 HIS H H 1 8.42 0.02 . 1 . . . . 4 HIS H . 15100 1 42 . 1 1 34 34 HIS HA H 1 4.82 0.02 . 1 . . . . 4 HIS HA . 15100 1 43 . 1 1 34 34 HIS HB2 H 1 2.65 0.02 . 2 . . . . 4 HIS HB2 . 15100 1 44 . 1 1 34 34 HIS HB3 H 1 2.79 0.02 . 2 . . . . 4 HIS HB3 . 15100 1 45 . 1 1 34 34 HIS HD2 H 1 6.87 0.02 . 1 . . . . 4 HIS HD2 . 15100 1 46 . 1 1 34 34 HIS C C 13 173.5 0.2 . 1 . . . . 4 HIS C . 15100 1 47 . 1 1 34 34 HIS CA C 13 55.3 0.2 . 1 . . . . 4 HIS CA . 15100 1 48 . 1 1 34 34 HIS CB C 13 32.3 0.2 . 1 . . . . 4 HIS CB . 15100 1 49 . 1 1 34 34 HIS CD2 C 13 120.8 0.2 . 1 . . . . 4 HIS CD2 . 15100 1 50 . 1 1 34 34 HIS N N 15 119.6 0.2 . 1 . . . . 4 HIS N . 15100 1 51 . 1 1 35 35 CYS H H 1 9.32 0.02 . 1 . . . . 5 CYS H . 15100 1 52 . 1 1 35 35 CYS HA H 1 4.31 0.02 . 1 . . . . 5 CYS HA . 15100 1 53 . 1 1 35 35 CYS HB2 H 1 3.11 0.02 . 2 . . . . 5 CYS HB2 . 15100 1 54 . 1 1 35 35 CYS HB3 H 1 3.21 0.02 . 2 . . . . 5 CYS HB3 . 15100 1 55 . 1 1 35 35 CYS CA C 13 57.3 0.2 . 1 . . . . 5 CYS CA . 15100 1 56 . 1 1 35 35 CYS CB C 13 31.9 0.2 . 1 . . . . 5 CYS CB . 15100 1 57 . 1 1 35 35 CYS N N 15 125.6 0.2 . 1 . . . . 5 CYS N . 15100 1 58 . 1 1 36 36 PRO HA H 1 4.46 0.02 . 1 . . . . 6 PRO HA . 15100 1 59 . 1 1 36 36 PRO HB2 H 1 2.08 0.02 . 2 . . . . 6 PRO HB2 . 15100 1 60 . 1 1 36 36 PRO HB3 H 1 2.4 0.02 . 2 . . . . 6 PRO HB3 . 15100 1 61 . 1 1 36 36 PRO HG2 H 1 2.14 0.02 . 1 . . . . 6 PRO HG2 . 15100 1 62 . 1 1 36 36 PRO HG3 H 1 2.14 0.02 . 1 . . . . 6 PRO HG3 . 15100 1 63 . 1 1 36 36 PRO HD2 H 1 3.94 0.02 . 2 . . . . 6 PRO HD2 . 15100 1 64 . 1 1 36 36 PRO HD3 H 1 4.13 0.02 . 2 . . . . 6 PRO HD3 . 15100 1 65 . 1 1 36 36 PRO C C 13 177 0.2 . 1 . . . . 6 PRO C . 15100 1 66 . 1 1 36 36 PRO CA C 13 64.2 0.2 . 1 . . . . 6 PRO CA . 15100 1 67 . 1 1 36 36 PRO CB C 13 32.3 0.2 . 1 . . . . 6 PRO CB . 15100 1 68 . 1 1 36 36 PRO CG C 13 27.4 0.2 . 1 . . . . 6 PRO CG . 15100 1 69 . 1 1 36 36 PRO CD C 13 51.5 0.2 . 1 . . . . 6 PRO CD . 15100 1 70 . 1 1 37 37 GLN H H 1 9.28 0.02 . 1 . . . . 7 GLN H . 15100 1 71 . 1 1 37 37 GLN HA H 1 4.51 0.02 . 1 . . . . 7 GLN HA . 15100 1 72 . 1 1 37 37 GLN HB2 H 1 2.18 0.02 . 2 . . . . 7 GLN HB2 . 15100 1 73 . 1 1 37 37 GLN HB3 H 1 2.28 0.02 . 2 . . . . 7 GLN HB3 . 15100 1 74 . 1 1 37 37 GLN HG2 H 1 2.33 0.02 . 2 . . . . 7 GLN HG2 . 15100 1 75 . 1 1 37 37 GLN HG3 H 1 2.38 0.02 . 2 . . . . 7 GLN HG3 . 15100 1 76 . 1 1 37 37 GLN HE21 H 1 7.74 0.02 . 2 . . . . 7 GLN HE21 . 15100 1 77 . 1 1 37 37 GLN HE22 H 1 6.84 0.02 . 2 . . . . 7 GLN HE22 . 15100 1 78 . 1 1 37 37 GLN C C 13 177.6 0.2 . 1 . . . . 7 GLN C . 15100 1 79 . 1 1 37 37 GLN CA C 13 57.4 0.2 . 1 . . . . 7 GLN CA . 15100 1 80 . 1 1 37 37 GLN CB C 13 29.9 0.2 . 1 . . . . 7 GLN CB . 15100 1 81 . 1 1 37 37 GLN CG C 13 33.6 0.2 . 1 . . . . 7 GLN CG . 15100 1 82 . 1 1 37 37 GLN CD C 13 179.8 0.2 . 1 . . . . 7 GLN CD . 15100 1 83 . 1 1 37 37 GLN N N 15 119.8 0.2 . 1 . . . . 7 GLN N . 15100 1 84 . 1 1 37 37 GLN NE2 N 15 112.6 0.2 . 1 . . . . 7 GLN NE2 . 15100 1 85 . 1 1 38 38 CYS H H 1 8.77 0.02 . 1 . . . . 8 CYS H . 15100 1 86 . 1 1 38 38 CYS HA H 1 5.04 0.02 . 1 . . . . 8 CYS HA . 15100 1 87 . 1 1 38 38 CYS HB2 H 1 2.55 0.02 . 2 . . . . 8 CYS HB2 . 15100 1 88 . 1 1 38 38 CYS HB3 H 1 3.25 0.02 . 2 . . . . 8 CYS HB3 . 15100 1 89 . 1 1 38 38 CYS C C 13 176.4 0.2 . 1 . . . . 8 CYS C . 15100 1 90 . 1 1 38 38 CYS CA C 13 59.2 0.2 . 1 . . . . 8 CYS CA . 15100 1 91 . 1 1 38 38 CYS CB C 13 32.8 0.2 . 1 . . . . 8 CYS CB . 15100 1 92 . 1 1 38 38 CYS N N 15 119.8 0.2 . 1 . . . . 8 CYS N . 15100 1 93 . 1 1 39 39 GLN H H 1 8.21 0.02 . 1 . . . . 9 GLN H . 15100 1 94 . 1 1 39 39 GLN HA H 1 4.17 0.02 . 1 . . . . 9 GLN HA . 15100 1 95 . 1 1 39 39 GLN HB2 H 1 2.34 0.02 . 2 . . . . 9 GLN HB2 . 15100 1 96 . 1 1 39 39 GLN HB3 H 1 2.47 0.02 . 2 . . . . 9 GLN HB3 . 15100 1 97 . 1 1 39 39 GLN HG2 H 1 2.26 0.02 . 1 . . . . 9 GLN HG2 . 15100 1 98 . 1 1 39 39 GLN HG3 H 1 2.26 0.02 . 1 . . . . 9 GLN HG3 . 15100 1 99 . 1 1 39 39 GLN HE21 H 1 7.24 0.02 . 2 . . . . 9 GLN HE21 . 15100 1 100 . 1 1 39 39 GLN HE22 H 1 6.48 0.02 . 2 . . . . 9 GLN HE22 . 15100 1 101 . 1 1 39 39 GLN C C 13 174.7 0.2 . 1 . . . . 9 GLN C . 15100 1 102 . 1 1 39 39 GLN CA C 13 59.1 0.2 . 1 . . . . 9 GLN CA . 15100 1 103 . 1 1 39 39 GLN CB C 13 26.1 0.2 . 1 . . . . 9 GLN CB . 15100 1 104 . 1 1 39 39 GLN CG C 13 34.5 0.2 . 1 . . . . 9 GLN CG . 15100 1 105 . 1 1 39 39 GLN CD C 13 180.4 0.2 . 1 . . . . 9 GLN CD . 15100 1 106 . 1 1 39 39 GLN N N 15 116.2 0.2 . 1 . . . . 9 GLN N . 15100 1 107 . 1 1 39 39 GLN NE2 N 15 112.4 0.2 . 1 . . . . 9 GLN NE2 . 15100 1 108 . 1 1 40 40 HIS H H 1 8.67 0.02 . 1 . . . . 10 HIS H . 15100 1 109 . 1 1 40 40 HIS HA H 1 4.54 0.02 . 1 . . . . 10 HIS HA . 15100 1 110 . 1 1 40 40 HIS HB2 H 1 3.39 0.02 . 1 . . . . 10 HIS HB2 . 15100 1 111 . 1 1 40 40 HIS HB3 H 1 3.39 0.02 . 1 . . . . 10 HIS HB3 . 15100 1 112 . 1 1 40 40 HIS HD2 H 1 7.26 0.02 . 1 . . . . 10 HIS HD2 . 15100 1 113 . 1 1 40 40 HIS C C 13 175.2 0.2 . 1 . . . . 10 HIS C . 15100 1 114 . 1 1 40 40 HIS CA C 13 58 0.2 . 1 . . . . 10 HIS CA . 15100 1 115 . 1 1 40 40 HIS CB C 13 31.2 0.2 . 1 . . . . 10 HIS CB . 15100 1 116 . 1 1 40 40 HIS CD2 C 13 123.7 0.2 . 1 . . . . 10 HIS CD2 . 15100 1 117 . 1 1 40 40 HIS N N 15 123.2 0.2 . 1 . . . . 10 HIS N . 15100 1 118 . 1 1 41 41 VAL H H 1 8.18 0.02 . 1 . . . . 11 VAL H . 15100 1 119 . 1 1 41 41 VAL HA H 1 3.88 0.02 . 1 . . . . 11 VAL HA . 15100 1 120 . 1 1 41 41 VAL HB H 1 1.85 0.02 . 1 . . . . 11 VAL HB . 15100 1 121 . 1 1 41 41 VAL HG11 H 1 0.88 0.02 . 1 . . . . 11 VAL HG1 . 15100 1 122 . 1 1 41 41 VAL HG12 H 1 0.88 0.02 . 1 . . . . 11 VAL HG1 . 15100 1 123 . 1 1 41 41 VAL HG13 H 1 0.88 0.02 . 1 . . . . 11 VAL HG1 . 15100 1 124 . 1 1 41 41 VAL HG21 H 1 0.87 0.02 . 1 . . . . 11 VAL HG2 . 15100 1 125 . 1 1 41 41 VAL HG22 H 1 0.87 0.02 . 1 . . . . 11 VAL HG2 . 15100 1 126 . 1 1 41 41 VAL HG23 H 1 0.87 0.02 . 1 . . . . 11 VAL HG2 . 15100 1 127 . 1 1 41 41 VAL C C 13 176.3 0.2 . 1 . . . . 11 VAL C . 15100 1 128 . 1 1 41 41 VAL CA C 13 64.1 0.2 . 1 . . . . 11 VAL CA . 15100 1 129 . 1 1 41 41 VAL CB C 13 32.1 0.2 . 1 . . . . 11 VAL CB . 15100 1 130 . 1 1 41 41 VAL CG1 C 13 21.1 0.02 . 1 . . . . 11 VAL CG1 . 15100 1 131 . 1 1 41 41 VAL CG2 C 13 22.2 0.02 . 1 . . . . 11 VAL CG2 . 15100 1 132 . 1 1 41 41 VAL N N 15 123.4 0.2 . 1 . . . . 11 VAL N . 15100 1 133 . 1 1 42 42 LEU H H 1 8.34 0.02 . 1 . . . . 12 LEU H . 15100 1 134 . 1 1 42 42 LEU HA H 1 4.48 0.02 . 1 . . . . 12 LEU HA . 15100 1 135 . 1 1 42 42 LEU HB2 H 1 1.16 0.02 . 2 . . . . 12 LEU HB2 . 15100 1 136 . 1 1 42 42 LEU HB3 H 1 1.5 0.02 . 2 . . . . 12 LEU HB3 . 15100 1 137 . 1 1 42 42 LEU HG H 1 1.55 0.02 . 1 . . . . 12 LEU HG . 15100 1 138 . 1 1 42 42 LEU HD11 H 1 0.66 0.02 . 1 . . . . 12 LEU HD1 . 15100 1 139 . 1 1 42 42 LEU HD12 H 1 0.66 0.02 . 1 . . . . 12 LEU HD1 . 15100 1 140 . 1 1 42 42 LEU HD13 H 1 0.66 0.02 . 1 . . . . 12 LEU HD1 . 15100 1 141 . 1 1 42 42 LEU HD21 H 1 0.75 0.02 . 1 . . . . 12 LEU HD2 . 15100 1 142 . 1 1 42 42 LEU HD22 H 1 0.75 0.02 . 1 . . . . 12 LEU HD2 . 15100 1 143 . 1 1 42 42 LEU HD23 H 1 0.75 0.02 . 1 . . . . 12 LEU HD2 . 15100 1 144 . 