################################### # 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 16961 _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 '2D 1H-15N HSQC' . . . 16961 1 2 '2D 1H-13C HSQC' . . . 16961 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 7 $SPARKY . . 16961 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 1 1 MET HA H 1 4.1 0.02 . 1 . . . . 1 MET HA . 16961 1 2 . 1 1 1 1 MET HB2 H 1 2.14 0.02 . 2 . . . . 1 MET HB2 . 16961 1 3 . 1 1 1 1 MET HB3 H 1 2.14 0.02 . 2 . . . . 1 MET HB3 . 16961 1 4 . 1 1 1 1 MET HE1 H 1 2.08 0.02 . 1 . . . . 1 MET HE . 16961 1 5 . 1 1 1 1 MET HE2 H 1 2.08 0.02 . 1 . . . . 1 MET HE . 16961 1 6 . 1 1 1 1 MET HE3 H 1 2.08 0.02 . 1 . . . . 1 MET HE . 16961 1 7 . 1 1 1 1 MET HG2 H 1 2.56 0.02 . 2 . . . . 1 MET HG2 . 16961 1 8 . 1 1 1 1 MET HG3 H 1 2.56 0.02 . 2 . . . . 1 MET HG3 . 16961 1 9 . 1 1 1 1 MET C C 13 171.7 0.2 . 1 . . . . 1 MET C . 16961 1 10 . 1 1 1 1 MET CA C 13 55.1 0.2 . 1 . . . . 1 MET CA . 16961 1 11 . 1 1 1 1 MET CB C 13 32.7 0.2 . 1 . . . . 1 MET CB . 16961 1 12 . 1 1 1 1 MET CE C 13 16.9 0.2 . 1 . . . . 1 MET CE . 16961 1 13 . 1 1 1 1 MET CG C 13 30.8 0.2 . 1 . . . . 1 MET CG . 16961 1 14 . 1 1 2 2 ASP H H 1 8.77 0.02 . 1 . . . . 2 ASP H . 16961 1 15 . 1 1 2 2 ASP HA H 1 4.63 0.02 . 1 . . . . 2 ASP HA . 16961 1 16 . 1 1 2 2 ASP HB2 H 1 2.65 0.02 . 2 . . . . 2 ASP HB2 . 16961 1 17 . 1 1 2 2 ASP HB3 H 1 2.78 0.02 . 2 . . . . 2 ASP HB3 . 16961 1 18 . 1 1 2 2 ASP C C 13 175.3 0.2 . 1 . . . . 2 ASP C . 16961 1 19 . 1 1 2 2 ASP CA C 13 54 0.2 . 1 . . . . 2 ASP CA . 16961 1 20 . 1 1 2 2 ASP CB C 13 41.1 0.2 . 1 . . . . 2 ASP CB . 16961 1 21 . 1 1 2 2 ASP N N 15 123.9 0.2 . 1 . . . . 2 ASP N . 16961 1 22 . 1 1 3 3 ASN H H 1 8.56 0.02 . 1 . . . . 3 ASN H . 16961 1 23 . 1 1 3 3 ASN HA H 1 4.72 0.02 . 1 . . . . 3 ASN HA . 16961 1 24 . 1 1 3 3 ASN HB2 H 1 2.69 0.02 . 2 . . . . 3 ASN HB2 . 16961 1 25 . 1 1 3 3 ASN HB3 H 1 2.88 0.02 . 2 . . . . 3 ASN HB3 . 16961 1 26 . 1 1 3 3 ASN HD21 H 1 7.54 0.02 . 2 . . . . 3 ASN HD21 . 16961 1 27 . 1 1 3 3 ASN HD22 H 1 6.82 0.02 . 2 . . . . 3 ASN HD22 . 16961 1 28 . 1 1 3 3 ASN C C 13 174.5 0.2 . 1 . . . . 3 ASN C . 16961 1 29 . 1 1 3 3 ASN CA C 13 52.9 0.2 . 1 . . . . 3 ASN CA . 16961 1 30 . 1 1 3 3 ASN CB C 13 38.3 0.2 . 1 . . . . 3 ASN CB . 16961 1 31 . 1 1 3 3 ASN CG C 13 176.7 0.2 . 1 . . . . 3 ASN CG . 16961 1 32 . 1 1 3 3 ASN N N 15 120.4 0.2 . 1 . . . . 3 ASN N . 16961 1 33 . 1 1 3 3 ASN ND2 N 15 111.6 0.2 . 1 . . . . 3 ASN ND2 . 16961 1 34 . 1 1 4 4 ARG H H 1 7.96 0.02 . 1 . . . . 4 ARG H . 16961 1 35 . 1 1 4 4 ARG HA H 1 3.94 0.02 . 1 . . . . 4 ARG HA . 16961 1 36 . 1 1 4 4 ARG HB2 H 1 1.51 0.02 . 2 . . . . 4 ARG HB2 . 16961 1 37 . 1 1 4 4 ARG HB3 H 1 1.69 0.02 . 2 . . . . 4 ARG HB3 . 16961 1 38 . 1 1 4 4 ARG HD2 H 1 3.07 0.02 . 2 . . . . 4 ARG HD2 . 16961 1 39 . 1 1 4 4 ARG HD3 H 1 3.14 0.02 . 2 . . . . 4 ARG HD3 . 16961 1 40 . 1 1 4 4 ARG HE H 1 7.75 0.02 . 1 . . . . 4 ARG HE . 16961 1 41 . 1 1 4 4 ARG HG2 H 1 1.29 0.02 . 2 . . . . 4 ARG HG2 . 16961 1 42 . 1 1 4 4 ARG HG3 H 1 1.52 0.02 . 2 . . . . 4 ARG HG3 . 16961 1 43 . 1 1 4 4 ARG C C 13 175.6 0.2 . 1 . . . . 4 ARG C . 16961 1 44 . 1 1 4 4 ARG CA C 13 57.2 0.2 . 1 . . . . 4 ARG CA . 16961 1 45 . 1 1 4 4 ARG CB C 13 30.7 0.2 . 1 . . . . 4 ARG CB . 16961 1 46 . 1 1 4 4 ARG CD C 13 43.4 0.2 . 1 . . . . 4 ARG CD . 16961 1 47 . 1 1 4 4 ARG CG C 13 27.3 0.2 . 1 . . . . 4 ARG CG . 16961 1 48 . 1 1 4 4 ARG N N 15 120.3 0.2 . 1 . . . . 4 ARG N . 16961 1 49 . 1 1 4 4 ARG NE N 15 114.2 0.2 . 1 . . . . 4 ARG NE . 16961 1 50 . 1 1 5 5 GLN H H 1 8.77 0.02 . 1 . . . . 5 GLN H . 16961 1 51 . 1 1 5 5 GLN HA H 1 4.23 0.02 . 1 . . . . 5 GLN HA . 16961 1 52 . 1 1 5 5 GLN HB2 H 1 1.80 0.02 . 2 . . . . 5 GLN HB2 . 16961 1 53 . 1 1 5 5 GLN HB3 H 1 1.94 0.02 . 2 . . . . 5 GLN HB3 . 16961 1 54 . 1 1 5 5 GLN HE21 H 1 8.46 0.02 . 2 . . . . 5 GLN HE21 . 16961 1 55 . 1 1 5 5 GLN HE22 H 1 6.15 0.02 . 2 . . . . 5 GLN HE22 . 16961 1 56 . 1 1 5 5 GLN HG2 H 1 2.24 0.02 . 2 . . . . 5 GLN HG2 . 16961 1 57 . 1 1 5 5 GLN HG3 H 1 2.24 0.02 . 2 . . . . 5 GLN HG3 . 16961 1 58 . 1 1 5 5 GLN C C 13 172.5 0.2 . 1 . . . . 5 GLN C . 16961 1 59 . 1 1 5 5 GLN CA C 13 54.7 0.2 . 1 . . . . 5 GLN CA . 16961 1 60 . 1 1 5 5 GLN CB C 13 34.2 0.2 . 1 . . . . 5 GLN CB . 16961 1 61 . 1 1 5 5 GLN CD C 13 179.8 0.2 . 1 . . . . 5 GLN CD . 16961 1 62 . 1 1 5 5 GLN CG C 13 35.0 0.2 . 1 . . . . 5 GLN CG . 16961 1 63 . 1 1 5 5 GLN N N 15 122.8 0.2 . 1 . . . . 5 GLN N . 16961 1 64 . 1 1 5 5 GLN NE2 N 15 111 0.2 . 1 . . . . 5 GLN NE2 . 16961 1 65 . 1 1 6 6 PHE H H 1 8.01 0.02 . 1 . . . . 6 PHE H . 16961 1 66 . 1 1 6 6 PHE HA H 1 5.36 0.02 . 1 . . . . 6 PHE HA . 16961 1 67 . 1 1 6 6 PHE HB2 H 1 2.92 0.02 . 2 . . . . 6 PHE HB2 . 16961 1 68 . 1 1 6 6 PHE HB3 H 1 3.01 0.02 . 2 . . . . 6 PHE HB3 . 16961 1 69 . 1 1 6 6 PHE HD1 H 1 7.17 0.02 . 3 . . . . 6 PHE HD1 . 16961 1 70 . 1 1 6 6 PHE HD2 H 1 7.17 0.02 . 3 . . . . 6 PHE HD2 . 16961 1 71 . 1 1 6 6 PHE HE1 H 1 7.18 0.02 . 3 . . . . 6 PHE HE1 . 16961 1 72 . 1 1 6 6 PHE HE2 H 1 7.18 0.02 . 3 . . . . 6 PHE HE2 . 16961 1 73 . 1 1 6 6 PHE HZ H 1 7.30 0.02 . 1 . . . . 6 PHE HZ . 16961 1 74 . 1 1 6 6 PHE C C 13 174.7 0.2 . 1 . . . . 6 PHE C . 16961 1 75 . 1 1 6 6 PHE CA C 13 56.4 0.2 . 1 . . . . 6 PHE CA . 16961 1 76 . 1 1 6 6 PHE CB C 13 40.9 0.2 . 1 . . . . 6 PHE CB . 16961 1 77 . 1 1 6 6 PHE CD1 C 13 132.0 0.2 . 