1 1 42 42 LEU C C 13 176.7 0.2 . 1 . . . . 12 LEU C . 15100 1 145 . 1 1 42 42 LEU CA C 13 54.3 0.2 . 1 . . . . 12 LEU CA . 15100 1 146 . 1 1 42 42 LEU CB C 13 43.8 0.2 . 1 . . . . 12 LEU CB . 15100 1 147 . 1 1 42 42 LEU CG C 13 26.8 0.2 . 1 . . . . 12 LEU CG . 15100 1 148 . 1 1 42 42 LEU CD1 C 13 26.7 0.02 . 1 . . . . 12 LEU CD1 . 15100 1 149 . 1 1 42 42 LEU CD2 C 13 23.6 0.02 . 1 . . . . 12 LEU CD2 . 15100 1 150 . 1 1 42 42 LEU N N 15 126.6 0.2 . 1 . . . . 12 LEU N . 15100 1 151 . 1 1 43 43 ASP H H 1 8.66 0.02 . 1 . . . . 13 ASP H . 15100 1 152 . 1 1 43 43 ASP HA H 1 4.91 0.02 . 1 . . . . 13 ASP HA . 15100 1 153 . 1 1 43 43 ASP HB2 H 1 2.68 0.02 . 1 . . . . 13 ASP HB2 . 15100 1 154 . 1 1 43 43 ASP HB3 H 1 2.68 0.02 . 1 . . . . 13 ASP HB3 . 15100 1 155 . 1 1 43 43 ASP C C 13 175.7 0.2 . 1 . . . . 13 ASP C . 15100 1 156 . 1 1 43 43 ASP CA C 13 53.8 0.2 . 1 . . . . 13 ASP CA . 15100 1 157 . 1 1 43 43 ASP CB C 13 42.4 0.2 . 1 . . . . 13 ASP CB . 15100 1 158 . 1 1 43 43 ASP N N 15 121.8 0.2 . 1 . . . . 13 ASP N . 15100 1 159 . 1 1 44 44 GLN H H 1 8.74 0.02 . 1 . . . . 14 GLN H . 15100 1 160 . 1 1 44 44 GLN HA H 1 4.8 0.02 . 1 . . . . 14 GLN HA . 15100 1 161 . 1 1 44 44 GLN HB2 H 1 1.83 0.02 . 2 . . . . 14 GLN HB2 . 15100 1 162 . 1 1 44 44 GLN HB3 H 1 2.04 0.02 . 2 . . . . 14 GLN HB3 . 15100 1 163 . 1 1 44 44 GLN HG2 H 1 2.1 0.02 . 2 . . . . 14 GLN HG2 . 15100 1 164 . 1 1 44 44 GLN HG3 H 1 2.2 0.02 . 2 . . . . 14 GLN HG3 . 15100 1 165 . 1 1 44 44 GLN HE21 H 1 7.54 0.02 . 2 . . . . 14 GLN HE21 . 15100 1 166 . 1 1 44 44 GLN HE22 H 1 6.66 0.02 . 2 . . . . 14 GLN HE22 . 15100 1 167 . 1 1 44 44 GLN C C 13 175 0.2 . 1 . . . . 14 GLN C . 15100 1 168 . 1 1 44 44 GLN CA C 13 55.7 0.2 . 1 . . . . 14 GLN CA . 15100 1 169 . 1 1 44 44 GLN CB C 13 30.6 0.2 . 1 . . . . 14 GLN CB . 15100 1 170 . 1 1 44 44 GLN CG C 13 34.4 0.2 . 1 . . . . 14 GLN CG . 15100 1 171 . 1 1 44 44 GLN CD C 13 179 0.2 . 1 . . . . 14 GLN CD . 15100 1 172 . 1 1 44 44 GLN N N 15 122.6 0.2 . 1 . . . . 14 GLN N . 15100 1 173 . 1 1 44 44 GLN NE2 N 15 111.2 0.2 . 1 . . . . 14 GLN NE2 . 15100 1 174 . 1 1 45 45 ASP H H 1 8.46 0.02 . 1 . . . . 15 ASP H . 15100 1 175 . 1 1 45 45 ASP HA H 1 4.64 0.02 . 1 . . . . 15 ASP HA . 15100 1 176 . 1 1 45 45 ASP HB2 H 1 2.54 0.02 . 1 . . . . 15 ASP HB2 . 15100 1 177 . 1 1 45 45 ASP HB3 H 1 2.54 0.02 . 1 . . . . 15 ASP HB3 . 15100 1 178 . 1 1 45 45 ASP CA C 13 54 0.2 . 1 . . . . 15 ASP CA . 15100 1 179 . 1 1 45 45 ASP CB C 13 42.8 0.2 . 1 . . . . 15 ASP CB . 15100 1 180 . 1 1 45 45 ASP N N 15 122.8 0.2 . 1 . . . . 15 ASP N . 15100 1 181 . 1 1 46 46 ASN HA H 1 4.33 0.02 . 1 . . . . 16 ASN HA . 15100 1 182 . 1 1 46 46 ASN HB2 H 1 2.7 0.02 . 2 . . . . 16 ASN HB2 . 15100 1 183 . 1 1 46 46 ASN HB3 H 1 2.95 0.02 . 2 . . . . 16 ASN HB3 . 15100 1 184 . 1 1 46 46 ASN HD21 H 1 7.7 0.02 . 2 . . . . 16 ASN HD21 . 15100 1 185 . 1 1 46 46 ASN HD22 H 1 6.91 0.02 . 2 . . . . 16 ASN HD22 . 15100 1 186 . 1 1 46 46 ASN CA C 13 54.4 0.2 . 1 . . . . 16 ASN CA . 15100 1 187 . 1 1 46 46 ASN CB C 13 38.5 0.2 . 1 . . . . 16 ASN CB . 15100 1 188 . 1 1 46 46 ASN ND2 N 15 113.7 0.2 . 1 . . . . 16 ASN ND2 . 15100 1 189 . 1 1 47 47 GLY H H 1 8.36 0.02 . 1 . . . . 17 GLY H . 15100 1 190 . 1 1 47 47 GLY HA2 H 1 2.96 0.02 . 2 . . . . 17 GLY HA2 . 15100 1 191 . 1 1 47 47 GLY HA3 H 1 3.27 0.02 . 2 . . . . 17 GLY HA3 . 15100 1 192 . 1 1 47 47 GLY C C 13 173.5 0.2 . 1 . . . . 17 GLY C . 15100 1 193 . 1 1 47 47 GLY CA C 13 45.5 0.2 . 1 . . . . 17 GLY CA . 15100 1 194 . 1 1 47 47 GLY N N 15 106.8 0.2 . 1 . . . . 17 GLY N . 15100 1 195 . 1 1 48 48 HIS H H 1 7.94 0.02 . 1 . . . . 18 HIS H . 15100 1 196 . 1 1 48 48 HIS HA H 1 5.05 0.02 . 1 . . . . 18 HIS HA . 15100 1 197 . 1 1 48 48 HIS HB2 H 1 2.97 0.02 . 2 . . . . 18 HIS HB2 . 15100 1 198 . 1 1 48 48 HIS HB3 H 1 3.14 0.02 . 2 . . . . 18 HIS HB3 . 15100 1 199 . 1 1 48 48 HIS HD2 H 1 6.79 0.02 . 1 . . . . 18 HIS HD2 . 15100 1 200 . 1 1 48 48 HIS HE1 H 1 7.80 0.02 . 1 . . . . 18 HIS HE1 . 15100 1 201 . 1 1 48 48 HIS C C 13 173.4 0.2 . 1 . . . . 18 HIS C . 15100 1 202 . 1 1 48 48 HIS CA C 13 54.7 0.2 . 1 . . . . 18 HIS CA . 15100 1 203 . 1 1 48 48 HIS CB C 13 32.4 0.2 . 1 . . . . 18 HIS CB . 15100 1 204 . 1 1 48 48 HIS CD2 C 13 120.8 0.2 . 1 . . . . 18 HIS CD2 . 15100 1 205 . 1 1 48 48 HIS N N 15 119.1 0.2 . 1 . . . . 18 HIS N . 15100 1 206 . 1 1 49 49 ALA H H 1 8.94 0.02 . 1 . . . . 19 ALA H . 15100 1 207 . 1 1 49 49 ALA HA H 1 5.18 0.02 . 1 . . . . 19 ALA HA . 15100 1 208 . 1 1 49 49 ALA HB1 H 1 1.26 0.02 . 1 . . . . 19 ALA HB . 15100 1 209 . 1 1 49 49 ALA HB2 H 1 1.26 0.02 . 1 . . . . 19 ALA HB . 15100 1 210 . 1 1 49 49 ALA HB3 H 1 1.26 0.02 . 1 . . . . 19 ALA HB . 15100 1 211 . 1 1 49 49 ALA C C 13 175.3 0.2 . 1 . . . . 19 ALA C . 15100 1 212 . 1 1 49 49 ALA CA C 13 50.6 0.2 . 1 . . . . 19 ALA CA . 15100 1 213 . 1 1 49 49 ALA CB C 13 22.2 0.2 . 1 . . . . 19 ALA CB . 15100 1 214 . 1 1 49 49 ALA N N 15 124.7 0.2 . 1 . . . . 19 ALA N . 15100 1 215 . 1 1 50 50 ARG H H 1 8.54 0.02 . 1 . . . . 20 ARG H . 15100 1 216 . 1 1 50 50 ARG HA H 1 5.18 0.02 . 1 . . . . 20 ARG HA . 15100 1 217 . 1 1 50 50 ARG HB2 H 1 1.69 0.02 . 1 . . . . 20 ARG HB2 . 15100 1 218 . 1 1 50 50 ARG HB3 H 1 1.69 0.02 . 1 . . . . 20 ARG HB3 . 15100 1 219 . 1 1 50 50 ARG HG2 H 1 1.37 0.02 . 1 . . . . 20 ARG HG2 . 15100 1 220 . 1 1 50 50 ARG HG3 H 1 1.37 0.02 . 1 . . . . 20 ARG HG3 . 15100 1 221 . 1 1 50 50 ARG HD2 H 1 2.98 0.02 . 2 . . . . 20 ARG HD2 . 15100 1 222 . 1 1 50 50 ARG HD3 H 1 3.08 0.02 . 2 . . . . 20 ARG HD3 . 15100 1 223 . 1 1 50 50 ARG C C 13 174.4 0.2 . 1 . . . . 20 ARG C . 15100 1 224 . 1 1 50 50 ARG CA C 13 54.2 0.2 . 1 . . . . 20 ARG CA . 15100 1 225 . 1 1 50 50 ARG CB C 13 34.2 0.2 . 1 . . . . 20 ARG CB . 15100 1 226 . 1 1 50 50 ARG CG C 13 27.4 0.2 . 1 . . . . 20 ARG CG . 15100 1 227 . 1 1 50 50 ARG CD C 13 43.2 0.2 . 1 . . . . 20 ARG CD . 15100 1 228 . 1 1 50 50 ARG N N 15 120 0.2 . 1 . . . . 20 ARG N . 15100 1 229 . 1 1 51 51 CYS H H 1 8.94 0.02 . 1 . . . . 21 CYS H . 15100 1 230 . 1 1 51 51 CYS HA H 1 4.66 0.02 . 1 . . . . 21 CYS HA . 15100 1 231 . 1 1 51 51 CYS HB2 H 1 2.68 0.02 . 2 . . . . 21 CYS HB2 . 15100 1 232 . 1 1 51 51 CYS HB3 H 1 3.16 0.02 . 2 . . . . 21 CYS HB3 . 15100 1 233 . 1 1 51 51 CYS C C 13 178 0.2 . 1 . . . . 21 CYS C . 15100 1 234 . 1 1 51 51 CYS CA C 13 59.1 0.2 . 1 . . . . 21 CYS CA . 15100 1 235 . 1 1 51 51 CYS CB C 13 31.7 0.2 . 1 . . . . 21 CYS CB . 15100 1 236 . 1 1 51 51 CYS N N 15 127.7 0.2 . 1 . . . . 21 CYS N . 15100 1 237 . 1 1 52 52 ARG H H 1 9.32 0.02 . 1 . . . . 22 ARG H . 15100 1 238 . 1 1 52 52 ARG HA H 1 4.13 0.02 . 1 . . . . 22 ARG HA . 15100 1 239 . 1 1 52 52 ARG HB2 H 1 1.86 0.02 . 2 . . . . 22 ARG HB2 . 15100 1 240 . 1 1 52 52 ARG HB3 H 1 1.91 0.02 . 2 . . . . 22 ARG HB3 . 15100 1 241 . 1 1 52 52 ARG HG2 H 1 1.68 0.02 . 1 . . . . 22 ARG HG2 . 15100 1 242 . 1 1 52 52 ARG HG3 H 1 1.68 0.02 . 1 . . . . 22 ARG HG3 . 15100 1 243 . 1 1 52 52 ARG HD2 H 1 3.2 0.02 . 1 . . . . 22 ARG HD2 . 15100 1 244 . 1 1 52 52 ARG HD3 H 1 3.2 0.02 . 1 . . . . 22 ARG HD3 . 15100 1 245 . 1 1 52 52 ARG C C 13 176.4 0.2 . 