3 . . . . 6 PHE CD1 . 16961 1 78 . 1 1 6 6 PHE CD2 C 13 132.0 0.2 . 3 . . . . 6 PHE CD2 . 16961 1 79 . 1 1 6 6 PHE CE1 C 13 131.1 0.2 . 3 . . . . 6 PHE CE1 . 16961 1 80 . 1 1 6 6 PHE CE2 C 13 131.1 0.2 . 3 . . . . 6 PHE CE2 . 16961 1 81 . 1 1 6 6 PHE CZ C 13 130.0 0.2 . 1 . . . . 6 PHE CZ . 16961 1 82 . 1 1 6 6 PHE N N 15 118.1 0.2 . 1 . . . . 6 PHE N . 16961 1 83 . 1 1 7 7 LEU H H 1 9.01 0.02 . 1 . . . . 7 LEU H . 16961 1 84 . 1 1 7 7 LEU HA H 1 5.45 0.02 . 1 . . . . 7 LEU HA . 16961 1 85 . 1 1 7 7 LEU HB2 H 1 1.28 0.02 . 2 . . . . 7 LEU HB2 . 16961 1 86 . 1 1 7 7 LEU HB3 H 1 1.44 0.02 . 2 . . . . 7 LEU HB3 . 16961 1 87 . 1 1 7 7 LEU HD11 H 1 0.59 0.02 . 2 . . . . 7 LEU HD1 . 16961 1 88 . 1 1 7 7 LEU HD12 H 1 0.59 0.02 . 2 . . . . 7 LEU HD1 . 16961 1 89 . 1 1 7 7 LEU HD13 H 1 0.59 0.02 . 2 . . . . 7 LEU HD1 . 16961 1 90 . 1 1 7 7 LEU HD21 H 1 0.6 0.02 . 2 . . . . 7 LEU HD2 . 16961 1 91 . 1 1 7 7 LEU HD22 H 1 0.6 0.02 . 2 . . . . 7 LEU HD2 . 16961 1 92 . 1 1 7 7 LEU HD23 H 1 0.6 0.02 . 2 . . . . 7 LEU HD2 . 16961 1 93 . 1 1 7 7 LEU HG H 1 1.54 0.02 . 1 . . . . 7 LEU HG . 16961 1 94 . 1 1 7 7 LEU C C 13 174.7 0.2 . 1 . . . . 7 LEU C . 16961 1 95 . 1 1 7 7 LEU CA C 13 53.6 0.2 . 1 . . . . 7 LEU CA . 16961 1 96 . 1 1 7 7 LEU CB C 13 46.0 0.2 . 1 . . . . 7 LEU CB . 16961 1 97 . 1 1 7 7 LEU CD1 C 13 25.2 0.2 . 2 . . . . 7 LEU CD1 . 16961 1 98 . 1 1 7 7 LEU CD2 C 13 25.4 0.2 . 2 . . . . 7 LEU CD2 . 16961 1 99 . 1 1 7 7 LEU CG C 13 27.5 0.2 . 1 . . . . 7 LEU CG . 16961 1 100 . 1 1 7 7 LEU N N 15 126.9 0.2 . 1 . . . . 7 LEU N . 16961 1 101 . 1 1 8 8 SER H H 1 9.32 0.02 . 1 . . . . 8 SER H . 16961 1 102 . 1 1 8 8 SER HA H 1 5.73 0.02 . 1 . . . . 8 SER HA . 16961 1 103 . 1 1 8 8 SER HB2 H 1 3.84 0.02 . 2 . . . . 8 SER HB2 . 16961 1 104 . 1 1 8 8 SER HB3 H 1 3.84 0.02 . 2 . . . . 8 SER HB3 . 16961 1 105 . 1 1 8 8 SER C C 13 172.4 0.2 . 1 . . . . 8 SER C . 16961 1 106 . 1 1 8 8 SER CA C 13 56.2 0.2 . 1 . . . . 8 SER CA . 16961 1 107 . 1 1 8 8 SER CB C 13 65.8 0.2 . 1 . . . . 8 SER CB . 16961 1 108 . 1 1 8 8 SER N N 15 122 0.2 . 1 . . . . 8 SER N . 16961 1 109 . 1 1 9 9 LEU H H 1 8.59 0.02 . 1 . . . . 9 LEU H . 16961 1 110 . 1 1 9 9 LEU HA H 1 5.58 0.02 . 1 . . . . 9 LEU HA . 16961 1 111 . 1 1 9 9 LEU HB2 H 1 1.26 0.02 . 2 . . . . 9 LEU HB2 . 16961 1 112 . 1 1 9 9 LEU HB3 H 1 1.52 0.02 . 2 . . . . 9 LEU HB3 . 16961 1 113 . 1 1 9 9 LEU HD11 H 1 0.77 0.02 . 2 . . . . 9 LEU HD1 . 16961 1 114 . 1 1 9 9 LEU HD12 H 1 0.77 0.02 . 2 . . . . 9 LEU HD1 . 16961 1 115 . 1 1 9 9 LEU HD13 H 1 0.77 0.02 . 2 . . . . 9 LEU HD1 . 16961 1 116 . 1 1 9 9 LEU HD21 H 1 0.53 0.02 . 2 . . . . 9 LEU HD2 . 16961 1 117 . 1 1 9 9 LEU HD22 H 1 0.53 0.02 . 2 . . . . 9 LEU HD2 . 16961 1 118 . 1 1 9 9 LEU HD23 H 1 0.53 0.02 . 2 . . . . 9 LEU HD2 . 16961 1 119 . 1 1 9 9 LEU HG H 1 2.03 0.02 . 1 . . . . 9 LEU HG . 16961 1 120 . 1 1 9 9 LEU C C 13 175.7 0.2 . 1 . . . . 9 LEU C . 16961 1 121 . 1 1 9 9 LEU CA C 13 54.1 0.2 . 1 . . . . 9 LEU CA . 16961 1 122 . 1 1 9 9 LEU CB C 13 47.4 0.2 . 1 . . . . 9 LEU CB . 16961 1 123 . 1 1 9 9 LEU CD1 C 13 24.3 0.2 . 2 . . . . 9 LEU CD1 . 16961 1 124 . 1 1 9 9 LEU CD2 C 13 25.9 0.2 . 2 . . . . 9 LEU CD2 . 16961 1 125 . 1 1 9 9 LEU CG C 13 26.1 0.2 . 1 . . . . 9 LEU CG . 16961 1 126 . 1 1 9 9 LEU N N 15 124.3 0.2 . 1 . . . . 9 LEU N . 16961 1 127 . 1 1 10 10 THR H H 1 7.62 0.02 . 1 . . . . 10 THR H . 16961 1 128 . 1 1 10 10 THR HA H 1 5.35 0.02 . 1 . . . . 10 THR HA . 16961 1 129 . 1 1 10 10 THR HB H 1 4.81 0.02 . 1 . . . . 10 THR HB . 16961 1 130 . 1 1 10 10 THR HG21 H 1 1.38 0.02 . 1 . . . . 10 THR HG2 . 16961 1 131 . 1 1 10 10 THR HG22 H 1 1.38 0.02 . 1 . . . . 10 THR HG2 . 16961 1 132 . 1 1 10 10 THR HG23 H 1 1.38 0.02 . 1 . . . . 10 THR HG2 . 16961 1 133 . 1 1 10 10 THR C C 13 175.1 0.2 . 1 . . . . 10 THR C . 16961 1 134 . 1 1 10 10 THR CA C 13 61 0.2 . 1 . . . . 10 THR CA . 16961 1 135 . 1 1 10 10 THR CB C 13 70 0.2 . 1 . . . . 10 THR CB . 16961 1 136 . 1 1 10 10 THR CG2 C 13 22.9 0.2 . 1 . . . . 10 THR CG2 . 16961 1 137 . 1 1 10 10 THR N N 15 111.8 0.2 . 1 . . . . 10 THR N . 16961 1 138 . 1 1 11 11 GLY H H 1 8.91 0.02 . 1 . . . . 11 GLY H . 16961 1 139 . 1 1 11 11 GLY HA2 H 1 4.02 0.02 . 2 . . . . 11 GLY HA2 . 16961 1 140 . 1 1 11 11 GLY HA3 H 1 4.02 0.02 . 2 . . . . 11 GLY HA3 . 16961 1 141 . 1 1 11 11 GLY C C 13 176.6 0.2 . 1 . . . . 11 GLY C . 16961 1 142 . 1 1 11 11 GLY CA C 13 47.1 0.2 . 1 . . . . 11 GLY CA . 16961 1 143 . 1 1 11 11 GLY N N 15 107.5 0.2 . 1 . . . . 11 GLY N . 16961 1 144 . 1 1 12 12 VAL H H 1 9.25 0.02 . 1 . . . . 12 VAL H . 16961 1 145 . 1 1 12 12 VAL HA H 1 4.07 0.02 . 1 . . . . 12 VAL HA . 16961 1 146 . 1 1 12 12 VAL HB H 1 1.7 0.02 . 1 . . . . 12 VAL HB . 16961 1 147 . 1 1 12 12 VAL HG11 H 1 0.76 0.02 . 2 . . . . 12 VAL HG1 . 16961 1 148 . 1 1 12 12 VAL HG12 H 1 0.76 0.02 . 2 . . . . 12 VAL HG1 . 16961 1 149 . 1 1 12 12 VAL HG13 H 1 0.76 0.02 . 2 . . . . 12 VAL HG1 . 16961 1 150 . 1 1 12 12 VAL HG21 H 1 0.68 0.02 . 2 . . . . 12 VAL HG2 . 16961 1 151 . 1 1 12 12 VAL HG22 H 1 0.68 0.02 . 2 . . . . 12 VAL HG2 . 16961 1 152 . 1 1 12 12 VAL HG23 H 1 0.68 0.02 . 2 . . . . 12 VAL HG2 . 16961 1 153 . 1 1 12 12 VAL C C 13 174.7 0.2 . 1 . . . . 12 VAL C . 16961 1 154 . 1 1 12 12 VAL CA C 13 62.8 0.2 . 1 . . . . 12 VAL CA . 16961 1 155 . 1 1 12 12 VAL CB C 13 32.4 0.2 . 1 . . . . 12 VAL CB . 16961 1 156 . 1 1 12 12 VAL CG1 C 13 21.9 0.2 . 2 . . . . 12 VAL CG1 . 16961 1 157 . 1 1 12 12 VAL CG2 C 13 22.0 0.2 . 2 . . . . 12 VAL CG2 . 16961 1 158 . 1 1 12 12 VAL N N 15 126.1 0.2 . 1 . . . . 12 VAL N . 16961 1 159 . 1 1 13 13 SER H H 1 8.83 0.02 . 1 . . . . 13 SER H . 16961 1 160 . 1 1 13 13 SER HA H 1 4.53 0.02 . 1 . . . . 13 SER HA . 16961 1 161 . 1 1 13 13 SER HB2 H 1 3.72 0.02 . 2 . . . . 13 SER HB2 . 16961 1 162 . 1 1 13 13 SER HB3 H 1 3.79 0.02 . 2 . . . . 13 SER HB3 . 16961 1 163 . 1 1 13 13 SER C C 13 174.8 0.2 . 1 . . . . 13 SER C . 16961 1 164 . 1 1 13 13 SER CA C 13 59 0.2 . 1 . . . . 13 SER CA . 16961 1 165 . 1 1 13 13 SER CB C 13 64.1 0.2 . 1 . . . . 13 SER CB . 16961 1 166 . 1 1 13 13 SER N N 15 120.6 0.2 . 1 . . . . 13 SER N . 16961 1 167 . 1 1 14 14 LYS H H 1 7.4 0.02 . 1 . . . . 14 LYS H . 16961 1 168 . 1 1 14 14 LYS HA H 1 4.37 0.02 . 1 . . . . 14 LYS HA . 16961 1 169 . 1 1 14 14 LYS HB2 H 1 1.65 0.02 . 2 . . . . 14 LYS HB2 . 16961 1 170 . 1 1 14 14 LYS HB3 H 1 1.79 0.02 . 2 . . . . 14 LYS HB3 . 16961 1 171 . 1 1 14 14 LYS HD2 H 1 1.62 0.02 . 2 . . . . 14 LYS HD2 . 16961 1 172 . 1 1 14 14 LYS HD3 H 1 1.62 0.02 . 2 . . . . 14 LYS HD3 . 16961 1 173 . 1 1 14 14 LYS HE2 H 1 2.92 0.02 . 2 . . . . 14 LYS HE2 . 16961 1 174 . 1 1 14 14 LYS HE3 H 1 2.92 0.02 . 2 . . . . 14 LYS HE3 . 16961 1 175 . 1 1 14 14 LYS HG2 H 1 1.16 0.02 . 2 . . . . 14 LYS HG2 . 16961 1 176 . 1 1 14 14 LYS HG3 H 1 1.26 0.02 . 2 . . . . 14 LYS HG3 . 16961 1 177 . 1 1 14 14 LYS C C 13 174.6 0.2 . 1 . . . . 14 LYS C . 16961 1 178 . 1 1 14 14 LYS CA C 13 56.3 0.2 . 1 . . . . 14 LYS CA . 16961 1 179 . 1 1 14 14 LYS CB C 13 36.6 0.2 . 1 . . . . 14 LYS CB . 16961 1 180 . 1 1 14 14 LYS CD C 13 29.1 0.2 . 1 . . . . 14 LYS CD . 16961 1 181 . 1 1 14 14 LYS CE C 13 41.8 0.2 . 1 . . . . 14 LYS CE . 16961 1 182 . 1 1 14 14 LYS CG C 13 24.5 0.2 . 1 . . . . 14 LYS CG . 16961 1 183 . 1 1 14 14 LYS N N 15 117.9 0.2 . 1 . . . . 14 LYS N . 16961 1 184 . 1 1 15 15 VAL H H 1 8.90 0.02 . 1 . . . . 15 VAL H . 16961 1 185 . 1 1 15 15 VAL HA H 1 4.16 0.02 . 1 . . . . 15 VAL HA . 16961 1 186 . 1 1 15 15 VAL HB H 1 2.1 0.02 . 1 . . . . 15 VAL HB . 16961 1 187 . 1 1 15 15 VAL HG11 H 1 0.74 0.02 . 2 . . . . 15 VAL HG1 . 16961 1 188 . 1 1 15 15 VAL HG12 H 1 0.74 0.02 . 2 . . . . 15 VAL HG1 . 16961 1 189 . 1 1 15 15 VAL HG13 H 1 0.74 0.02 . 2 . . . . 15 VAL HG1 . 16961 1 190 . 1 1 15 15 VAL HG21 H 1 0.78 0.02 . 2 . . . . 15 VAL HG2 . 16961 1 191 . 1 1 15 15 VAL HG22 H 1 0.78 0.02 . 2 . . . . 15 VAL HG2 . 16961 1 192 . 1 1 15 15 VAL HG23 H 1 0.78 0.02 . 2 . . . . 15 VAL HG2 . 16961 1 193 . 1 1 15 15 VAL C C 13 175.3 0.2 . 1 . . . . 15 VAL C . 16961 1 194 . 1 1 15 15 VAL CA C 13 62.3 0.2 . 1 . . . . 15 VAL CA . 16961 1 195 . 1 1 15 15 VAL CB C 13 31.2 0.2 . 1 . . . . 15 VAL CB . 16961 1 196 . 1 1 15 15 VAL CG1 C 13 21.0 0.2 . 2 . . . . 15 VAL CG1 . 16961 1 197 . 1 1 15 15 VAL CG2 C 13 20.7 0.2 . 2 . . . . 15 VAL CG2 . 16961 1 198 . 1 1 15 15 VAL N N 15 124.8 0.2 . 1 . . . . 15 VAL N . 16961 1 199 . 1 1 16 16 GLN H H 1 8.64 0.02 . 1 . . . . 16 GLN H . 16961 1 200 . 1 1 16 16 GLN HA H 1 4.13 0.02 . 1 . . . . 16 GLN HA . 16961 1 201 . 1 1 16 16 GLN HB2 H 1 1.9 0.02 . 2 . . . . 16 GLN HB2 . 16961 1 202 . 1 1 16 16 GLN HB3 H 1 1.98 0.02 . 2 . . . . 16 GLN HB3 . 16961 1 203 . 1 1 16 16 GLN HE21 H 1 7.82 0.02 . 2 . . . . 16 GLN HE21 . 16961 1 204 . 1 1 16 16 GLN HE22 H 1 6.55 0.02 . 2 . . . . 16 GLN HE22 . 16961 1 205 . 1 1 16 16 GLN HG2 H 1 2.14 0.02 . 2 . . . . 16 GLN HG2 . 16961 1 206 . 1 1 16 16 GLN HG3 H 1 2.33 0.02 . 2 . . . . 16 GLN HG3 . 16961 1 207 . 1 1 16 16 GLN C C 13 176.2 0.2 . 1 . . . . 16 GLN C . 16961 1 208 . 1 1 16 16 GLN CA C 13 58.4 0.2 . 1 . . . . 16 GLN CA . 16961 1 209 . 1 1 16 16 GLN CB C 13 29.7 0.2 . 1 . . . . 16 GLN CB . 16961 1 210 . 1 1 16 16 GLN CD C 13 178.3 0.2 . 1 . . . . 16 GLN CD . 16961 1 211 . 1 1 16 16 GLN CG C 13 34 0.2 . 1 . . . . 16 GLN CG . 16961 1 212 . 1 1 16 16 GLN N N 15 128.8 0.2 . 1 . . . . 16 GLN N . 16961 1 213 . 1 1 16 16 GLN NE2 N 15 110 0.2 . 1 . . . . 16 GLN NE2 . 16961 1 214 . 1 1 17 17 SER H H 1 7.76 0.02 . 1 . . . . 17 SER H . 16961 1 215 . 1 1 17 17 SER HA H 1 4.56 0.02 . 1 . . . . 17 SER HA . 16961 1 216 . 1 1 17 17 SER HB2 H 1 3.70 0.02 . 2 . . . . 17 SER HB2 . 16961 1 217 . 1 1 17 17 SER HB3 H 1 3.82 0.02 . 2 . . . . 17 SER HB3 . 16961 1 218 . 1 1 17 17 SER C C 13 172.2 0.2 . 1 . . . . 17 SER C . 16961 1 219 . 1 1 17 17 SER CA C 13 58.0 0.2 . 1 . . . . 17 SER CA . 16961 1 220 . 1 1 17 17 SER CB C 13 64.4 0.2 . 1 . . . . 17 SER CB . 16961 1 221 . 1 1 17 17 SER N N 15 109.4 0.2 . 1 . . . . 17 SER N . 16961 1 222 . 1 1 18 18 PHE H H 1 8.88 0.02 . 1 . . . . 18 PHE H . 16961 1 223 . 1 1 18 18 PHE HA H 1 4.89 0.02 . 1 . . . . 18 PHE HA . 16961 1 224 . 1 1 18 18 PHE HB2 H 1 2.91 0.02 . 2 . . . . 18 PHE HB2 . 16961 1 225 . 1 1 18 18 PHE HB3 H 1 2.91 0.02 . 2 . . . . 18 PHE HB3 . 16961 1 226 . 1 1 18 18 PHE HD1 H 1 7.03 0.02 . 3 . . . . 18 PHE HD1 . 16961 1 227 . 1 1 18 18 PHE HD2 H 1 7.03 0.02 . 3 . . . . 18 PHE HD2 . 16961 1 228 . 1 1 18 18 PHE HE1 H 1 7.14 0.02 . 3 . . . . 18 PHE HE1 . 16961 1 229 . 1 1 18 18 PHE HE2 H 1 7.14 0.02 . 3 . . . . 18 PHE HE2 . 16961 1 230 . 1 1 18 18 PHE HZ H 1 7.18 0.02 . 1 . . . . 18 PHE HZ . 16961 1 231 . 1 1 18 18 PHE CA C 13 57.8 0.2 . 1 . . . . 18 PHE CA . 16961 1 232 . 1 1 18 18 PHE CB C 13 41.8 0.2 . 1 . . . . 18 PHE CB . 16961 1 233 . 1 1 18 18 PHE CD1 C 13 131.8 0.2 . 