1 . . . . 22 ARG C . 15100 1 246 . 1 1 52 52 ARG CA C 13 57.9 0.2 . 1 . . . . 22 ARG CA . 15100 1 247 . 1 1 52 52 ARG CB C 13 30.3 0.2 . 1 . . . . 22 ARG CB . 15100 1 248 . 1 1 52 52 ARG CG C 13 27.5 0.2 . 1 . . . . 22 ARG CG . 15100 1 249 . 1 1 52 52 ARG CD C 13 43.4 0.2 . 1 . . . . 22 ARG CD . 15100 1 250 . 1 1 52 52 ARG N N 15 130.2 0.2 . 1 . . . . 22 ARG N . 15100 1 251 . 1 1 53 53 SER H H 1 8.72 0.02 . 1 . . . . 23 SER H . 15100 1 252 . 1 1 53 53 SER HA H 1 4.36 0.02 . 1 . . . . 23 SER HA . 15100 1 253 . 1 1 53 53 SER HB2 H 1 3.1 0.02 . 2 . . . . 23 SER HB2 . 15100 1 254 . 1 1 53 53 SER HB3 H 1 3.84 0.02 . 2 . . . . 23 SER HB3 . 15100 1 255 . 1 1 53 53 SER C C 13 176 0.2 . 1 . . . . 23 SER C . 15100 1 256 . 1 1 53 53 SER CA C 13 59.9 0.2 . 1 . . . . 23 SER CA . 15100 1 257 . 1 1 53 53 SER CB C 13 62.9 0.2 . 1 . . . . 23 SER CB . 15100 1 258 . 1 1 53 53 SER N N 15 116.8 0.2 . 1 . . . . 23 SER N . 15100 1 259 . 1 1 54 54 CYS H H 1 9.29 0.02 . 1 . . . . 24 CYS H . 15100 1 260 . 1 1 54 54 CYS C C 13 177.2 0.2 . 1 . . . . 24 CYS C . 15100 1 261 . 1 1 54 54 CYS N N 15 121 0.2 . 1 . . . . 24 CYS N . 15100 1 262 . 1 1 55 55 GLY H H 1 7.63 0.02 . 1 . . . . 25 GLY H . 15100 1 263 . 1 1 55 55 GLY HA2 H 1 3.81 0.02 . 2 . . . . 25 GLY HA2 . 15100 1 264 . 1 1 55 55 GLY HA3 H 1 4.22 0.02 . 2 . . . . 25 GLY HA3 . 15100 1 265 . 1 1 55 55 GLY CA C 13 46 0.2 . 1 . . . . 25 GLY CA . 15100 1 266 . 1 1 55 55 GLY N N 15 111.5 0.2 . 1 . . . . 25 GLY N . 15100 1 267 . 1 1 56 56 GLU HA H 1 4.29 0.02 . 1 . . . . 26 GLU HA . 15100 1 268 . 1 1 56 56 GLU HB2 H 1 1.97 0.02 . 2 . . . . 26 GLU HB2 . 15100 1 269 . 1 1 56 56 GLU HB3 H 1 2.03 0.02 . 2 . . . . 26 GLU HB3 . 15100 1 270 . 1 1 56 56 GLU HG2 H 1 2.28 0.02 . 1 . . . . 26 GLU HG2 . 15100 1 271 . 1 1 56 56 GLU HG3 H 1 2.28 0.02 . 1 . . . . 26 GLU HG3 . 15100 1 272 . 1 1 56 56 GLU C C 13 175 0.2 . 1 . . . . 26 GLU C . 15100 1 273 . 1 1 56 56 GLU CA C 13 57.5 0.2 . 1 . . . . 26 GLU CA . 15100 1 274 . 1 1 56 56 GLU CB C 13 30.3 0.2 . 1 . . . . 26 GLU CB . 15100 1 275 . 1 1 57 57 PHE H H 1 8.61 0.02 . 1 . . . . 27 PHE H . 15100 1 276 . 1 1 57 57 PHE HA H 1 5.21 0.02 . 1 . . . . 27 PHE HA . 15100 1 277 . 1 1 57 57 PHE HB2 H 1 3 0.02 . 2 . . . . 27 PHE HB2 . 15100 1 278 . 1 1 57 57 PHE HB3 H 1 3.06 0.02 . 2 . . . . 27 PHE HB3 . 15100 1 279 . 1 1 57 57 PHE HD1 H 1 7.18 0.02 . 1 . . . . 27 PHE HD1 . 15100 1 280 . 1 1 57 57 PHE HD2 H 1 7.18 0.02 . 1 . . . . 27 PHE HD2 . 15100 1 281 . 1 1 57 57 PHE HE1 H 1 6.97 0.02 . 1 . . . . 27 PHE HE1 . 15100 1 282 . 1 1 57 57 PHE HE2 H 1 6.97 0.02 . 1 . . . . 27 PHE HE2 . 15100 1 283 . 1 1 57 57 PHE HZ H 1 6.96 0.02 . 1 . . . . 27 PHE HZ . 15100 1 284 . 1 1 57 57 PHE C C 13 175 0.2 . 1 . . . . 27 PHE C . 15100 1 285 . 1 1 57 57 PHE CA C 13 57.1 0.2 . 1 . . . . 27 PHE CA . 15100 1 286 . 1 1 57 57 PHE CB C 13 40.8 0.2 . 1 . . . . 27 PHE CB . 15100 1 287 . 1 1 57 57 PHE CD1 C 13 131.7 0.02 . 1 . . . . 27 PHE CD1 . 15100 1 288 . 1 1 57 57 PHE CD2 C 13 131.7 0.02 . 1 . . . . 27 PHE CD2 . 15100 1 289 . 1 1 57 57 PHE CE1 C 13 129.4 0.02 . 1 . . . . 27 PHE CE1 . 15100 1 290 . 1 1 57 57 PHE CE2 C 13 129.4 0.02 . 1 . . . . 27 PHE CE2 . 15100 1 291 . 1 1 57 57 PHE CZ C 13 132.2 0.2 . 1 . . . . 27 PHE CZ . 15100 1 292 . 1 1 57 57 PHE N N 15 124.5 0.2 . 1 . . . . 27 PHE N . 15100 1 293 . 1 1 58 58 ILE H H 1 8.73 0.02 . 1 . . . . 28 ILE H . 15100 1 294 . 1 1 58 58 ILE HA H 1 4.3 0.02 . 1 . . . . 28 ILE HA . 15100 1 295 . 1 1 58 58 ILE HB H 1 1.66 0.02 . 1 . . . . 28 ILE HB . 15100 1 296 . 1 1 58 58 ILE HG12 H 1 1.2 0.02 . 2 . . . . 28 ILE HG12 . 15100 1 297 . 1 1 58 58 ILE HG13 H 1 1.39 0.02 . 2 . . . . 28 ILE HG13 . 15100 1 298 . 1 1 58 58 ILE HG21 H 1 0.84 0.02 . 1 . . . . 28 ILE HG2 . 15100 1 299 . 1 1 58 58 ILE HG22 H 1 0.84 0.02 . 1 . . . . 28 ILE HG2 . 15100 1 300 . 1 1 58 58 ILE HG23 H 1 0.84 0.02 . 1 . . . . 28 ILE HG2 . 15100 1 301 . 1 1 58 58 ILE HD11 H 1 0.85 0.02 . 1 . . . . 28 ILE HD1 . 15100 1 302 . 1 1 58 58 ILE HD12 H 1 0.85 0.02 . 1 . . . . 28 ILE HD1 . 15100 1 303 . 1 1 58 58 ILE HD13 H 1 0.85 0.02 . 1 . . . . 28 ILE HD1 . 15100 1 304 . 1 1 58 58 ILE C C 13 174.6 0.2 . 1 . . . . 28 ILE C . 15100 1 305 . 1 1 58 58 ILE CA C 13 59.7 0.2 . 1 . . . . 28 ILE CA . 15100 1 306 . 1 1 58 58 ILE CB C 13 41.7 0.2 . 1 . . . . 28 ILE CB . 15100 1 307 . 1 1 58 58 ILE CG1 C 13 27.7 0.2 . 1 . . . . 28 ILE CG1 . 15100 1 308 . 1 1 58 58 ILE CG2 C 13 18.5 0.2 . 1 . . . . 28 ILE CG2 . 15100 1 309 . 1 1 58 58 ILE CD1 C 13 14.1 0.2 . 1 . . . . 28 ILE CD1 . 15100 1 310 . 1 1 58 58 ILE N N 15 126.1 0.2 . 1 . . . . 28 ILE N . 15100 1 311 . 1 1 59 59 GLU H H 1 8.64 0.02 . 1 . . . . 29 GLU H . 15100 1 312 . 1 1 59 59 GLU HA H 1 4.29 0.02 . 1 . . . . 29 GLU HA . 15100 1 313 . 1 1 59 59 GLU HB2 H 1 1.95 0.02 . 2 . . . . 29 GLU HB2 . 15100 1 314 . 1 1 59 59 GLU HB3 H 1 2.03 0.02 . 2 . . . . 29 GLU HB3 . 15100 1 315 . 1 1 59 59 GLU HG2 H 1 2.21 0.02 . 1 . . . . 29 GLU HG2 . 15100 1 316 . 1 1 59 59 GLU HG3 H 1 2.21 0.02 . 1 . . . . 29 GLU HG3 . 15100 1 317 . 1 1 59 59 GLU C C 13 175.6 0.2 . 1 . . . . 29 GLU C . 15100 1 318 . 1 1 59 59 GLU CA C 13 56.4 0.2 . 1 . . . . 29 GLU CA . 15100 1 319 . 1 1 59 59 GLU CB C 13 30.3 0.2 . 1 . . . . 29 GLU CB . 15100 1 320 . 1 1 59 59 GLU CG C 13 36.6 0.2 . 1 . . . . 29 GLU CG . 15100 1 321 . 1 1 59 59 GLU N N 15 127.1 0.2 . 1 . . . . 29 GLU N . 15100 1 322 . 1 1 60 60 MET H H 1 8.41 0.02 . 1 . . . . 30 MET H . 15100 1 323 . 1 1 60 60 MET HA H 1 4.86 0.02 . 1 . . . . 30 MET HA . 15100 1 324 . 1 1 60 60 MET HB2 H 1 1.79 0.02 . 2 . . . . 30 MET HB2 . 15100 1 325 . 1 1 60 60 MET HB3 H 1 2.15 0.02 . 2 . . . . 30 MET HB3 . 15100 1 326 . 1 1 60 60 MET HG2 H 1 2 0.02 . 2 . . . . 30 MET HG2 . 15100 1 327 . 1 1 60 60 MET HG3 H 1 2.28 0.02 . 2 . . . . 30 MET HG3 . 15100 1 328 . 1 1 60 60 MET HE1 H 1 1.56 0.02 . 1 . . . . 30 MET HE . 15100 1 329 . 1 1 60 60 MET HE2 H 1 1.56 0.02 . 1 . . . . 30 MET HE . 15100 1 330 . 1 1 60 60 MET HE3 H 1 1.56 0.02 . 1 . . . . 30 MET HE . 15100 1 331 . 1 1 60 60 MET C C 13 175.2 0.2 . 1 . . . . 30 MET C . 15100 1 332 . 1 1 60 60 MET CA C 13 55.3 0.2 . 1 . . . . 30 MET CA . 15100 1 333 . 1 1 60 60 MET CB C 13 35.3 0.2 . 1 . . . . 30 MET CB . 15100 1 334 . 1 1 60 60 MET CG C 13 32.6 0.2 . 1 . . . . 30 MET CG . 15100 1 335 . 1 1 60 60 MET CE C 13 17.4 0.2 . 1 . . . . 30 MET CE . 15100 1 336 . 1 1 60 60 MET N N 15 123.8 0.2 . 1 . . . . 30 MET N . 15100 1 337 . 1 1 61 61 LYS H H 1 9.18 0.02 . 1 . . . . 31 LYS H . 15100 1 338 . 1 1 61 61 LYS HA H 1 4.65 0.02 . 1 . . . . 31 LYS HA . 15100 1 339 . 1 1 61 61 LYS HB2 H 1 1.66 0.02 . 1 . . . . 31 LYS HB2 . 15100 1 340 . 1 1 61 61 LYS HB3 H 1 1.66 0.02 . 1 . . . . 31 LYS HB3 . 15100 1 341 . 1 1 61 61 LYS HG2 H 1 1.3 0.02 . 2 . . . . 31 LYS HG2 . 15100 1 342 . 1 1 61 61 LYS HG3 H 1 1.44 0.02 . 2 . . . . 31 LYS HG3 . 15100 1 343 . 1 1 61 61 LYS HD2 H 1 1.68 0.02 . 1 . . . . 31 LYS HD2 . 15100 1 344 . 1 1 61 61 LYS HD3 H 1 1.68 0.02 . 1 . . . . 31 LYS HD3 . 15100 1 345 . 1 1 61 61 LYS HE2 H 1 2.95 0.02 . 1 . . . . 31 LYS HE2 . 15100 1 346 . 1 1 61 61 LYS HE3 H 1 2.95 0.02 . 1 . . . . 31 LYS HE3 . 