3 . . . . 18 PHE CD1 . 16961 1 234 . 1 1 18 18 PHE CD2 C 13 131.8 0.2 . 3 . . . . 18 PHE CD2 . 16961 1 235 . 1 1 18 18 PHE CE1 C 13 129.4 0.2 . 3 . . . . 18 PHE CE1 . 16961 1 236 . 1 1 18 18 PHE CE2 C 13 129.4 0.2 . 3 . . . . 18 PHE CE2 . 16961 1 237 . 1 1 18 18 PHE CZ C 13 130.4 0.2 . 1 . . . . 18 PHE CZ . 16961 1 238 . 1 1 18 18 PHE N N 15 123.5 0.2 . 1 . . . . 18 PHE N . 16961 1 239 . 1 1 19 19 ASP H H 1 7.70 0.02 . 1 . . . . 19 ASP H . 16961 1 240 . 1 1 19 19 ASP HA H 1 4.31 0.02 . 1 . . . . 19 ASP HA . 16961 1 241 . 1 1 19 19 ASP HB2 H 1 2.76 0.02 . 2 . . . . 19 ASP HB2 . 16961 1 242 . 1 1 19 19 ASP HB3 H 1 2.76 0.02 . 2 . . . . 19 ASP HB3 . 16961 1 243 . 1 1 19 19 ASP CA C 13 52.3 0.2 . 1 . . . . 19 ASP CA . 16961 1 244 . 1 1 19 19 ASP CB C 13 43.9 0.2 . 1 . . . . 19 ASP CB . 16961 1 245 . 1 1 19 19 ASP N N 15 128.6 0.2 . 1 . . . . 19 ASP N . 16961 1 246 . 1 1 20 20 PRO HA H 1 4.63 0.02 . 1 . . . . 20 PRO HA . 16961 1 247 . 1 1 20 20 PRO HB2 H 1 1.95 0.02 . 2 . . . . 20 PRO HB2 . 16961 1 248 . 1 1 20 20 PRO HB3 H 1 2.4 0.02 . 2 . . . . 20 PRO HB3 . 16961 1 249 . 1 1 20 20 PRO HD2 H 1 3.55 0.02 . 2 . . . . 20 PRO HD2 . 16961 1 250 . 1 1 20 20 PRO HD3 H 1 3.62 0.02 . 2 . . . . 20 PRO HD3 . 16961 1 251 . 1 1 20 20 PRO HG2 H 1 1.97 0.02 . 2 . . . . 20 PRO HG2 . 16961 1 252 . 1 1 20 20 PRO HG3 H 1 2.07 0.02 . 2 . . . . 20 PRO HG3 . 16961 1 253 . 1 1 20 20 PRO C C 13 175.3 0.2 . 1 . . . . 20 PRO C . 16961 1 254 . 1 1 20 20 PRO CA C 13 64.5 0.2 . 1 . . . . 20 PRO CA . 16961 1 255 . 1 1 20 20 PRO CB C 13 32.6 0.2 . 1 . . . . 20 PRO CB . 16961 1 256 . 1 1 20 20 PRO CD C 13 50.8 0.2 . 1 . . . . 20 PRO CD . 16961 1 257 . 1 1 20 20 PRO CG C 13 28.1 0.2 . 1 . . . . 20 PRO CG . 16961 1 258 . 1 1 21 21 LYS H H 1 8.33 0.02 . 1 . . . . 21 LYS H . 16961 1 259 . 1 1 21 21 LYS HA H 1 4.94 0.02 . 1 . . . . 21 LYS HA . 16961 1 260 . 1 1 21 21 LYS HB2 H 1 1.66 0.02 . 2 . . . . 21 LYS HB2 . 16961 1 261 . 1 1 21 21 LYS HB3 H 1 2.04 0.02 . 2 . . . . 21 LYS HB3 . 16961 1 262 . 1 1 21 21 LYS HD2 H 1 1.73 0.02 . 2 . . . . 21 LYS HD2 . 16961 1 263 . 1 1 21 21 LYS HD3 H 1 1.73 0.02 . 2 . . . . 21 LYS HD3 . 16961 1 264 . 1 1 21 21 LYS HE2 H 1 3.04 0.02 . 2 . . . . 21 LYS HE2 . 16961 1 265 . 1 1 21 21 LYS HE3 H 1 3.04 0.02 . 2 . . . . 21 LYS HE3 . 16961 1 266 . 1 1 21 21 LYS HG2 H 1 1.48 0.02 . 2 . . . . 21 LYS HG2 . 16961 1 267 . 1 1 21 21 LYS HG3 H 1 1.60 0.02 . 2 . . . . 21 LYS HG3 . 16961 1 268 . 1 1 21 21 LYS C C 13 178.5 0.2 . 1 . . . . 21 LYS C . 16961 1 269 . 1 1 21 21 LYS CA C 13 54.9 0.2 . 1 . . . . 21 LYS CA . 16961 1 270 . 1 1 21 21 LYS CB C 13 33.8 0.2 . 1 . . . . 21 LYS CB . 16961 1 271 . 1 1 21 21 LYS CD C 13 29.3 0.2 . 1 . . . . 21 LYS CD . 16961 1 272 . 1 1 21 21 LYS CE C 13 41.9 0.2 . 1 . . . . 21 LYS CE . 16961 1 273 . 1 1 21 21 LYS CG C 13 25.2 0.2 . 1 . . . . 21 LYS CG . 16961 1 274 . 1 1 21 21 LYS N N 15 110.7 0.2 . 1 . . . . 21 LYS N . 16961 1 275 . 1 1 22 22 GLU H H 1 7.75 0.02 . 1 . . . . 22 GLU H . 16961 1 276 . 1 1 22 22 GLU HA H 1 5.17 0.02 . 1 . . . . 22 GLU HA . 16961 1 277 . 1 1 22 22 GLU HB2 H 1 1.68 0.02 . 2 . . . . 22 GLU HB2 . 16961 1 278 . 1 1 22 22 GLU HB3 H 1 2.01 0.02 . 2 . . . . 22 GLU HB3 . 16961 1 279 . 1 1 22 22 GLU HG2 H 1 1.82 0.02 . 2 . . . . 22 GLU HG2 . 16961 1 280 . 1 1 22 22 GLU HG3 H 1 2.02 0.02 . 2 . . . . 22 GLU HG3 . 16961 1 281 . 1 1 22 22 GLU C C 13 173.9 0.2 . 1 . . . . 22 GLU C . 16961 1 282 . 1 1 22 22 GLU CA C 13 56.4 0.2 . 1 . . . . 22 GLU CA . 16961 1 283 . 1 1 22 22 GLU CB C 13 31.7 0.2 . 1 . . . . 22 GLU CB . 16961 1 284 . 1 1 22 22 GLU CG C 13 35.6 0.2 . 1 . . . . 22 GLU CG . 16961 1 285 . 1 1 22 22 GLU N N 15 121.5 0.2 . 1 . . . . 22 GLU N . 16961 1 286 . 1 1 23 23 ILE H H 1 9.25 0.02 . 1 . . . . 23 ILE H . 16961 1 287 . 1 1 23 23 ILE HA H 1 4.63 0.02 . 1 . . . . 23 ILE HA . 16961 1 288 . 1 1 23 23 ILE HB H 1 1.59 0.02 . 1 . . . . 23 ILE HB . 16961 1 289 . 1 1 23 23 ILE HD11 H 1 0.77 0.02 . 1 . . . . 23 ILE HD1 . 16961 1 290 . 1 1 23 23 ILE HD12 H 1 0.77 0.02 . 1 . . . . 23 ILE HD1 . 16961 1 291 . 1 1 23 23 ILE HD13 H 1 0.77 0.02 . 1 . . . . 23 ILE HD1 . 16961 1 292 . 1 1 23 23 ILE HG12 H 1 1.11 0.02 . 2 . . . . 23 ILE HG12 . 16961 1 293 . 1 1 23 23 ILE HG13 H 1 1.82 0.02 . 2 . . . . 23 ILE HG13 . 16961 1 294 . 1 1 23 23 ILE HG21 H 1 0.93 0.02 . 1 . . . . 23 ILE HG2 . 16961 1 295 . 1 1 23 23 ILE HG22 H 1 0.93 0.02 . 1 . . . . 23 ILE HG2 . 16961 1 296 . 1 1 23 23 ILE HG23 H 1 0.93 0.02 . 1 . . . . 23 ILE HG2 . 16961 1 297 . 1 1 23 23 ILE C C 13 174.1 0.2 . 1 . . . . 23 ILE C . 16961 1 298 . 1 1 23 23 ILE CA C 13 59.9 0.2 . 1 . . . . 23 ILE CA . 16961 1 299 . 1 1 23 23 ILE CB C 13 41.7 0.2 . 1 . . . . 23 ILE CB . 16961 1 300 . 1 1 23 23 ILE CD1 C 13 15.4 0.2 . 1 . . . . 23 ILE CD1 . 16961 1 301 . 1 1 23 23 ILE CG1 C 13 28.2 0.2 . 1 . . . . 23 ILE CG1 . 16961 1 302 . 1 1 23 23 ILE CG2 C 13 17.4 0.2 . 1 . . . . 23 ILE CG2 . 16961 1 303 . 1 1 23 23 ILE N N 15 128.6 0.2 . 1 . . . . 23 ILE N . 16961 1 304 . 1 1 24 24 LEU H H 1 8.47 0.02 . 1 . . . . 24 LEU H . 16961 1 305 . 1 1 24 24 LEU HA H 1 5.5 0.02 . 1 . . . . 24 LEU HA . 16961 1 306 . 1 1 24 24 LEU HB2 H 1 1.14 0.02 . 2 . . . . 24 LEU HB2 . 16961 1 307 . 1 1 24 24 LEU HB3 H 1 1.80 0.02 . 2 . . . . 24 LEU HB3 . 16961 1 308 . 1 1 24 24 LEU HD11 H 1 0.81 0.02 . 2 . . . . 24 LEU HD1 . 16961 1 309 . 1 1 24 24 LEU HD12 H 1 0.81 0.02 . 2 . . . . 24 LEU HD1 . 16961 1 310 . 1 1 24 24 LEU HD13 H 1 0.81 0.02 . 2 . . . . 24 LEU HD1 . 16961 1 311 . 1 1 24 24 LEU HD21 H 1 0.86 0.02 . 2 . . . . 24 LEU HD2 . 16961 1 312 . 1 1 24 24 LEU HD22 H 1 0.86 0.02 . 2 . . . . 24 LEU HD2 . 16961 1 313 . 1 1 24 24 LEU HD23 H 1 0.86 0.02 . 2 . . . . 24 LEU HD2 . 16961 1 314 . 1 1 24 24 LEU HG H 1 1.51 0.02 . 1 . . . . 24 LEU HG . 16961 1 315 . 1 1 24 24 LEU C C 13 176.3 0.2 . 1 . . . . 24 LEU C . 16961 1 316 . 1 1 24 24 LEU CA C 13 53 0.2 . 1 . . . . 24 LEU CA . 16961 1 317 . 1 1 24 24 LEU CB C 13 44 0.2 . 1 . . . . 24 LEU CB . 16961 1 318 . 1 1 24 24 LEU CD1 C 13 25.2 0.2 . 2 . . . . 24 LEU CD1 . 16961 1 319 . 1 1 24 24 LEU CD2 C 13 23.9 0.2 . 2 . . . . 24 LEU CD2 . 16961 1 320 . 1 1 24 24 LEU CG C 13 27.1 0.2 . 1 . . . . 24 LEU CG . 16961 1 321 . 1 1 24 24 LEU N N 15 125.3 0.2 . 1 . . . . 24 LEU N . 16961 1 322 . 1 1 25 25 LEU H H 1 9.34 0.02 . 1 . . . . 25 LEU H . 16961 1 323 . 1 1 25 25 LEU HA H 1 5 0.02 . 1 . . . . 25 LEU HA . 16961 1 324 . 1 1 25 25 LEU HB2 H 1 1.34 0.02 . 2 . . . . 25 LEU HB2 . 16961 1 325 . 1 1 25 25 LEU HB3 H 1 1.84 0.02 . 2 . . . . 25 LEU HB3 . 16961 1 326 . 1 1 25 25 LEU HD11 H 1 0.76 0.02 . 2 . . . . 25 LEU HD1 . 16961 1 327 . 1 1 25 25 LEU HD12 H 1 0.76 0.02 . 2 . . . . 25 LEU HD1 . 16961 1 328 . 1 1 25 25 LEU HD13 H 1 0.76 0.02 . 2 . . . . 25 LEU HD1 . 16961 1 329 . 1 1 25 25 LEU HD21 H 1 0.86 0.02 . 2 . . . . 25 LEU HD2 . 16961 1 330 . 1 1 25 25 LEU HD22 H 1 0.86 0.02 . 2 . . . . 25 LEU HD2 . 16961 1 331 . 1 1 25 25 LEU HD23 H 1 0.86 0.02 . 2 . . . . 25 LEU HD2 . 16961 1 332 . 1 1 25 25 LEU HG H 1 1.12 0.02 . 1 . . . . 25 LEU HG . 16961 1 333 . 1 1 25 25 LEU C C 13 174.8 0.2 . 1 . . . . 25 LEU C . 16961 1 334 . 1 1 25 25 LEU CA C 13 52.7 0.2 . 1 . . . . 25 LEU CA . 16961 1 335 . 1 1 25 25 LEU CB C 13 44.5 0.2 . 1 . . . . 25 LEU CB . 16961 1 336 . 1 1 25 25 LEU CD1 C 13 26.2 0.2 . 2 . . . . 25 LEU CD1 . 16961 1 337 . 1 1 25 25 LEU CD2 C 13 25.4 0.2 . 2 . . . . 25 LEU CD2 . 16961 1 338 . 1 1 25 25 LEU CG C 13 26.4 0.2 . 1 . . . . 25 LEU CG . 16961 1 339 . 1 1 25 25 LEU N N 15 122.4 0.2 . 1 . . . . 25 LEU N . 16961 1 340 . 1 1 26 26 GLU H H 1 9.03 0.02 . 1 . . . . 26 GLU H . 16961 1 341 . 1 1 26 26 GLU HA H 1 4.65 0.02 . 1 . . . . 26 GLU HA . 16961 1 342 . 1 1 26 26 GLU HB2 H 1 1.91 0.02 . 2 . . . . 26 GLU HB2 . 16961 1 343 . 1 1 26 26 GLU HB3 H 1 2.15 0.02 . 2 . . . . 26 GLU HB3 . 16961 1 344 . 1 1 26 26 GLU HG2 H 1 2.23 0.02 . 2 . . . . 26 GLU HG2 . 16961 1 345 . 1 1 26 26 GLU HG3 H 1 2.23 0.02 . 2 . . . . 26 GLU HG3 . 16961 1 346 . 1 1 26 26 GLU C C 13 174.7 0.2 . 1 . . . . 26 GLU C . 16961 1 347 . 1 1 26 26 GLU CA C 13 56.4 0.2 . 1 . . . . 26 GLU CA . 16961 1 348 . 1 1 26 26 GLU CB C 13 30.7 0.2 . 1 . . . . 26 GLU CB . 16961 1 349 . 1 1 26 26 GLU CG C 13 35.7 0.2 . 1 . . . . 26 GLU CG . 16961 1 350 . 1 1 26 26 GLU N N 15 122.4 0.2 . 1 . . . . 26 GLU N . 16961 1 351 . 1 1 27 27 THR H H 1 8.93 0.02 . 1 . . . . 27 THR H . 16961 1 352 . 1 1 27 27 THR HA H 1 5.15 0.02 . 1 . . . . 27 THR HA . 16961 1 353 . 1 1 27 27 THR HB H 1 4.21 0.02 . 1 . . . . 27 THR HB . 16961 1 354 . 1 1 27 27 THR HG1 H 1 5.73 0.02 . 1 . . . . 27 THR HG1 . 16961 1 355 . 1 1 27 27 THR HG21 H 1 1.16 0.02 . 1 . . . . 27 THR HG2 . 16961 1 356 . 1 1 27 27 THR HG22 H 1 1.16 0.02 . 1 . . . . 27 THR HG2 . 16961 1 357 . 1 1 27 27 THR HG23 H 1 1.16 0.02 . 1 . . . . 27 THR HG2 . 16961 1 358 . 1 1 27 27 THR C C 13 175.5 0.2 . 1 . . . . 27 THR C . 16961 1 359 . 1 1 27 27 THR CA C 13 59.2 0.2 . 1 . . . . 27 THR CA . 16961 1 360 . 1 1 27 27 THR CB C 13 70.2 0.2 . 1 . . . . 27 THR CB . 16961 1 361 . 1 1 27 27 THR CG2 C 13 18.9 0.2 . 1 . . . . 27 THR CG2 . 16961 1 362 . 1 1 27 27 THR N N 15 121 0.2 . 1 . . . . 27 THR N . 16961 1 363 . 1 1 28 28 ILE H H 1 8.68 0.02 . 1 . . . . 28 ILE H . 16961 1 364 . 1 1 28 28 ILE HA H 1 3.77 0.02 . 1 . . . . 28 ILE HA . 16961 1 365 . 1 1 28 28 ILE HB H 1 2.06 0.02 . 1 . . . . 28 ILE HB . 16961 1 366 . 1 1 28 28 ILE HD11 H 1 0.92 0.02 . 1 . . . . 28 ILE HD1 . 16961 1 367 . 1 1 28 28 ILE HD12 H 1 0.92 0.02 . 1 . . . . 28 ILE HD1 . 16961 1 368 . 1 1 28 28 ILE HD13 H 1 0.92 0.02 . 1 . . . . 28 ILE HD1 . 16961 1 369 . 1 1 28 28 ILE HG12 H 1 1.36 0.02 . 2 . . . . 28 ILE HG12 . 16961 1 370 . 1 1 28 28 ILE HG13 H 1 1.68 0.02 . 2 . . . . 28 ILE HG13 . 16961 1 371 . 1 1 28 28 ILE HG21 H 1 0.96 0.02 . 1 . . . . 28 ILE HG2 . 16961 1 372 . 1 1 28 28 ILE HG22 H 1 0.96 0.02 . 1 . . . . 28 ILE HG2 . 16961 1 373 . 1 1 28 28 ILE HG23 H 1 0.96 0.02 . 1 . . . . 28 ILE HG2 . 16961 1 374 . 1 1 28 28 ILE C C 13 177.9 0.2 . 1 . . . . 28 ILE C . 16961 1 375 . 1 1 28 28 ILE CA C 13 65.5 0.2 . 1 . . . . 28 ILE CA . 16961 1 376 . 1 1 28 28 ILE CB C 13 38.2 0.2 . 1 . . . . 28 ILE CB . 16961 1 377 . 1 1 28 28 ILE CD1 C 13 12.5 0.2 . 1 . . . . 28 ILE CD1 . 16961 1 378 . 1 1 28 28 ILE CG1 C 13 28.6 0.2 . 1 . . . . 28 ILE CG1 . 16961 1 379 . 1 1 28 28 ILE CG2 C 13 17.2 0.2 . 1 . . . . 28 ILE CG2 . 16961 1 380 . 1 1 28 28 ILE N N 15 120.9 0.2 . 1 . . . . 28 ILE N . 16961 1 381 . 1 1 29 29 GLN H H 1 8.49 0.02 . 1 . . . . 29 GLN H . 16961 1 382 . 1 1 29 29 GLN HA H 1 4.71 0.02 . 1 . . . . 29 GLN HA . 16961 1 383 . 1 1 29 29 GLN HB2 H 1 1.60 0.02 . 2 . . . . 29 GLN HB2 . 16961 1 384 . 1 1 29 29 GLN HB3 H 1 2.35 0.02 . 2 . . . . 29 GLN HB3 . 16961 1 385 . 1 1 29 29 GLN HE21 H 1 7.3 0.02 . 2 . . . . 29 GLN HE21 . 16961 1 386 . 1 1 29 29 GLN HE22 H 1 6.98 0.02 . 2 . . . . 