15100 1 347 . 1 1 61 61 LYS C C 13 174.3 0.2 . 1 . . . . 31 LYS C . 15100 1 348 . 1 1 61 61 LYS CA C 13 55.2 0.2 . 1 . . . . 31 LYS CA . 15100 1 349 . 1 1 61 61 LYS CB C 13 34.4 0.2 . 1 . . . . 31 LYS CB . 15100 1 350 . 1 1 61 61 LYS CG C 13 24.5 0.2 . 1 . . . . 31 LYS CG . 15100 1 351 . 1 1 61 61 LYS CD C 13 29.4 0.2 . 1 . . . . 31 LYS CD . 15100 1 352 . 1 1 61 61 LYS CE C 13 41.7 0.2 . 1 . . . . 31 LYS CE . 15100 1 353 . 1 1 61 61 LYS N N 15 122.6 0.2 . 1 . . . . 31 LYS N . 15100 1 354 . 1 1 62 62 ALA H H 1 8.35 0.02 . 1 . . . . 32 ALA H . 15100 1 355 . 1 1 62 62 ALA HA H 1 4.21 0.02 . 1 . . . . 32 ALA HA . 15100 1 356 . 1 1 62 62 ALA HB1 H 1 1.1 0.02 . 1 . . . . 32 ALA HB . 15100 1 357 . 1 1 62 62 ALA HB2 H 1 1.1 0.02 . 1 . . . . 32 ALA HB . 15100 1 358 . 1 1 62 62 ALA HB3 H 1 1.1 0.02 . 1 . . . . 32 ALA HB . 15100 1 359 . 1 1 62 62 ALA C C 13 176 0.2 . 1 . . . . 32 ALA C . 15100 1 360 . 1 1 62 62 ALA CA C 13 50.9 0.2 . 1 . . . . 32 ALA CA . 15100 1 361 . 1 1 62 62 ALA CB C 13 21.1 0.2 . 1 . . . . 32 ALA CB . 15100 1 362 . 1 1 62 62 ALA N N 15 127.2 0.2 . 1 . . . . 32 ALA N . 15100 1 363 . 1 1 63 63 LEU H H 1 9.18 0.02 . 1 . . . . 33 LEU H . 15100 1 364 . 1 1 63 63 LEU HA H 1 4.61 0.02 . 1 . . . . 33 LEU HA . 15100 1 365 . 1 1 63 63 LEU HB2 H 1 1.88 0.02 . 2 . . . . 33 LEU HB2 . 15100 1 366 . 1 1 63 63 LEU HB3 H 1 0.83 0.02 . 2 . . . . 33 LEU HB3 . 15100 1 367 . 1 1 63 63 LEU HG H 1 1.52 0.02 . 1 . . . . 33 LEU HG . 15100 1 368 . 1 1 63 63 LEU HD11 H 1 0.76 0.02 . 1 . . . . 33 LEU HD1 . 15100 1 369 . 1 1 63 63 LEU HD12 H 1 0.76 0.02 . 1 . . . . 33 LEU HD1 . 15100 1 370 . 1 1 63 63 LEU HD13 H 1 0.76 0.02 . 1 . . . . 33 LEU HD1 . 15100 1 371 . 1 1 63 63 LEU HD21 H 1 0.57 0.02 . 1 . . . . 33 LEU HD2 . 15100 1 372 . 1 1 63 63 LEU HD22 H 1 0.57 0.02 . 1 . . . . 33 LEU HD2 . 15100 1 373 . 1 1 63 63 LEU HD23 H 1 0.57 0.02 . 1 . . . . 33 LEU HD2 . 15100 1 374 . 1 1 63 63 LEU C C 13 175 0.2 . 1 . . . . 33 LEU C . 15100 1 375 . 1 1 63 63 LEU CA C 13 52.8 0.2 . 1 . . . . 33 LEU CA . 15100 1 376 . 1 1 63 63 LEU CB C 13 44.2 0.2 . 1 . . . . 33 LEU CB . 15100 1 377 . 1 1 63 63 LEU CG C 13 26.7 0.2 . 1 . . . . 33 LEU CG . 15100 1 378 . 1 1 63 63 LEU CD1 C 13 26 0.02 . 1 . . . . 33 LEU CD1 . 15100 1 379 . 1 1 63 63 LEU CD2 C 13 21.9 0.02 . 1 . . . . 33 LEU CD2 . 15100 1 380 . 1 1 63 63 LEU N N 15 125.1 0.2 . 1 . . . . 33 LEU N . 15100 1 381 . 1 1 64 64 CYS H H 1 8.05 0.02 . 1 . . . . 34 CYS H . 15100 1 382 . 1 1 64 64 CYS HA H 1 4.37 0.02 . 1 . . . . 34 CYS HA . 15100 1 383 . 1 1 64 64 CYS HB2 H 1 2.84 0.02 . 2 . . . . 34 CYS HB2 . 15100 1 384 . 1 1 64 64 CYS HB3 H 1 3.27 0.02 . 2 . . . . 34 CYS HB3 . 15100 1 385 . 1 1 64 64 CYS CA C 13 56.5 0.2 . 1 . . . . 34 CYS CA . 15100 1 386 . 1 1 64 64 CYS CB C 13 31.5 0.2 . 1 . . . . 34 CYS CB . 15100 1 387 . 1 1 64 64 CYS N N 15 123.4 0.2 . 1 . . . . 34 CYS N . 15100 1 388 . 1 1 65 65 PRO HA H 1 4.24 0.02 . 1 . . . . 35 PRO HA . 15100 1 389 . 1 1 65 65 PRO HB2 H 1 1.88 0.02 . 2 . . . . 35 PRO HB2 . 15100 1 390 . 1 1 65 65 PRO HB3 H 1 2.35 0.02 . 2 . . . . 35 PRO HB3 . 15100 1 391 . 1 1 65 65 PRO HG2 H 1 1.79 0.02 . 1 . . . . 35 PRO HG2 . 15100 1 392 . 1 1 65 65 PRO HG3 H 1 1.79 0.02 . 1 . . . . 35 PRO HG3 . 15100 1 393 . 1 1 65 65 PRO HD2 H 1 3.4 0.02 . 2 . . . . 35 PRO HD2 . 15100 1 394 . 1 1 65 65 PRO HD3 H 1 4.32 0.02 . 2 . . . . 35 PRO HD3 . 15100 1 395 . 1 1 65 65 PRO C C 13 175.5 0.2 . 1 . . . . 35 PRO C . 15100 1 396 . 1 1 65 65 PRO CA C 13 63.8 0.2 . 1 . . . . 35 PRO CA . 15100 1 397 . 1 1 65 65 PRO CB C 13 32 0.2 . 1 . . . . 35 PRO CB . 15100 1 398 . 1 1 65 65 PRO CG C 13 26.8 0.2 . 1 . . . . 35 PRO CG . 15100 1 399 . 1 1 65 65 PRO CD C 13 51 0.2 . 1 . . . . 35 PRO CD . 15100 1 400 . 1 1 66 66 ASP H H 1 8.79 0.02 . 1 . . . . 36 ASP H . 15100 1 401 . 1 1 66 66 ASP HA H 1 4.52 0.02 . 1 . . . . 36 ASP HA . 15100 1 402 . 1 1 66 66 ASP HB2 H 1 1.09 0.02 . 2 . . . . 36 ASP HB2 . 15100 1 403 . 1 1 66 66 ASP HB3 H 1 1.59 0.02 . 2 . . . . 36 ASP HB3 . 15100 1 404 . 1 1 66 66 ASP C C 13 176.6 0.2 . 1 . . . . 36 ASP C . 15100 1 405 . 1 1 66 66 ASP CA C 13 56.3 0.2 . 1 . . . . 36 ASP CA . 15100 1 406 . 1 1 66 66 ASP CB C 13 40.8 0.2 . 1 . . . . 36 ASP CB . 15100 1 407 . 1 1 66 66 ASP N N 15 121.7 0.2 . 1 . . . . 36 ASP N . 15100 1 408 . 1 1 67 67 CYS H H 1 7.75 0.02 . 1 . . . . 37 CYS H . 15100 1 409 . 1 1 67 67 CYS HA H 1 4.9 0.02 . 1 . . . . 37 CYS HA . 15100 1 410 . 1 1 67 67 CYS HB2 H 1 2.96 0.02 . 2 . . . . 37 CYS HB2 . 15100 1 411 . 1 1 67 67 CYS HB3 H 1 3.29 0.02 . 2 . . . . 37 CYS HB3 . 15100 1 412 . 1 1 67 67 CYS C C 13 175.8 0.2 . 1 . . . . 37 CYS C . 15100 1 413 . 1 1 67 67 CYS CA C 13 58.2 0.2 . 1 . . . . 37 CYS CA . 15100 1 414 . 1 1 67 67 CYS CB C 13 32.8 0.2 . 1 . . . . 37 CYS CB . 15100 1 415 . 1 1 67 67 CYS N N 15 116 0.2 . 1 . . . . 37 CYS N . 15100 1 416 . 1 1 68 68 HIS H H 1 7.93 0.02 . 1 . . . . 38 HIS H . 15100 1 417 . 1 1 68 68 HIS HA H 1 4.49 0.02 . 1 . . . . 38 HIS HA . 15100 1 418 . 1 1 68 68 HIS HB2 H 1 3.34 0.02 . 1 . . . . 38 HIS HB2 . 15100 1 419 . 1 1 68 68 HIS HB3 H 1 3.34 0.02 . 1 . . . . 38 HIS HB3 . 15100 1 420 . 1 1 68 68 HIS HD2 H 1 6.93 0.02 . 1 . . . . 38 HIS HD2 . 15100 1 421 . 1 1 68 68 HIS C C 13 172.9 0.2 . 1 . . . . 38 HIS C . 15100 1 422 . 1 1 68 68 HIS CA C 13 57.6 0.2 . 1 . . . . 38 HIS CA . 15100 1 423 . 1 1 68 68 HIS CB C 13 26.6 0.2 . 1 . . . . 38 HIS CB . 15100 1 424 . 1 1 68 68 HIS CD2 C 13 119.6 0.2 . 1 . . . . 38 HIS CD2 . 15100 1 425 . 1 1 68 68 HIS N N 15 118.1 0.2 . 1 . . . . 38 HIS N . 15100 1 426 . 1 1 69 69 GLN H H 1 7.65 0.02 . 1 . . . . 39 GLN H . 15100 1 427 . 1 1 69 69 GLN HA H 1 4.83 0.02 . 1 . . . . 39 GLN HA . 15100 1 428 . 1 1 69 69 GLN HB2 H 1 2.07 0.02 . 2 . . . . 39 GLN HB2 . 15100 1 429 . 1 1 69 69 GLN HB3 H 1 2.11 0.02 . 2 . . . . 39 GLN HB3 . 15100 1 430 . 1 1 69 69 GLN HG2 H 1 1.84 0.02 . 2 . . . . 39 GLN HG2 . 15100 1 431 . 1 1 69 69 GLN HG3 H 1 2.25 0.02 . 2 . . . . 39 GLN HG3 . 15100 1 432 . 1 1 69 69 GLN HE21 H 1 6.7 0.02 . 2 . . . . 39 GLN HE21 . 15100 1 433 . 1 1 69 69 GLN HE22 H 1 7.17 0.02 . 2 . . . . 39 GLN HE22 . 15100 1 434 . 1 1 69 69 GLN CA C 13 53.6 0.2 . 1 . . . . 39 GLN CA . 15100 1 435 . 1 1 69 69 GLN CB C 13 28.5 0.2 . 1 . . . . 39 GLN CB . 15100 1 436 . 1 1 69 69 GLN CG C 13 33.7 0.2 . 1 . . . . 39 GLN CG . 15100 1 437 . 1 1 69 69 GLN CD C 13 180 0.2 . 1 . . . . 39 GLN CD . 15100 1 438 . 1 1 69 69 GLN N N 15 116.7 0.2 . 1 . . . . 39 GLN N . 15100 1 439 . 1 1 69 69 GLN NE2 N 15 112.9 0.2 . 1 . . . . 39 GLN NE2 . 15100 1 440 . 1 1 70 70 PRO HA H 1 4.68 0.02 . 1 . . . . 40 PRO HA . 15100 1 441 . 1 1 70 70 PRO HB2 H 1 2.07 0.02 . 2 . . . . 40 PRO HB2 . 15100 1 442 . 1 1 70 70 PRO HB3 H 1 2.33 0.02 . 2 . . . . 40 PRO HB3 . 15100 1 443 . 1 1 70 70 PRO HG2 H 1 1.88 0.02 . 2 . . . . 40 PRO HG2 . 15100 1 444 . 1 1 70 70 PRO HG3 H 1 2.31 0.02 . 2 . . . . 40 PRO HG3 . 15100 1 445 . 1 1 70 70 PRO HD2 H 1 3.81 0.02 . 2 . . . . 40 PRO HD2 . 15100 1 446 . 1 1 70 70 PRO HD3 H 1 3.91 0.02 . 2 . . . . 40 PRO HD3 . 15100 1 447 . 1 1 70 70 PRO C C 13 176.7 0.2 . 1 . . . . 40 PRO C . 15100 1 448 . 1 1 70 70 PRO CA C 13 63.9 0.2 . 