29 GLN HE22 . 16961 1 387 . 1 1 29 29 GLN HG2 H 1 2.36 0.02 . 2 . . . . 29 GLN HG2 . 16961 1 388 . 1 1 29 29 GLN HG3 H 1 2.5 0.02 . 2 . . . . 29 GLN HG3 . 16961 1 389 . 1 1 29 29 GLN C C 13 175.1 0.2 . 1 . . . . 29 GLN C . 16961 1 390 . 1 1 29 29 GLN CA C 13 54.7 0.2 . 1 . . . . 29 GLN CA . 16961 1 391 . 1 1 29 29 GLN CB C 13 28.4 0.2 . 1 . . . . 29 GLN CB . 16961 1 392 . 1 1 29 29 GLN CD C 13 179.6 0.2 . 1 . . . . 29 GLN CD . 16961 1 393 . 1 1 29 29 GLN CG C 13 33 0.2 . 1 . . . . 29 GLN CG . 16961 1 394 . 1 1 29 29 GLN N N 15 113 0.2 . 1 . . . . 29 GLN N . 16961 1 395 . 1 1 29 29 GLN NE2 N 15 112 0.2 . 1 . . . . 29 GLN NE2 . 16961 1 396 . 1 1 30 30 GLY H H 1 7.58 0.02 . 1 . . . . 30 GLY H . 16961 1 397 . 1 1 30 30 GLY HA2 H 1 3.86 0.02 . 2 . . . . 30 GLY HA2 . 16961 1 398 . 1 1 30 30 GLY HA3 H 1 4.49 0.02 . 2 . . . . 30 GLY HA3 . 16961 1 399 . 1 1 30 30 GLY C C 13 171.8 0.2 . 1 . . . . 30 GLY C . 16961 1 400 . 1 1 30 30 GLY CA C 13 44.7 0.2 . 1 . . . . 30 GLY CA . 16961 1 401 . 1 1 30 30 GLY N N 15 106.2 0.2 . 1 . . . . 30 GLY N . 16961 1 402 . 1 1 31 31 VAL H H 1 9.13 0.02 . 1 . . . . 31 VAL H . 16961 1 403 . 1 1 31 31 VAL HA H 1 4.83 0.02 . 1 . . . . 31 VAL HA . 16961 1 404 . 1 1 31 31 VAL HB H 1 1.99 0.02 . 1 . . . . 31 VAL HB . 16961 1 405 . 1 1 31 31 VAL HG11 H 1 0.85 0.02 . 2 . . . . 31 VAL HG1 . 16961 1 406 . 1 1 31 31 VAL HG12 H 1 0.85 0.02 . 2 . . . . 31 VAL HG1 . 16961 1 407 . 1 1 31 31 VAL HG13 H 1 0.85 0.02 . 2 . . . . 31 VAL HG1 . 16961 1 408 . 1 1 31 31 VAL HG21 H 1 1 0.02 . 2 . . . . 31 VAL HG2 . 16961 1 409 . 1 1 31 31 VAL HG22 H 1 1 0.02 . 2 . . . . 31 VAL HG2 . 16961 1 410 . 1 1 31 31 VAL HG23 H 1 1 0.02 . 2 . . . . 31 VAL HG2 . 16961 1 411 . 1 1 31 31 VAL C C 13 175 0.2 . 1 . . . . 31 VAL C . 16961 1 412 . 1 1 31 31 VAL CA C 13 61.9 0.2 . 1 . . . . 31 VAL CA . 16961 1 413 . 1 1 31 31 VAL CB C 13 33.8 0.2 . 1 . . . . 31 VAL CB . 16961 1 414 . 1 1 31 31 VAL CG1 C 13 22.7 0.2 . 2 . . . . 31 VAL CG1 . 16961 1 415 . 1 1 31 31 VAL CG2 C 13 22.8 0.2 . 2 . . . . 31 VAL CG2 . 16961 1 416 . 1 1 31 31 VAL N N 15 124.2 0.2 . 1 . . . . 31 VAL N . 16961 1 417 . 1 1 32 32 LEU H H 1 9.46 0.02 . 1 . . . . 32 LEU H . 16961 1 418 . 1 1 32 32 LEU HA H 1 5.22 0.02 . 1 . . . . 32 LEU HA . 16961 1 419 . 1 1 32 32 LEU HB2 H 1 1.19 0.02 . 2 . . . . 32 LEU HB2 . 16961 1 420 . 1 1 32 32 LEU HB3 H 1 1.59 0.02 . 2 . . . . 32 LEU HB3 . 16961 1 421 . 1 1 32 32 LEU HD11 H 1 0.60 0.02 . 2 . . . . 32 LEU HD1 . 16961 1 422 . 1 1 32 32 LEU HD12 H 1 0.60 0.02 . 2 . . . . 32 LEU HD1 . 16961 1 423 . 1 1 32 32 LEU HD13 H 1 0.60 0.02 . 2 . . . . 32 LEU HD1 . 16961 1 424 . 1 1 32 32 LEU HD21 H 1 0.57 0.02 . 2 . . . . 32 LEU HD2 . 16961 1 425 . 1 1 32 32 LEU HD22 H 1 0.57 0.02 . 2 . . . . 32 LEU HD2 . 16961 1 426 . 1 1 32 32 LEU HD23 H 1 0.57 0.02 . 2 . . . . 32 LEU HD2 . 16961 1 427 . 1 1 32 32 LEU HG H 1 1.44 0.02 . 1 . . . . 32 LEU HG . 16961 1 428 . 1 1 32 32 LEU C C 13 174.3 0.2 . 1 . . . . 32 LEU C . 16961 1 429 . 1 1 32 32 LEU CA C 13 53.5 0.2 . 1 . . . . 32 LEU CA . 16961 1 430 . 1 1 32 32 LEU CB C 13 44.4 0.2 . 1 . . . . 32 LEU CB . 16961 1 431 . 1 1 32 32 LEU CD1 C 13 25.2 0.2 . 2 . . . . 32 LEU CD1 . 16961 1 432 . 1 1 32 32 LEU CD2 C 13 26.5 0.2 . 2 . . . . 32 LEU CD2 . 16961 1 433 . 1 1 32 32 LEU CG C 13 27.6 0.2 . 1 . . . . 32 LEU CG . 16961 1 434 . 1 1 32 32 LEU N N 15 130.5 0.2 . 1 . . . . 32 LEU N . 16961 1 435 . 1 1 33 33 SER H H 1 9.06 0.02 . 1 . . . . 33 SER H . 16961 1 436 . 1 1 33 33 SER HA H 1 5.31 0.02 . 1 . . . . 33 SER HA . 16961 1 437 . 1 1 33 33 SER HB2 H 1 3.75 0.02 . 2 . . . . 33 SER HB2 . 16961 1 438 . 1 1 33 33 SER HB3 H 1 3.75 0.02 . 2 . . . . 33 SER HB3 . 16961 1 439 . 1 1 33 33 SER C C 13 173.6 0.2 . 1 . . . . 33 SER C . 16961 1 440 . 1 1 33 33 SER CA C 13 56.1 0.2 . 1 . . . . 33 SER CA . 16961 1 441 . 1 1 33 33 SER CB C 13 64.3 0.2 . 1 . . . . 33 SER CB . 16961 1 442 . 1 1 33 33 SER N N 15 120.9 0.2 . 1 . . . . 33 SER N . 16961 1 443 . 1 1 34 34 ILE H H 1 8.98 0.02 . 1 . . . . 34 ILE H . 16961 1 444 . 1 1 34 34 ILE HA H 1 4.64 0.02 . 1 . . . . 34 ILE HA . 16961 1 445 . 1 1 34 34 ILE HB H 1 1.81 0.02 . 1 . . . . 34 ILE HB . 16961 1 446 . 1 1 34 34 ILE HD11 H 1 0.73 0.02 . 1 . . . . 34 ILE HD1 . 16961 1 447 . 1 1 34 34 ILE HD12 H 1 0.73 0.02 . 1 . . . . 34 ILE HD1 . 16961 1 448 . 1 1 34 34 ILE HD13 H 1 0.73 0.02 . 1 . . . . 34 ILE HD1 . 16961 1 449 . 1 1 34 34 ILE HG12 H 1 1.56 0.02 . 2 . . . . 34 ILE HG12 . 16961 1 450 . 1 1 34 34 ILE HG13 H 1 1.66 0.02 . 2 . . . . 34 ILE HG13 . 16961 1 451 . 1 1 34 34 ILE HG21 H 1 0.79 0.02 . 1 . . . . 34 ILE HG2 . 16961 1 452 . 1 1 34 34 ILE HG22 H 1 0.79 0.02 . 1 . . . . 34 ILE HG2 . 16961 1 453 . 1 1 34 34 ILE HG23 H 1 0.79 0.02 . 1 . . . . 34 ILE HG2 . 16961 1 454 . 1 1 34 34 ILE C C 13 174.2 0.2 . 1 . . . . 34 ILE C . 16961 1 455 . 1 1 34 34 ILE CA C 13 60.4 0.2 . 1 . . . . 34 ILE CA . 16961 1 456 . 1 1 34 34 ILE CB C 13 40 0.2 . 1 . . . . 34 ILE CB . 16961 1 457 . 1 1 34 34 ILE CD1 C 13 15.6 0.2 . 1 . . . . 34 ILE CD1 . 16961 1 458 . 1 1 34 34 ILE CG1 C 13 26.9 0.2 . 1 . . . . 34 ILE CG1 . 16961 1 459 . 1 1 34 34 ILE CG2 C 13 18.2 0.2 . 1 . . . . 34 ILE CG2 . 16961 1 460 . 1 1 34 34 ILE N N 15 128.6 0.2 . 1 . . . . 34 ILE N . 16961 1 461 . 1 1 35 35 LYS H H 1 8.66 0.02 . 1 . . . . 35 LYS H . 16961 1 462 . 1 1 35 35 LYS HA H 1 5.2 0.02 . 1 . . . . 35 LYS HA . 16961 1 463 . 1 1 35 35 LYS HB2 H 1 1.62 0.02 . 