1 . . . . 40 PRO CA . 15100 1 449 . 1 1 70 70 PRO CB C 13 32.2 0.2 . 1 . . . . 40 PRO CB . 15100 1 450 . 1 1 70 70 PRO CG C 13 28.1 0.2 . 1 . . . . 40 PRO CG . 15100 1 451 . 1 1 70 70 PRO CD C 13 50.9 0.2 . 1 . . . . 40 PRO CD . 15100 1 452 . 1 1 71 71 LEU H H 1 8.24 0.02 . 1 . . . . 41 LEU H . 15100 1 453 . 1 1 71 71 LEU HA H 1 4.55 0.02 . 1 . . . . 41 LEU HA . 15100 1 454 . 1 1 71 71 LEU HB2 H 1 1.47 0.02 . 2 . . . . 41 LEU HB2 . 15100 1 455 . 1 1 71 71 LEU HB3 H 1 1.54 0.02 . 2 . . . . 41 LEU HB3 . 15100 1 456 . 1 1 71 71 LEU HG H 1 1.67 0.02 . 1 . . . . 41 LEU HG . 15100 1 457 . 1 1 71 71 LEU HD11 H 1 0.58 0.02 . 1 . . . . 41 LEU HD1 . 15100 1 458 . 1 1 71 71 LEU HD12 H 1 0.58 0.02 . 1 . . . . 41 LEU HD1 . 15100 1 459 . 1 1 71 71 LEU HD13 H 1 0.58 0.02 . 1 . . . . 41 LEU HD1 . 15100 1 460 . 1 1 71 71 LEU HD21 H 1 0.89 0.02 . 1 . . . . 41 LEU HD2 . 15100 1 461 . 1 1 71 71 LEU HD22 H 1 0.89 0.02 . 1 . . . . 41 LEU HD2 . 15100 1 462 . 1 1 71 71 LEU HD23 H 1 0.89 0.02 . 1 . . . . 41 LEU HD2 . 15100 1 463 . 1 1 71 71 LEU C C 13 177.7 0.2 . 1 . . . . 41 LEU C . 15100 1 464 . 1 1 71 71 LEU CA C 13 54.6 0.2 . 1 . . . . 41 LEU CA . 15100 1 465 . 1 1 71 71 LEU CB C 13 43.5 0.2 . 1 . . . . 41 LEU CB . 15100 1 466 . 1 1 71 71 LEU CG C 13 27.8 0.2 . 1 . . . . 41 LEU CG . 15100 1 467 . 1 1 71 71 LEU CD1 C 13 28.4 0.02 . 1 . . . . 41 LEU CD1 . 15100 1 468 . 1 1 71 71 LEU CD2 C 13 25.5 0.02 . 1 . . . . 41 LEU CD2 . 15100 1 469 . 1 1 71 71 LEU N N 15 124.6 0.2 . 1 . . . . 41 LEU N . 15100 1 470 . 1 1 72 72 GLN H H 1 9.24 0.02 . 1 . . . . 42 GLN H . 15100 1 471 . 1 1 72 72 GLN HA H 1 4.54 0.02 . 1 . . . . 42 GLN HA . 15100 1 472 . 1 1 72 72 GLN HB2 H 1 2.2 0.02 . 2 . . . . 42 GLN HB2 . 15100 1 473 . 1 1 72 72 GLN HB3 H 1 2.38 0.02 . 2 . . . . 42 GLN HB3 . 15100 1 474 . 1 1 72 72 GLN HG2 H 1 2.31 0.02 . 2 . . . . 42 GLN HG2 . 15100 1 475 . 1 1 72 72 GLN HG3 H 1 2.51 0.02 . 2 . . . . 42 GLN HG3 . 15100 1 476 . 1 1 72 72 GLN HE21 H 1 7.32 0.02 . 2 . . . . 42 GLN HE21 . 15100 1 477 . 1 1 72 72 GLN HE22 H 1 6.6 0.02 . 2 . . . . 42 GLN HE22 . 15100 1 478 . 1 1 72 72 GLN C C 13 175 0.2 . 1 . . . . 42 GLN C . 15100 1 479 . 1 1 72 72 GLN CA C 13 55.6 0.2 . 1 . . . . 42 GLN CA . 15100 1 480 . 1 1 72 72 GLN CB C 13 29.7 0.2 . 1 . . . . 42 GLN CB . 15100 1 481 . 1 1 72 72 GLN CG C 13 33.9 0.2 . 1 . . . . 42 GLN CG . 15100 1 482 . 1 1 72 72 GLN CD C 13 179.3 0.2 . 1 . . . . 42 GLN CD . 15100 1 483 . 1 1 72 72 GLN N N 15 122 0.2 . 1 . . . . 42 GLN N . 15100 1 484 . 1 1 72 72 GLN NE2 N 15 110.1 0.2 . 1 . . . . 42 GLN NE2 . 15100 1 485 . 1 1 73 73 VAL H H 1 8.57 0.02 . 1 . . . . 43 VAL H . 15100 1 486 . 1 1 73 73 VAL HA H 1 4.31 0.02 . 1 . . . . 43 VAL HA . 15100 1 487 . 1 1 73 73 VAL HB H 1 2.01 0.02 . 1 . . . . 43 VAL HB . 15100 1 488 . 1 1 73 73 VAL HG11 H 1 0.7 0.02 . 1 . . . . 43 VAL HG1 . 15100 1 489 . 1 1 73 73 VAL HG12 H 1 0.7 0.02 . 1 . . . . 43 VAL HG1 . 15100 1 490 . 1 1 73 73 VAL HG13 H 1 0.7 0.02 . 1 . . . . 43 VAL HG1 . 15100 1 491 . 1 1 73 73 VAL HG21 H 1 1.06 0.02 . 1 . . . . 43 VAL HG2 . 15100 1 492 . 1 1 73 73 VAL HG22 H 1 1.06 0.02 . 1 . . . . 43 VAL HG2 . 15100 1 493 . 1 1 73 73 VAL HG23 H 1 1.06 0.02 . 1 . . . . 43 VAL HG2 . 15100 1 494 . 1 1 73 73 VAL C C 13 175.7 0.2 . 1 . . . . 43 VAL C . 15100 1 495 . 1 1 73 73 VAL CA C 13 62.3 0.2 . 1 . . . . 43 VAL CA . 15100 1 496 . 1 1 73 73 VAL CB C 13 32.1 0.2 . 1 . . . . 43 VAL CB . 15100 1 497 . 1 1 73 73 VAL CG1 C 13 21.6 0.02 . 1 . . . . 43 VAL CG1 . 15100 1 498 . 1 1 73 73 VAL CG2 C 13 20.9 0.02 . 1 . . . . 43 VAL CG2 . 15100 1 499 . 1 1 73 73 VAL N N 15 126.6 0.2 . 1 . . . . 43 VAL N . 15100 1 500 . 1 1 74 74 LEU H H 1 9.01 0.02 . 1 . . . . 44 LEU H . 15100 1 501 . 1 1 74 74 LEU HA H 1 4.54 0.02 . 1 . . . . 44 LEU HA . 15100 1 502 . 1 1 74 74 LEU HB2 H 1 1.34 0.02 . 2 . . . . 44 LEU HB2 . 15100 1 503 . 1 1 74 74 LEU HB3 H 1 1.6 0.02 . 2 . . . . 44 LEU HB3 . 15100 1 504 . 1 1 74 74 LEU HG H 1 1.41 0.02 . 1 . . . . 44 LEU HG . 15100 1 505 . 1 1 74 74 LEU HD11 H 1 0.65 0.02 . 1 . . . . 44 LEU HD1 . 15100 1 506 . 1 1 74 74 LEU HD12 H 1 0.65 0.02 . 1 . . . . 44 LEU HD1 . 15100 1 507 . 1 1 74 74 LEU HD13 H 1 0.65 0.02 . 1 . . . . 44 LEU HD1 . 15100 1 508 . 1 1 74 74 LEU HD21 H 1 0.66 0.02 . 1 . . . . 44 LEU HD2 . 15100 1 509 . 1 1 74 74 LEU HD22 H 1 0.66 0.02 . 1 . . . . 44 LEU HD2 . 15100 1 510 . 1 1 74 74 LEU HD23 H 1 0.66 0.02 . 1 . . . . 44 LEU HD2 . 15100 1 511 . 1 1 74 74 LEU C C 13 175.7 0.2 . 1 . . . . 44 LEU C . 15100 1 512 . 1 1 74 74 LEU CA C 13 53.6 0.2 . 1 . . . . 44 LEU CA . 15100 1 513 . 1 1 74 74 LEU CB C 13 42.6 0.2 . 1 . . . . 44 LEU CB . 15100 1 514 . 1 1 74 74 LEU CG C 13 27 0.2 . 1 . . . . 44 LEU CG . 15100 1 515 . 1 1 74 74 LEU CD1 C 13 25.5 0.02 . 1 . . . . 44 LEU CD1 . 15100 1 516 . 1 1 74 74 LEU CD2 C 13 23.5 0.02 . 1 . . . . 44 LEU CD2 . 15100 1 517 . 1 1 74 74 LEU N N 15 130.5 0.2 . 1 . . . . 44 LEU N . 15100 1 518 . 1 1 75 75 LYS H H 1 8.48 0.02 . 1 . . . . 45 LYS H . 15100 1 519 . 1 1 75 75 LYS HA H 1 4.88 0.02 . 1 . . . . 45 LYS HA . 15100 1 520 . 1 1 75 75 LYS HB2 H 1 1.7 0.02 . 2 . . . . 45 LYS HB2 . 15100 1 521 . 1 1 75 75 LYS HB3 H 1 1.82 0.02 . 2 . . . . 45 LYS HB3 . 15100 1 522 . 1 1 75 75 LYS HG2 H 1 1.3 0.02 . 2 . . . . 45 LYS HG2 . 15100 1 523 . 1 1 75 75 LYS HG3 H 1 1.38 0.02 . 2 . . . . 45 LYS HG3 . 15100 1 524 . 1 1 75 75 LYS HD2 H 1 1.68 0.02 . 1 . . . . 45 LYS HD2 . 15100 1 525 . 1 1 75 75 LYS HD3 H 1 1.68 0.02 . 1 . . . . 45 LYS HD3 . 15100 1 526 . 1 1 75 75 LYS HE2 H 1 2.94 0.02 . 1 . . . . 45 LYS HE2 . 15100 1 527 . 1 1 75 75 LYS HE3 H 1 2.94 0.02 . 1 . . . . 45 LYS HE3 . 15100 1 528 . 1 1 75 75 LYS C C 13 175.7 0.2 . 1 . . . . 45 LYS C . 15100 1 529 . 1 1 75 75 LYS CA C 13 55.8 0.2 . 1 . . . . 45 LYS CA . 15100 1 530 . 1 1 75 75 LYS CB C 13 33.8 0.2 . 1 . . . . 45 LYS CB . 15100 1 531 . 1 1 75 75 LYS CG C 13 25.3 0.2 . 1 . . . . 45 LYS CG . 15100 1 532 . 1 1 75 75 LYS CD C 13 29.5 0.2 . 1 . . . . 45 LYS CD . 15100 1 533 . 1 1 75 75 LYS CE C 13 41.9 0.2 . 1 . . . . 45 LYS CE . 15100 1 534 . 1 1 75 75 LYS N N 15 124.1 0.2 . 1 . . . . 45 LYS N . 15100 1 535 . 1 1 76 76 ALA H H 1 8.25 0.02 . 1 . . . . 46 ALA H . 15100 1 536 . 1 1 76 76 ALA HA H 1 4.56 0.02 . 1 . . . . 46 ALA HA . 15100 1 537 . 1 1 76 76 ALA HB1 H 1 1.36 0.02 . 1 . . . . 46 ALA HB . 15100 1 538 . 1 1 76 76 ALA HB2 H 1 1.36 0.02 . 1 . . . . 46 ALA HB . 15100 1 539 . 1 1 76 76 ALA HB3 H 1 1.36 0.02 . 1 . . . . 46 ALA HB . 15100 1 540 . 1 1 76 76 ALA CA C 13 52.1 0.2 . 1 . . . . 46 ALA CA . 15100 1 541 . 1 1 76 76 ALA CB C 13 20.9 0.2 . 1 . . . . 46 ALA CB . 15100 1 542 . 1 1 76 76 ALA N N 15 126.6 0.2 . 1 . . . . 46 ALA N . 15100 1 543 . 1 1 77 77 CYS HA H 1 4.14 0.02 . 1 . . . . 47 CYS HA . 15100 1 544 . 1 1 77 77 CYS HB2 H 1 2.93 0.02 . 2 . . . . 47 CYS HB2 . 15100 1 545 . 1 1 77 77 CYS HB3 H 1 3.1 0.02 . 2 . . . . 47 CYS HB3 . 15100 1 546 . 1 1 77 77 CYS CA C 13 59.9 0.2 . 1 . . . . 47 CYS CA . 15100 1 547 . 1 1 77 77 CYS CB C 13 25.9 0.2 . 1 . . . . 47 CYS CB . 15100 1 548 . 1 1 78 78 GLY HA2 H 1 3.72 0.02 . 2 . . . . 48 GLY HA2 . 15100 1 549 . 1 1 78 78 GLY HA3 H 1 4.11 0.02 . 2 . . . . 48 GLY HA3 . 15100 1 550 . 1 1 78 78 GLY C C 13 173.3 0.2 . 1 . . . . 48 GLY C . 15100 1 551 . 1 1 78 78 GLY CA C 13 45.6 0.2 . 1 . . . . 48 GLY CA . 15100 1 552 . 1 1 79 79 ALA H H 1 7.83 0.02 . 1 . . . . 49 ALA H . 15100 1 553 . 1 1 79 79 ALA HA H 1 4.66 0.02 . 1 . . . . 49 ALA HA . 15100 1 554 . 1 1 79 79 ALA HB1 H 1 1.41 0.02 . 1 . . . . 49 ALA HB . 15100 1 555 . 1 1 79 79 ALA HB2 H 1 1.41 0.02 . 1 . . . . 49 ALA HB . 15100 1 556 . 1 1 79 79 ALA HB3 H 1 1.41 0.02 . 1 . . . . 49 ALA HB . 15100 1 557 . 1 1 79 79 ALA C C 13 176.2 0.2 . 1 . . . . 49 ALA C . 15100 1 558 . 1 1 79 79 ALA CA C 13 51.3 0.2 . 1 . . . . 49 ALA CA . 15100 1 559 . 1 1 79 79 ALA CB C 13 21.4 0.2 . 1 . . . . 49 ALA CB . 15100 1 560 . 1 1 79 79 ALA N N 15 124.1 0.2 . 1 . . . . 49 ALA N . 15100 1 561 . 1 1 80 80 VAL H H 1 8.09 0.02 . 1 . . . . 50 VAL H . 15100 1 562 . 1 1 80 80 VAL HA H 1 4.63 0.02 . 1 . . . . 50 VAL HA . 15100 1 563 . 1 1 80 80 VAL HB H 1 1.83 0.02 . 1 . . . . 50 VAL HB . 15100 1 564 . 1 1 80 80 VAL HG11 H 1 0.57 0.02 . 1 . . . . 50 VAL HG1 . 15100 1 565 . 1 1 80 80 VAL HG12 H 1 0.57 0.02 . 1 . . . . 50 VAL HG1 . 15100 1 566 . 1 1 80 80 VAL HG13 H 1 0.57 0.02 . 1 . . . . 50 VAL HG1 . 15100 1 567 . 1 1 80 80 VAL HG21 H 1 0.76 0.02 . 1 . . . . 50 VAL HG2 . 15100 1 568 . 1 1 80 80 VAL HG22 H 1 0.76 0.02 . 1 . . . . 50 VAL HG2 . 15100 1 569 . 1 1 80 80 VAL HG23 H 1 0.76 0.02 . 1 . . . . 50 VAL HG2 . 15100 1 570 . 1 1 80 80 VAL C C 13 174.3 0.2 . 1 . . . . 50 VAL C . 15100 1 571 . 1 1 80 80 VAL CA C 13 61.5 0.2 . 1 . . . . 50 VAL CA . 15100 1 572 . 1 1 80 80 VAL CB C 13 34.2 0.2 . 1 . . . . 50 VAL CB . 15100 1 573 . 1 1 80 80 VAL CG1 C 13 21.3 0.02 . 1 . . . . 50 VAL CG1 . 15100 1 574 . 1 1 80 80 VAL CG2 C 13 21.1 0.02 . 1 . . . . 50 VAL CG2 . 15100 1 575 . 1 1 80 80 VAL N N 15 119.8 0.2 . 1 . . . . 50 VAL N . 15100 1 576 . 1 1 81 81 ASP H H 1 8.55 0.02 . 1 . . . . 51 ASP H . 15100 1 577 . 1 1 81 81 ASP HA H 1 5.08 0.02 . 1 . . . . 51 ASP HA . 15100 1 578 . 1 1 81 81 ASP HB2 H 1 2.39 0.02 . 2 . . . . 51 ASP HB2 . 15100 1 579 . 1 1 81 81 ASP HB3 H 1 2.52 0.02 . 2 . . . . 51 ASP HB3 . 15100 1 580 . 1 1 81 81 ASP C C 13 173.6 0.2 . 1 . . . . 51 ASP C . 15100 1 581 . 1 1 81 81 ASP CA C 13 52.9 0.2 . 1 . . . . 51 ASP CA . 15100 1 582 . 1 1 81 81 ASP CB C 13 45.5 0.2 . 1 . . . . 51 ASP CB . 15100 1 583 . 1 1 81 81 ASP N N 15 125.5 0.2 . 1 . . . . 51 ASP N . 15100 1 584 . 1 1 82 82 TYR H H 1 8.97 0.02 . 1 . . . . 52 TYR H . 15100 1 585 . 1 1 82 82 TYR HA H 1 5.14 0.02 . 1 . . . . 52 TYR HA . 15100 1 586 . 1 1 82 82 TYR HB2 H 1 2.76 0.02 . 2 . . . . 52 TYR HB2 . 15100 1 587 . 1 1 82 82 TYR HB3 H 1 3.07 0.02 . 2 . . . . 52 TYR HB3 . 15100 1 588 . 1 1 82 82 TYR HD1 H 1 6.97 0.02 . 1 . . . . 52 TYR HD1 . 15100 1 589 . 1 1 82 82 TYR HD2 H 1 6.97 0.02 . 1 . . . . 52 TYR HD2 . 15100 1 590 . 1 1 82 82 TYR HE1 H 1 6.75 0.02 . 1 . . . . 52 TYR HE1 . 15100 1 591 . 1 1 82 82 TYR HE2 H 1 6.75 0.02 . 1 . . . . 52 TYR HE2 . 15100 1 592 . 1 1 82 82 TYR C C 13 174.6 0.2 . 1 . . . . 52 TYR C . 15100 1 593 . 1 1 82 82 TYR CA C 13 57.4 0.2 . 1 . . . . 52 TYR CA . 15100 1 594 . 1 1 82 82 TYR CB C 13 41.2 0.2 . 1 . . . . 52 TYR CB . 15100 1 595 . 1 1 82 82 TYR CD1 C 13 133.3 0.02 . 1 . . . . 52 TYR CD1 . 15100 1 596 . 1 1 82 82 TYR CD2 C 13 133.3 0.02 . 1 . . . . 52 TYR CD2 . 15100 1 597 . 1 1 82 82 TYR CE1 C 13 117.6 0.02 . 1 . . . . 52 TYR CE1 . 15100 1 598 . 1 1 82 82 TYR CE2 C 13 117.6 0.02 . 1 . . . . 52 TYR CE2 . 15100 1 599 . 1 1 82 82 TYR N N 15 118.7 0.2 . 1 . . . . 52 TYR N . 15100 1 600 . 1 1 83 83 PHE H H 1 9.21 0.02 . 1 . . . . 53 PHE H . 15100 1 601 . 1 1 83 83 PHE HA H 1 5.08 0.02 . 1 . . . . 53 PHE HA . 15100 1 602 . 1 1 83 83 PHE HB2 H 1 2.69 0.02 . 2 . . . . 53 PHE HB2 . 15100 1 603 . 1 1 83 83 PHE HB3 H 1 2.98 0.02 . 2 . . . . 53 PHE HB3 . 15100 1 604 . 1 1 83 83 PHE HD1 H 1 6.98 0.02 . 1 . . . . 53 PHE HD1 . 15100 1 605 . 1 1 83 83 PHE HD2 H 1 6.98 0.02 . 1 . . . . 53 PHE HD2 . 15100 1 606 . 1 1 83 83 PHE HE1 H 1 7.28 0.02 . 1 . . . . 53 PHE HE1 . 15100 1 607 . 1 1 83 83 PHE HE2 H 1 7.28 0.02 . 1 . . . . 53 PHE HE2 . 15100 1 608 . 1 1 83 83 PHE HZ H 1 7.29 0.02 . 1 . . . . 53 PHE HZ . 15100 1 609 . 1 1 83 83 PHE C C 13 173.2 0.2 . 1 . . . . 53 PHE C . 15100 1 610 . 1 1 83 83 PHE CA C 13 56.6 0.2 . 1 . . . . 53 PHE CA . 15100 1 611 . 1 1 83 83 PHE CB C 13 44.4 0.2 . 1 . . . . 53 PHE CB . 15100 1 612 . 1 1 83 83 PHE CD1 C 13 131.5 0.02 . 1 . . . . 53 PHE CD1 . 15100 1 613 . 1 1 83 83 PHE CD2 C 13 131.5 0.02 . 1 . . . . 53 PHE CD2 . 15100 1 614 . 1 1 83 83 PHE CE1 C 13 131.6 0.02 . 1 . . . . 53 PHE CE1 . 15100 1 615 . 1 1 83 83 PHE CE2 C 13 131.6 0.02 . 1 . . . . 53 PHE CE2 . 15100 1 616 . 1 1 83 83 PHE CZ C 13 130 0.2 . 1 . . . . 53 PHE CZ . 15100 1 617 . 1 1 83 83 PHE N N 15 123.3 0.2 . 1 . . . . 53 PHE N . 15100 1 618 . 1 1 84 84 CYS H H 1 9.13 0.02 . 1 . . . . 54 CYS H . 15100 1 619 . 1 1 84 84 CYS HA H 1 4.82 0.02 . 1 . . . . 54 CYS HA . 15100 1 620 . 1 1 84 84 CYS HB2 H 1 2.78 0.02 . 2 . . . . 54 CYS HB2 . 15100 1 621 . 1 1 84 84 CYS HB3 H 1 2.82 0.02 . 2 . . . . 54 CYS HB3 . 15100 1 622 . 1 1 84 84 CYS C C 13 175.9 0.2 . 1 . . . . 54 CYS C . 15100 1 623 . 1 1 84 84 CYS CA C 13 58.3 0.2 . 1 . . . . 54 CYS CA . 15100 1 624 . 1 1 84 84 CYS CB C 13 29.7 0.2 . 1 . . . . 54 CYS CB . 15100 1 625 . 1 1 84 84 CYS N N 15 131 0.2 . 1 . . . . 54 CYS N . 15100 1 626 . 1 1 85 85 GLN H H 1 9.5 0.02 . 1 . . . . 55 GLN H . 15100 1 627 . 1 1 85 85 GLN HA H 1 4.2 0.02 . 1 . . . . 55 GLN HA . 15100 1 628 . 1 1 85 85 GLN HB2 H 1 1.89 0.02 . 2 . . . . 55 GLN HB2 . 15100 1 629 . 1 1 85 85 GLN HB3 H 1 2.03 0.02 . 2 . . . . 55 GLN HB3 . 15100 1 630 . 1 1 85 85 GLN HG2 H 1 2.04 0.02 . 2 . . . . 55 GLN HG2 . 15100 1 631 . 1 1 85 85 GLN HG3 H 1 2.29 0.02 . 2 . . . . 55 GLN HG3 . 15100 1 632 . 1 1 85 85 GLN HE21 H 1 7.45 0.02 . 2 . . . . 55 GLN HE21 . 15100 1 633 . 1 1 85 85 GLN HE22 H 1 6.87 0.02 . 2 . . . . 55 GLN HE22 . 15100 1 634 . 1 1 85 85 GLN C C 13 174.7 0.2 . 1 . . . . 55 GLN C . 15100 1 635 . 1 1 85 85 GLN CA C 13 56.7 0.2 . 1 . . . . 55 GLN CA . 15100 1 636 . 1 1 85 85 GLN CB C 13 29 0.2 . 1 . . . . 55 GLN CB . 15100 1 637 . 1 1 85 85 GLN CG C 13 33.8 0.2 . 1 . . . . 55 GLN CG . 15100 1 638 . 1 1 85 85 GLN CD C 13 180.1 0.2 . 1 . . . . 55 GLN CD . 15100 1 639 . 1 1 85 85 GLN N N 15 129 0.2 . 1 . . . . 55 GLN N . 15100 1 640 . 1 1 85 85 GLN NE2 N 15 112.1 0.2 . 1 . . . . 55 GLN NE2 . 15100 1 641 . 1 1 86 86 HIS H H 1 8.88 0.02 . 1 . . . . 56 HIS H . 15100 1 642 . 1 1 86 86 HIS HA H 1 4.6 0.02 . 1 . . . . 56 HIS HA . 15100 1 643 . 1 1 86 86 HIS HB2 H 1 3.09 0.02 . 2 . . . . 56 HIS HB2 . 15100 1 644 . 1 1 86 86 HIS HB3 H 1 3.32 0.02 . 2 . . . . 56 HIS HB3 . 15100 1 645 . 1 1 86 86 HIS HD2 H 1 7.26 0.02 . 1 . . . . 56 HIS HD2 . 15100 1 646 . 1 1 86 86 HIS C C 13 175 0.2 . 1 . . . . 56 HIS C . 15100 1 647 . 1 1 86 86 HIS CA C 13 55.3 0.2 . 1 . . . . 56 HIS CA . 15100 1 648 . 1 1 86 86 HIS CB C 13 30.3 0.2 . 1 . . . . 56 HIS CB . 15100 1 649 . 1 1 86 86 HIS CD2 C 13 121.2 0.2 . 1 . . . . 56 HIS CD2 . 15100 1 650 . 1 1 86 86 HIS N N 15 122.5 0.2 . 