2 . . . . 35 LYS HB2 . 16961 1 464 . 1 1 35 35 LYS HB3 H 1 1.97 0.02 . 2 . . . . 35 LYS HB3 . 16961 1 465 . 1 1 35 35 LYS HD2 H 1 1.61 0.02 . 2 . . . . 35 LYS HD2 . 16961 1 466 . 1 1 35 35 LYS HD3 H 1 1.61 0.02 . 2 . . . . 35 LYS HD3 . 16961 1 467 . 1 1 35 35 LYS HE2 H 1 2.91 0.02 . 2 . . . . 35 LYS HE2 . 16961 1 468 . 1 1 35 35 LYS HE3 H 1 2.91 0.02 . 2 . . . . 35 LYS HE3 . 16961 1 469 . 1 1 35 35 LYS HG2 H 1 1.34 0.02 . 2 . . . . 35 LYS HG2 . 16961 1 470 . 1 1 35 35 LYS HG3 H 1 1.56 0.02 . 2 . . . . 35 LYS HG3 . 16961 1 471 . 1 1 35 35 LYS C C 13 177 0.2 . 1 . . . . 35 LYS C . 16961 1 472 . 1 1 35 35 LYS CA C 13 54.3 0.2 . 1 . . . . 35 LYS CA . 16961 1 473 . 1 1 35 35 LYS CB C 13 36.4 0.2 . 1 . . . . 35 LYS CB . 16961 1 474 . 1 1 35 35 LYS CD C 13 29.4 0.2 . 1 . . . . 35 LYS CD . 16961 1 475 . 1 1 35 35 LYS CE C 13 42 0.2 . 1 . . . . 35 LYS CE . 16961 1 476 . 1 1 35 35 LYS CG C 13 25.4 0.2 . 1 . . . . 35 LYS CG . 16961 1 477 . 1 1 35 35 LYS N N 15 124.4 0.2 . 1 . . . . 35 LYS N . 16961 1 478 . 1 1 36 36 GLY H H 1 8.23 0.02 . 1 . . . . 36 GLY H . 16961 1 479 . 1 1 36 36 GLY HA2 H 1 3.92 0.02 . 2 . . . . 36 GLY HA2 . 16961 1 480 . 1 1 36 36 GLY HA3 H 1 4.89 0.02 . 2 . . . . 36 GLY HA3 . 16961 1 481 . 1 1 36 36 GLY C C 13 171 0.2 . 1 . . . . 36 GLY C . 16961 1 482 . 1 1 36 36 GLY CA C 13 46.5 0.2 . 1 . . . . 36 GLY CA . 16961 1 483 . 1 1 36 36 GLY N N 15 111.7 0.2 . 1 . . . . 36 GLY N . 16961 1 484 . 1 1 37 37 GLU H H 1 8.97 0.02 . 1 . . . . 37 GLU H . 16961 1 485 . 1 1 37 37 GLU HA H 1 4.83 0.02 . 1 . . . . 37 GLU HA . 16961 1 486 . 1 1 37 37 GLU HB2 H 1 1.91 0.02 . 2 . . . . 37 GLU HB2 . 16961 1 487 . 1 1 37 37 GLU HB3 H 1 2.09 0.02 . 2 . . . . 37 GLU HB3 . 16961 1 488 . 1 1 37 37 GLU HG2 H 1 2.3 0.02 . 2 . . . . 37 GLU HG2 . 16961 1 489 . 1 1 37 37 GLU HG3 H 1 2.3 0.02 . 2 . . . . 37 GLU HG3 . 16961 1 490 . 1 1 37 37 GLU C C 13 174 0.2 . 1 . . . . 37 GLU C . 16961 1 491 . 1 1 37 37 GLU CA C 13 54.7 0.2 . 1 . . . . 37 GLU CA . 16961 1 492 . 1 1 37 37 GLU CB C 13 34.0 0.2 . 1 . . . . 37 GLU CB . 16961 1 493 . 1 1 37 37 GLU CG C 13 35.6 0.2 . 1 . . . . 37 GLU CG . 16961 1 494 . 1 1 37 37 GLU N N 15 121.2 0.2 . 1 . . . . 37 GLU N . 16961 1 495 . 1 1 38 38 LYS H H 1 8.87 0.02 . 1 . . . . 38 LYS H . 16961 1 496 . 1 1 38 38 LYS HA H 1 3.79 0.02 . 1 . . . . 38 LYS HA . 16961 1 497 . 1 1 38 38 LYS HB2 H 1 1.88 0.02 . 2 . . . . 38 LYS HB2 . 16961 1 498 . 1 1 38 38 LYS HB3 H 1 1.94 0.02 . 2 . . . . 38 LYS HB3 . 16961 1 499 . 1 1 38 38 LYS HD2 H 1 1.58 0.02 . 2 . . . . 38 LYS HD2 . 16961 1 500 . 1 1 38 38 LYS HD3 H 1 1.7 0.02 . 2 . . . . 38 LYS HD3 . 16961 1 501 . 1 1 38 38 LYS HE2 H 1 2.95 0.02 . 2 . . . . 38 LYS HE2 . 16961 1 502 . 1 1 38 38 LYS HE3 H 1 2.95 0.02 . 2 . . . . 38 LYS HE3 . 16961 1 503 . 1 1 38 38 LYS HG2 H 1 1.37 0.02 . 2 . . . . 38 LYS HG2 . 16961 1 504 . 1 1 38 38 LYS HG3 H 1 1.37 0.02 . 2 . . . . 38 LYS HG3 . 16961 1 505 . 1 1 38 38 LYS C C 13 175.5 0.2 . 1 . . . . 38 LYS C . 16961 1 506 . 1 1 38 38 LYS CA C 13 56.8 0.2 . 1 . . . . 38 LYS CA . 16961 1 507 . 1 1 38 38 LYS CB C 13 29.9 0.2 . 1 . . . . 38 LYS CB . 16961 1 508 . 1 1 38 38 LYS CD C 13 29.6 0.2 . 1 . . . . 38 LYS CD . 16961 1 509 . 1 1 38 38 LYS CE C 13 42.3 0.2 . 1 . . . . 38 LYS CE . 16961 1 510 . 1 1 38 38 LYS CG C 13 25.6 0.2 . 1 . . . . 38 LYS CG . 16961 1 511 . 1 1 38 38 LYS N N 15 116.9 0.2 . 1 . . . . 38 LYS N . 16961 1 512 . 1 1 39 39 LEU H H 1 9.4 0.02 . 1 . . . . 39 LEU H . 16961 1 513 . 1 1 39 39 LEU HA H 1 4.83 0.02 . 1 . . . . 39 LEU HA . 16961 1 514 . 1 1 39 39 LEU HB2 H 1 1 0.02 . 2 . . . . 39 LEU HB2 . 16961 1 515 . 1 1 39 39 LEU HB3 H 1 1.80 0.02 . 2 . . . . 39 LEU HB3 . 16961 1 516 . 1 1 39 39 LEU HD11 H 1 0.43 0.02 . 2 . . . . 39 LEU HD1 . 16961 1 517 . 1 1 39 39 LEU HD12 H 1 0.43 0.02 . 2 . . . . 39 LEU HD1 . 16961 1 518 . 1 1 39 39 LEU HD13 H 1 0.43 0.02 . 2 . . . . 39 LEU HD1 . 16961 1 519 . 1 1 39 39 LEU HD21 H 1 0.44 0.02 . 2 . . . . 39 LEU HD2 . 16961 1 520 . 1 1 39 39 LEU HD22 H 1 0.44 0.02 . 2 . . . . 39 LEU HD2 . 16961 1 521 . 1 1 39 39 LEU HD23 H 1 0.44 0.02 . 2 . . . . 39 LEU HD2 . 16961 1 522 . 1 1 39 39 LEU HG H 1 1.5 0.02 . 1 . . . . 39 LEU HG . 16961 1 523 . 1 1 39 39 LEU C C 13 178.5 0.2 . 1 . . . . 39 LEU C . 16961 1 524 . 1 1 39 39 LEU CA C 13 55.3 0.2 . 1 . . . . 39 LEU CA . 16961 1 525 . 1 1 39 39 LEU CB C 13 42.8 0.2 . 1 . . . . 39 LEU CB . 16961 1 526 . 1 1 39 39 LEU CD1 C 13 23.1 0.2 . 2 . . . . 39 LEU CD1 . 16961 1 527 . 1 1 39 39 LEU CD2 C 13 26.4 0.2 . 2 . . . . 39 LEU CD2 . 16961 1 528 . 1 1 39 39 LEU CG C 13 26.3 0.2 . 1 . . . . 39 LEU CG . 16961 1 529 . 1 1 39 39 LEU N N 15 118.3 0.2 . 1 . . . . 39 LEU N . 16961 1 530 . 1 1 40 40 GLY H H 1 8.84 0.02 . 1 . . . . 40 GLY H . 16961 1 531 . 1 1 40 40 GLY HA2 H 1 3.77 0.02 . 2 . . . . 40 GLY HA2 . 16961 1 532 . 1 1 40 40 GLY HA3 H 1 4.50 0.02 . 2 . . . . 40 GLY HA3 . 16961 1 533 . 1 1 40 40 GLY CA C 13 44.3 0.2 . 1 . . . . 40 GLY CA . 16961 1 534 . 1 1 40 40 GLY N N 15 106.7 0.2 . 1 . . . . 40 GLY N . 16961 1 535 . 1 1 46 46 LEU H H 1 9.07 0.02 . 1 . . . . 46 LEU H . 16961 1 536 . 1 1 46 46 LEU HA H 1 4.05 0.02 . 1 . . . . 46 LEU HA . 16961 1 537 . 1 1 46 46 LEU HB2 H 1 1.59 0.02 . 2 . . . . 46 LEU HB2 . 16961 1 538 . 1 1 46 46 LEU HB3 H 1 1.78 0.02 . 2 . . . . 46 LEU HB3 . 16961 1 539 . 1 1 46 46 LEU HD11 H 1 0.94 0.02 . 2 . . . . 46 LEU HD1 . 16961 1 540 . 1 1 46 46 LEU HD12 H 1 0.94 0.02 . 