1 . . . . 56 HIS N . 15100 1 651 . 1 1 87 87 GLY H H 1 7.29 0.02 . 1 . . . . 57 GLY H . 15100 1 652 . 1 1 87 87 GLY HA2 H 1 3.48 0.02 . 2 . . . . 57 GLY HA2 . 15100 1 653 . 1 1 87 87 GLY HA3 H 1 4.17 0.02 . 2 . . . . 57 GLY HA3 . 15100 1 654 . 1 1 87 87 GLY C C 13 175.8 0.2 . 1 . . . . 57 GLY C . 15100 1 655 . 1 1 87 87 GLY CA C 13 45.1 0.2 . 1 . . . . 57 GLY CA . 15100 1 656 . 1 1 87 87 GLY N N 15 105.8 0.2 . 1 . . . . 57 GLY N . 15100 1 657 . 1 1 88 88 HIS H H 1 7.49 0.02 . 1 . . . . 58 HIS H . 15100 1 658 . 1 1 88 88 HIS HA H 1 4.68 0.02 . 1 . . . . 58 HIS HA . 15100 1 659 . 1 1 88 88 HIS HB2 H 1 3.09 0.02 . 2 . . . . 58 HIS HB2 . 15100 1 660 . 1 1 88 88 HIS HB3 H 1 3.42 0.02 . 2 . . . . 58 HIS HB3 . 15100 1 661 . 1 1 88 88 HIS HD2 H 1 7.18 0.02 . 1 . . . . 58 HIS HD2 . 15100 1 662 . 1 1 88 88 HIS HE1 H 1 7.66 0.02 . 1 . . . . 58 HIS HE1 . 15100 1 663 . 1 1 88 88 HIS C C 13 174.2 0.2 . 1 . . . . 58 HIS C . 15100 1 664 . 1 1 88 88 HIS CA C 13 59.9 0.2 . 1 . . . . 58 HIS CA . 15100 1 665 . 1 1 88 88 HIS CB C 13 30.1 0.2 . 1 . . . . 58 HIS CB . 15100 1 666 . 1 1 88 88 HIS CD2 C 13 118 0.2 . 1 . . . . 58 HIS CD2 . 15100 1 667 . 1 1 88 88 HIS CE1 C 13 137.6 0.2 . 1 . . . . 58 HIS CE1 . 15100 1 668 . 1 1 88 88 HIS N N 15 116.4 0.2 . 1 . . . . 58 HIS N . 15100 1 669 . 1 1 89 89 GLY H H 1 7.61 0.02 . 1 . . . . 59 GLY H . 15100 1 670 . 1 1 89 89 GLY HA2 H 1 3 0.02 . 2 . . . . 59 GLY HA2 . 15100 1 671 . 1 1 89 89 GLY HA3 H 1 3.77 0.02 . 2 . . . . 59 GLY HA3 . 15100 1 672 . 1 1 89 89 GLY C C 13 173.1 0.2 . 1 . . . . 59 GLY C . 15100 1 673 . 1 1 89 89 GLY CA C 13 45.7 0.2 . 1 . . . . 59 GLY CA . 15100 1 674 . 1 1 89 89 GLY N N 15 108 0.2 . 1 . . . . 59 GLY N . 15100 1 675 . 1 1 90 90 LEU H H 1 8.43 0.02 . 1 . . . . 60 LEU H . 15100 1 676 . 1 1 90 90 LEU HA H 1 4.72 0.02 . 1 . . . . 60 LEU HA . 15100 1 677 . 1 1 90 90 LEU HB2 H 1 1.69 0.02 . 2 . . . . 60 LEU HB2 . 15100 1 678 . 1 1 90 90 LEU HB3 H 1 1.73 0.02 . 2 . . . . 60 LEU HB3 . 15100 1 679 . 1 1 90 90 LEU HG H 1 1.72 0.02 . 1 . . . . 60 LEU HG . 15100 1 680 . 1 1 90 90 LEU HD11 H 1 1.01 0.02 . 1 . . . . 60 LEU HD1 . 15100 1 681 . 1 1 90 90 LEU HD12 H 1 1.01 0.02 . 1 . . . . 60 LEU HD1 . 15100 1 682 . 1 1 90 90 LEU HD13 H 1 1.01 0.02 . 1 . . . . 60 LEU HD1 . 15100 1 683 . 1 1 90 90 LEU HD21 H 1 0.99 0.02 . 1 . . . . 60 LEU HD2 . 15100 1 684 . 1 1 90 90 LEU HD22 H 1 0.99 0.02 . 1 . . . . 60 LEU HD2 . 15100 1 685 . 1 1 90 90 LEU HD23 H 1 0.99 0.02 . 1 . . . . 60 LEU HD2 . 15100 1 686 . 1 1 90 90 LEU C C 13 176.9 0.2 . 1 . . . . 60 LEU C . 15100 1 687 . 1 1 90 90 LEU CA C 13 55.9 0.2 . 1 . . . . 60 LEU CA . 15100 1 688 . 1 1 90 90 LEU CB C 13 42.4 0.2 . 1 . . . . 60 LEU CB . 15100 1 689 . 1 1 90 90 LEU CG C 13 27.4 0.2 . 1 . . . . 60 LEU CG . 15100 1 690 . 1 1 90 90 LEU CD1 C 13 25 0.02 . 1 . . . . 60 LEU CD1 . 15100 1 691 . 1 1 90 90 LEU CD2 C 13 24.7 0.02 . 1 . . . . 60 LEU CD2 . 15100 1 692 . 1 1 90 90 LEU N N 15 124.4 0.2 . 1 . . . . 60 LEU N . 15100 1 693 . 1 1 91 91 ILE H H 1 8.75 0.02 . 1 . . . . 61 ILE H . 15100 1 694 . 1 1 91 91 ILE HA H 1 4.3 0.02 . 1 . . . . 61 ILE HA . 15100 1 695 . 1 1 91 91 ILE HB H 1 1.85 0.02 . 1 . . . . 61 ILE HB . 15100 1 696 . 1 1 91 91 ILE HG12 H 1 1.25 0.02 . 2 . . . . 61 ILE HG12 . 15100 1 697 . 1 1 91 91 ILE HG13 H 1 1.84 0.02 . 2 . . . . 61 ILE HG13 . 15100 1 698 . 1 1 91 91 ILE HG21 H 1 0.78 0.02 . 1 . . . . 61 ILE HG2 . 15100 1 699 . 1 1 91 91 ILE HG22 H 1 0.78 0.02 . 1 . . . . 61 ILE HG2 . 15100 1 700 . 1 1 91 91 ILE HG23 H 1 0.78 0.02 . 1 . . . . 61 ILE HG2 . 15100 1 701 . 1 1 91 91 ILE HD11 H 1 0.64 0.02 . 1 . . . . 61 ILE HD1 . 15100 1 702 . 1 1 91 91 ILE HD12 H 1 0.64 0.02 . 1 . . . . 61 ILE HD1 . 15100 1 703 . 1 1 91 91 ILE HD13 H 1 0.64 0.02 . 1 . . . . 61 ILE HD1 . 15100 1 704 . 1 1 91 91 ILE C C 13 175.7 0.2 . 1 . . . . 61 ILE C . 15100 1 705 . 1 1 91 91 ILE CA C 13 57.3 0.2 . 1 . . . . 61 ILE CA . 15100 1 706 . 1 1 91 91 ILE CB C 13 37.9 0.2 . 1 . . . . 61 ILE CB . 15100 1 707 . 1 1 91 91 ILE CG1 C 13 27.2 0.2 . 1 . . . . 61 ILE CG1 . 15100 1 708 . 1 1 91 91 ILE CG2 C 13 18.2 0.2 . 1 . . . . 61 ILE CG2 . 15100 1 709 . 1 1 91 91 ILE CD1 C 13 9.8 0.2 . 1 . . . . 61 ILE CD1 . 15100 1 710 . 1 1 91 91 ILE N N 15 128.4 0.2 . 1 . . . . 61 ILE N . 15100 1 711 . 1 1 92 92 SER H H 1 8.46 0.02 . 1 . . . . 62 SER H . 15100 1 712 . 1 1 92 92 SER HA H 1 4.45 0.02 . 1 . . . . 62 SER HA . 15100 1 713 . 1 1 92 92 SER HB2 H 1 3.84 0.02 . 2 . . . . 62 SER HB2 . 15100 1 714 . 1 1 92 92 SER HB3 H 1 4.1 0.02 . 2 . . . . 62 SER HB3 . 15100 1 715 . 1 1 92 92 SER C C 13 176.5 0.2 . 1 . . . . 62 SER C . 15100 1 716 . 1 1 92 92 SER CA C 13 58.6 0.2 . 1 . . . . 62 SER CA . 15100 1 717 . 1 1 92 92 SER CB C 13 63.7 0.2 . 1 . . . . 62 SER CB . 15100 1 718 . 1 1 92 92 SER N N 15 121.7 0.2 . 1 . . . . 62 SER N . 15100 1 719 . 1 1 93 93 LYS H H 1 9.04 0.02 . 1 . . . . 63 LYS H . 15100 1 720 . 1 1 93 93 LYS HA H 1 3.88 0.02 . 1 . . . . 63 LYS HA . 15100 1 721 . 1 1 93 93 LYS HB2 H 1 2.06 0.02 . 2 . . . . 63 LYS HB2 . 15100 1 722 . 1 1 93 93 LYS HB3 H 1 2.21 0.02 . 2 . . . . 63 LYS HB3 . 15100 1 723 . 1 1 93 93 LYS HG2 H 1 1.7 0.02 . 1 . . . . 63 LYS HG2 . 15100 1 724 . 1 1 93 93 LYS HG3 H 1 1.7 0.02 . 1 . . . . 63 LYS HG3 . 15100 1 725 . 1 1 93 93 LYS HD2 H 1 1.96 0.02 . 1 . . . . 63 LYS HD2 . 15100 1 726 . 1 1 93 93 LYS HD3 H 1 1.96 0.02 . 1 . . . . 63 LYS HD3 . 15100 1 727 . 1 1 93 93 LYS HE2 H 1 3.15 0.02 . 2 . . . . 63 LYS HE2 . 15100 1 728 . 1 1 93 93 LYS HE3 H 1 3.2 0.02 . 2 . . . . 63 LYS HE3 . 15100 1 729 . 1 1 93 93 LYS C C 13 178.1 0.2 . 1 . . . . 63 LYS C . 15100 1 730 . 1 1 93 93 LYS CA C 13 60.4 0.2 . 1 . . . . 63 LYS CA . 15100 1 731 . 1 1 93 93 LYS CB C 13 32.3 0.2 . 1 . . . . 63 LYS CB . 15100 1 732 . 1 1 93 93 LYS CG C 13 25.5 0.2 . 1 . . . . 63 LYS CG . 15100 1 733 . 1 1 93 93 LYS CD C 13 29.5 0.2 . 1 . . . . 63 LYS CD . 15100 1 734 . 1 1 93 93 LYS CE C 13 42.3 0.2 . 1 . . . . 63 LYS CE . 15100 1 735 . 1 1 93 93 LYS N N 15 126.7 0.2 . 1 . . . . 63 LYS N . 15100 1 736 . 1 1 94 94 LYS H H 1 8.04 0.02 . 1 . . . . 64 LYS H . 15100 1 737 . 1 1 94 94 LYS HA H 1 4.22 0.02 . 1 . . . . 64 LYS HA . 15100 1 738 . 1 1 94 94 LYS HB2 H 1 1.84 0.02 . 2 . . . . 64 LYS HB2 . 15100 1 739 . 1 1 94 94 LYS HB3 H 1 1.9 0.02 . 2 . . . . 64 LYS HB3 . 15100 1 740 . 1 1 94 94 LYS HG2 H 1 1.5 0.02 . 1 . . . . 64 LYS HG2 . 15100 1 741 . 1 1 94 94 LYS HG3 H 1 1.5 0.02 . 1 . . . . 64 LYS HG3 . 15100 1 742 . 1 1 94 94 LYS HD2 H 1 1.74 0.02 . 1 . . . . 64 LYS HD2 . 15100 1 743 . 1 1 94 94 LYS HD3 H 1 1.74 0.02 . 1 . . . . 64 LYS HD3 . 15100 1 744 . 1 1 94 94 LYS HE2 H 1 3.04 0.02 . 1 . . . . 64 LYS HE2 . 15100 1 745 . 1 1 94 94 LYS HE3 H 1 3.04 0.02 . 1 . . . . 64 LYS HE3 . 15100 1 746 . 1 1 94 94 LYS C C 13 176.9 0.2 . 1 . . . . 64 LYS C . 15100 1 747 . 1 1 94 94 LYS CA C 13 57.9 0.2 . 1 . . . . 64 LYS CA . 15100 1 748 . 1 1 94 94 LYS CB C 13 32.4 0.2 . 1 . . . . 64 LYS CB . 15100 1 749 . 1 1 94 94 LYS CG C 13 25.1 0.2 . 1 . . . . 64 LYS CG . 15100 1 750 . 1 1 94 94 LYS CD C 13 29.1 0.2 . 1 . . . . 64 LYS CD . 15100 1 751 . 1 1 94 94 LYS CE C 13 42 0.2 . 1 . . . . 64 LYS CE . 15100 1 752 . 1 1 94 94 LYS N N 15 114.8 0.2 . 1 . . . . 64 LYS N . 15100 1 753 . 1 1 95 95 ARG H H 1 7.99 0.02 . 1 . . . . 65 ARG H . 15100 1 754 . 1 1 95 95 ARG HA H 1 4.35 0.02 . 1 . . . . 65 ARG HA . 15100 1 755 . 1 1 95 95 ARG HB2 H 1 1.69 0.02 . 2 . . . . 65 ARG HB2 . 15100 1 756 . 1 1 95 95 ARG HB3 H 1 1.94 0.02 . 2 . . . . 65 ARG HB3 . 15100 1 757 . 1 1 95 95 ARG HG2 H 1 1.53 0.02 . 2 . . . . 65 ARG HG2 . 15100 1 758 . 1 1 95 95 ARG HG3 H 1 1.63 0.02 . 2 . . . . 65 ARG HG3 . 15100 1 759 . 1 1 95 95 ARG HD2 H 1 3.2 0.02 . 2 . . . . 65 ARG HD2 . 15100 1 760 . 1 1 95 95 ARG HD3 H 1 3.35 0.02 . 2 . . . . 65 ARG HD3 . 15100 1 761 . 1 1 95 95 ARG C C 13 176.1 0.2 . 1 . . . . 65 ARG C . 15100 1 762 . 1 1 95 95 ARG CA C 13 56 0.2 . 1 . . . . 65 ARG CA . 15100 1 763 . 1 1 95 95 ARG CB C 13 32.4 0.2 . 1 . . . . 65 ARG CB . 15100 1 764 . 1 1 95 95 ARG CG C 13 28.7 0.2 . 1 . . . . 65 ARG CG . 15100 1 765 . 1 1 95 95 ARG CD C 13 43.5 0.2 . 1 . . . . 65 ARG CD . 15100 1 766 . 1 1 95 95 ARG N N 15 116.5 0.2 . 1 . . . . 65 ARG N . 15100 1 767 . 1 1 96 96 VAL H H 1 6.82 0.02 . 1 . . . . 66 VAL H . 15100 1 768 . 1 1 96 96 VAL HA H 1 2.85 0.02 . 1 . . . . 66 VAL HA . 15100 1 769 . 1 1 96 96 VAL HB H 1 1.33 0.02 . 1 . . . . 66 VAL HB . 15100 1 770 . 1 1 96 96 VAL HG11 H 1 -0.55 0.02 . 1 . . . . 66 VAL HG1 . 15100 1 771 . 1 1 96 96 VAL HG12 H 1 -0.55 0.02 . 1 . . . . 66 VAL HG1 . 15100 1 772 . 1 1 96 96 VAL HG13 H 1 -0.55 0.02 . 1 . . . . 66 VAL HG1 . 15100 1 773 . 1 1 96 96 VAL HG21 H 1 0.21 0.02 . 1 . . . . 66 VAL HG2 . 15100 1 774 . 1 1 96 96 VAL HG22 H 1 0.21 0.02 . 1 . . . . 66 VAL HG2 . 15100 1 775 . 1 1 96 96 VAL HG23 H 1 0.21 0.02 . 1 . . . . 66 VAL HG2 . 15100 1 776 . 1 1 96 96 VAL C C 13 174.4 0.2 . 1 . . . . 66 VAL C . 15100 1 777 . 1 1 96 96 VAL CA C 13 65.2 0.2 . 1 . . . . 66 VAL CA . 15100 1 778 . 1 1 96 96 VAL CB C 13 32.3 0.2 . 1 . . . . 66 VAL CB . 15100 1 779 . 1 1 96 96 VAL CG1 C 13 21.1 0.02 . 1 . . . . 66 VAL CG1 . 15100 1 780 . 1 1 96 96 VAL CG2 C 13 23.1 0.02 . 1 . . . . 66 VAL CG2 . 15100 1 781 . 1 1 96 96 VAL N N 15 120 0.2 . 1 . . . . 66 VAL N . 15100 1 782 . 1 1 97 97 GLU H H 1 7.29 0.02 . 1 . . . . 67 GLU H . 15100 1 783 . 1 1 97 97 GLU HA H 1 4.38 0.02 . 1 . . . . 67 GLU HA . 15100 1 784 . 1 1 97 97 GLU HB2 H 1 1.62 0.02 . 2 . . . . 67 GLU HB2 . 15100 1 785 . 1 1 97 97 GLU HB3 H 1 1.84 0.02 . 2 . . . . 67 GLU HB3 . 15100 1 786 . 1 1 97 97 GLU HG2 H 1 1.99 0.02 . 2 . . . . 67 GLU HG2 . 15100 1 787 . 1 1 97 97 GLU HG3 H 1 2.09 0.02 . 2 . . . . 67 GLU HG3 . 15100 1 788 . 1 1 97 97 GLU C C 13 173.8 0.2 . 1 . . . . 67 GLU C . 15100 1 789 . 1 1 97 97 GLU CA C 13 54.5 0.2 . 1 . . . . 67 GLU CA . 15100 1 790 . 1 1 97 97 GLU CB C 13 30.7 0.2 . 1 . . . . 67 GLU CB . 15100 1 791 . 1 1 97 97 GLU CG C 13 35.9 0.2 . 1 . . . . 67 GLU CG . 15100 1 792 . 1 1 97 97 GLU N N 15 126.2 0.2 . 1 . . . . 67 GLU N . 15100 1 793 . 1 1 98 98 PHE H H 1 8.35 0.02 . 1 . . . . 68 PHE H . 15100 1 794 . 1 1 98 98 PHE HA H 1 5.4 0.02 . 1 . . . . 68 PHE HA . 15100 1 795 . 1 1 98 98 PHE HB2 H 1 2.71 0.02 . 2 . . . . 68 PHE HB2 . 15100 1 796 . 1 1 98 98 PHE HB3 H 1 2.87 0.02 . 2 . . . . 68 PHE HB3 . 15100 1 797 . 1 1 98 98 PHE HD1 H 1 6.98 0.02 . 1 . . . . 68 PHE HD1 . 15100 1 798 . 1 1 98 98 PHE HD2 H 1 6.98 0.02 . 1 . . . . 68 PHE HD2 . 15100 1 799 . 1 1 98 98 PHE HE1 H 1 7.2 0.02 . 1 . . . . 68 PHE HE1 . 15100 1 800 . 1 1 98 98 PHE HE2 H 1 7.2 0.02 . 1 . . . . 68 PHE HE2 . 15100 1 801 . 1 1 98 98 PHE HZ H 1 6.95 0.02 . 1 . . . . 68 PHE HZ . 15100 1 802 . 1 1 98 98 PHE C C 13 176.2 0.2 . 1 . . . . 68 PHE C . 15100 1 803 . 1 1 98 98 PHE CA C 13 57.8 0.2 . 1 . . . . 68 PHE CA . 15100 1 804 . 1 1 98 98 PHE CB C 13 41.1 0.2 . 1 . . . . 68 PHE CB . 15100 1 805 . 1 1 98 98 PHE CD1 C 13 132.1 0.02 . 1 . . . . 68 PHE CD1 . 15100 1 806 . 1 1 98 98 PHE CD2 C 13 132.1 0.02 . 1 . . . . 68 PHE CD2 . 15100 1 807 . 1 1 98 98 PHE CE1 C 13 131.5 0.02 . 1 . . . . 68 PHE CE1 . 15100 1 808 . 1 1 98 98 PHE CE2 C 13 131.5 0.02 . 1 . . . . 68 PHE CE2 . 15100 1 809 . 1 1 98 98 PHE CZ C 13 129.1 0.2 . 1 . . . . 68 PHE CZ . 15100 1 810 . 1 1 98 98 PHE N N 15 124.5 0.2 . 1 . . . . 68 PHE N . 15100 1 811 . 1 1 99 99 VAL H H 1 8.8 0.02 . 1 . . . . 69 VAL H . 15100 1 812 . 1 1 99 99 VAL HA H 1 4.72 0.02 . 1 . . . . 69 VAL HA . 15100 1 813 . 1 1 99 99 VAL HB H 1 2.25 0.02 . 1 . . . . 69 VAL HB . 15100 1 814 . 1 1 99 99 VAL HG11 H 1 0.85 0.02 . 1 . . . . 69 VAL HG1 . 15100 1 815 . 1 1 99 99 VAL HG12 H 1 0.85 0.02 . 1 . . . . 69 VAL HG1 . 15100 1 816 . 1 1 99 99 VAL HG13 H 1 0.85 0.02 . 1 . . . . 69 VAL HG1 . 15100 1 817 . 1 1 99 99 VAL HG21 H 1 0.8 0.02 . 1 . . . . 69 VAL HG2 . 15100 1 818 . 1 1 99 99 VAL HG22 H 1 0.8 0.02 . 1 . . . . 69 VAL HG2 . 15100 1 819 . 1 1 99 99 VAL HG23 H 1 0.8 0.02 . 1 . . . . 69 VAL HG2 . 15100 1 820 . 1 1 99 99 VAL C C 13 175.1 0.2 . 1 . . . . 69 VAL C . 15100 1 821 . 1 1 99 99 VAL CA C 13 58.9 0.2 . 1 . . . . 69 VAL CA . 15100 1 822 . 1 1 99 99 VAL CB C 13 35.7 0.2 . 1 . . . . 69 VAL CB . 15100 1 823 . 1 1 99 99 VAL CG1 C 13 21.7 0.02 . 1 . . . . 69 VAL CG1 . 15100 1 824 . 1 1 99 99 VAL CG2 C 13 19 0.02 . 1 . . . . 69 VAL CG2 . 15100 1 825 . 1 1 99 99 VAL N N 15 115.6 0.2 . 1 . . . . 69 VAL N . 15100 1 826 . 1 1 100 100 LEU H H 1 8.51 0.02 . 1 . . . . 70 LEU H . 15100 1 827 . 1 1 100 100 LEU HA H 1 4.46 0.02 . 1 . . . . 70 LEU HA . 15100 1 828 . 1 1 100 100 LEU HB2 H 1 1.66 0.02 . 1 . . . . 70 LEU HB2 . 15100 1 829 . 1 1 100 100 LEU HB3 H 1 1.66 0.02 . 1 . . . . 70 LEU HB3 . 15100 1 830 . 1 1 100 100 LEU HG H 1 1.74 0.02 . 1 . . . . 70 LEU HG . 15100 1 831 . 1 1 100 100 LEU HD11 H 1 0.96 0.02 . 1 . . . . 70 LEU HD1 . 15100 1 832 . 1 1 100 100 LEU HD12 H 1 0.96 0.02 . 1 . . . . 70 LEU HD1 . 15100 1 833 . 1 1 100 100 LEU HD13 H 1 0.96 0.02 . 1 . . . . 70 LEU HD1 . 15100 1 834 . 1 1 100 100 LEU HD21 H 1 0.83 0.02 . 1 . . . . 70 LEU HD2 . 15100 1 835 . 1 1 100 100 LEU HD22 H 1 0.83 0.02 . 1 . . . . 70 LEU HD2 . 15100 1 836 . 1 1 100 100 LEU HD23 H 1 0.83 0.02 . 1 . . . . 70 LEU HD2 . 15100 1 837 . 1 1 100 100 LEU C C 13 176.5 0.2 . 1 . . . . 70 LEU C . 15100 1 838 . 1 1 100 100 LEU CA C 13 55.8 0.2 . 1 . . . . 70 LEU CA . 15100 1 839 . 1 1 100 100 LEU CB C 13 41.8 0.2 . 1 . . . . 70 LEU CB . 15100 1 840 . 1 1 100 100 LEU CG C 13 27.2 0.2 . 1 . . . . 70 LEU CG . 15100 1 841 . 1 1 100 100 LEU CD1 C 13 25.7 0.02 . 1 . . . . 70 LEU CD1 . 15100 1 842 . 1 1 100 100 LEU CD2 C 13 23.5 0.02 . 1 . . . . 70 LEU CD2 . 15100 1 843 . 1 1 100 100 LEU N N 15 122.1 0.2 . 1 . . . . 70 LEU N . 15100 1 844 . 1 1 101 101 ALA H H 1 7.99 0.02 . 1 . . . . 71 ALA H . 15100 1 845 . 1 1 101 101 ALA HA H 1 4.07 0.02 . 1 . . . . 71 ALA HA . 15100 1 846 . 1 1 101 101 ALA HB1 H 1 1.3 0.02 . 1 . . . . 71 ALA HB . 15100 1 847 . 1 1 101 101 ALA HB2 H 1 1.3 0.02 . 1 . . . . 71 ALA HB . 15100 1 848 . 1 1 101 101 ALA HB3 H 1 1.3 0.02 . 1 . . . . 71 ALA HB . 15100 1 849 . 1 1 101 101 ALA CA C 13 53.8 0.2 . 1 . . . . 71 ALA CA . 15100 1 850 . 1 1 101 101 ALA CB C 13 20.5 0.2 . 1 . . . . 71 ALA CB . 15100 1 851 . 1 1 101 101 ALA N N 15 129.7 0.2 . 1 . . . . 71 ALA N . 15100 1 stop_ save_