2 . . . . 46 LEU HD1 . 16961 1 541 . 1 1 46 46 LEU HD13 H 1 0.94 0.02 . 2 . . . . 46 LEU HD1 . 16961 1 542 . 1 1 46 46 LEU HD21 H 1 0.66 0.02 . 2 . . . . 46 LEU HD2 . 16961 1 543 . 1 1 46 46 LEU HD22 H 1 0.66 0.02 . 2 . . . . 46 LEU HD2 . 16961 1 544 . 1 1 46 46 LEU HD23 H 1 0.66 0.02 . 2 . . . . 46 LEU HD2 . 16961 1 545 . 1 1 46 46 LEU HG H 1 1.60 0.02 . 1 . . . . 46 LEU HG . 16961 1 546 . 1 1 46 46 LEU C C 13 179.1 0.2 . 1 . . . . 46 LEU C . 16961 1 547 . 1 1 46 46 LEU CA C 13 57.1 0.2 . 1 . . . . 46 LEU CA . 16961 1 548 . 1 1 46 46 LEU CB C 13 41 0.2 . 1 . . . . 46 LEU CB . 16961 1 549 . 1 1 46 46 LEU CD1 C 13 25.4 0.2 . 2 . . . . 46 LEU CD1 . 16961 1 550 . 1 1 46 46 LEU CD2 C 13 22.5 0.2 . 2 . . . . 46 LEU CD2 . 16961 1 551 . 1 1 46 46 LEU CG C 13 27.1 0.2 . 1 . . . . 46 LEU CG . 16961 1 552 . 1 1 46 46 LEU N N 15 125.4 0.2 . 1 . . . . 46 LEU N . 16961 1 553 . 1 1 47 47 LYS H H 1 8.28 0.02 . 1 . . . . 47 LYS H . 16961 1 554 . 1 1 47 47 LYS HA H 1 4.14 0.02 . 1 . . . . 47 LYS HA . 16961 1 555 . 1 1 47 47 LYS HB2 H 1 1.94 0.02 . 2 . . . . 47 LYS HB2 . 16961 1 556 . 1 1 47 47 LYS HB3 H 1 1.94 0.02 . 2 . . . . 47 LYS HB3 . 16961 1 557 . 1 1 47 47 LYS HD2 H 1 1.7 0.02 . 2 . . . . 47 LYS HD2 . 16961 1 558 . 1 1 47 47 LYS HD3 H 1 1.7 0.02 . 2 . . . . 47 LYS HD3 . 16961 1 559 . 1 1 47 47 LYS HE2 H 1 2.98 0.02 . 2 . . . . 47 LYS HE2 . 16961 1 560 . 1 1 47 47 LYS HE3 H 1 2.98 0.02 . 2 . . . . 47 LYS HE3 . 16961 1 561 . 1 1 47 47 LYS HG2 H 1 1.43 0.02 . 2 . . . . 47 LYS HG2 . 16961 1 562 . 1 1 47 47 LYS HG3 H 1 1.49 0.02 . 2 . . . . 47 LYS HG3 . 16961 1 563 . 1 1 47 47 LYS C C 13 178.1 0.2 . 1 . . . . 47 LYS C . 16961 1 564 . 1 1 47 47 LYS CA C 13 59.1 0.2 . 1 . . . . 47 LYS CA . 16961 1 565 . 1 1 47 47 LYS CB C 13 31.4 0.2 . 1 . . . . 47 LYS CB . 16961 1 566 . 1 1 47 47 LYS CD C 13 29 0.2 . 1 . . . . 47 LYS CD . 16961 1 567 . 1 1 47 47 LYS CE C 13 42.1 0.2 . 1 . . . . 47 LYS CE . 16961 1 568 . 1 1 47 47 LYS CG C 13 25.1 0.2 . 1 . . . . 47 LYS CG . 16961 1 569 . 1 1 47 47 LYS N N 15 121.7 0.2 . 1 . . . . 47 LYS N . 16961 1 570 . 1 1 48 48 ALA H H 1 7.51 0.02 . 1 . . . . 48 ALA H . 16961 1 571 . 1 1 48 48 ALA HA H 1 4.38 0.02 . 1 . . . . 48 ALA HA . 16961 1 572 . 1 1 48 48 ALA HB1 H 1 1.34 0.02 . 1 . . . . 48 ALA HB . 16961 1 573 . 1 1 48 48 ALA HB2 H 1 1.34 0.02 . 1 . . . . 48 ALA HB . 16961 1 574 . 1 1 48 48 ALA HB3 H 1 1.34 0.02 . 1 . . . . 48 ALA HB . 16961 1 575 . 1 1 48 48 ALA C C 13 178.3 0.2 . 1 . . . . 48 ALA C . 16961 1 576 . 1 1 48 48 ALA CA C 13 51.6 0.2 . 1 . . . . 48 ALA CA . 16961 1 577 . 1 1 48 48 ALA CB C 13 19.5 0.2 . 1 . . . . 48 ALA CB . 16961 1 578 . 1 1 48 48 ALA N N 15 119.3 0.2 . 1 . . . . 48 ALA N . 16961 1 579 . 1 1 49 49 GLY H H 1 8 0.02 . 1 . . . . 49 GLY H . 16961 1 580 . 1 1 49 49 GLY HA2 H 1 4.03 0.02 . 2 . . . . 49 GLY HA2 . 16961 1 581 . 1 1 49 49 GLY HA3 H 1 4.17 0.02 . 2 . . . . 49 GLY HA3 . 16961 1 582 . 1 1 49 49 GLY C C 13 173.6 0.2 . 1 . . . . 49 GLY C . 16961 1 583 . 1 1 49 49 GLY CA C 13 47.0 0.2 . 1 . . . . 49 GLY CA . 16961 1 584 . 1 1 49 49 GLY N N 15 109.9 0.2 . 1 . . . . 49 GLY N . 16961 1 585 . 1 1 50 50 GLN H H 1 7.96 0.02 . 1 . . . . 50 GLN H . 16961 1 586 . 1 1 50 50 GLN HA H 1 5.25 0.02 . 1 . . . . 50 GLN HA . 16961 1 587 . 1 1 50 50 GLN HB2 H 1 1.72 0.02 . 2 . . . . 50 GLN HB2 . 16961 1 588 . 1 1 50 50 GLN HB3 H 1 2.15 0.02 . 2 . . . . 50 GLN HB3 . 16961 1 589 . 1 1 50 50 GLN HE21 H 1 7.21 0.02 . 2 . . . . 50 GLN HE21 . 16961 1 590 . 1 1 50 50 GLN HE22 H 1 6.79 0.02 . 2 . . . . 50 GLN HE22 . 16961 1 591 . 1 1 50 50 GLN HG2 H 1 2.16 0.02 . 2 . . . . 50 GLN HG2 . 16961 1 592 . 1 1 50 50 GLN HG3 H 1 2.26 0.02 . 2 . . . . 50 GLN HG3 . 16961 1 593 . 1 1 50 50 GLN C C 13 174.5 0.2 . 1 . . . . 50 GLN C . 16961 1 594 . 1 1 50 50 GLN CA C 13 54.8 0.2 . 1 . . . . 50 GLN CA . 16961 1 595 . 1 1 50 50 GLN CB C 13 31.8 0.2 . 1 . . . . 50 GLN CB . 16961 1 596 . 1 1 50 50 GLN CD C 13 178.8 0.2 . 1 . . . . 50 GLN CD . 16961 1 597 . 1 1 50 50 GLN CG C 13 33.6 0.2 . 1 . . . . 50 GLN CG . 16961 1 598 . 1 1 50 50 GLN N N 15 118.1 0.2 . 1 . . . . 50 GLN N . 16961 1 599 . 1 1 50 50 GLN NE2 N 15 110.1 0.2 . 1 . . . . 50 GLN NE2 . 16961 1 600 . 1 1 51 51 VAL H H 1 8.43 0.02 . 1 . . . . 51 VAL H . 16961 1 601 . 1 1 51 51 VAL HA H 1 4.84 0.02 . 1 . . . . 51 VAL HA . 16961 1 602 . 1 1 51 51 VAL HB H 1 1.75 0.02 . 1 . . . . 51 VAL HB . 16961 1 603 . 1 1 51 51 VAL HG11 H 1 0.85 0.02 . 2 . . . . 51 VAL HG1 . 16961 1 604 . 1 1 51 51 VAL HG12 H 1 0.85 0.02 . 2 . . . . 51 VAL HG1 . 16961 1 605 . 1 1 51 51 VAL HG13 H 1 0.85 0.02 . 2 . . . . 51 VAL HG1 . 16961 1 606 . 1 1 51 51 VAL HG21 H 1 0.91 0.02 . 2 . . . . 51 VAL HG2 . 16961 1 607 . 1 1 51 51 VAL HG22 H 1 0.91 0.02 . 2 . . . . 51 VAL HG2 . 16961 1 608 . 1 1 51 51 VAL HG23 H 1 0.91 0.02 . 2 . . . . 51 VAL HG2 . 16961 1 609 . 1 1 51 51 VAL C C 13 172.2 0.2 . 1 . . . . 51 VAL C . 16961 1 610 . 1 1 51 51 VAL CA C 13 59.4 0.2 . 1 . . . . 51 VAL CA . 16961 1 611 . 1 1 51 51 VAL CB C 13 36.0 0.2 . 1 . . . . 51 VAL CB . 16961 1 612 . 1 1 51 51 VAL CG1 C 13 21.2 0.2 . 2 . . . . 51 VAL CG1 . 16961 1 613 . 1 1 51 51 VAL CG2 C 13 22.3 0.2 . 2 . . . . 51 VAL CG2 . 16961 1 614 . 1 1 51 51 VAL N N 15 122 0.2 . 1 . . . . 51 VAL N . 16961 1 615 . 1 1 52 52 GLU H H 1 8.73 0.02 . 1 . . . . 52 GLU H . 16961 1 616 . 1 1 52 52 GLU HA H 1 5.35 0.02 . 1 . . . . 52 GLU HA . 16961 1 617 . 1 1 52 52 GLU HB2 H 1 1.98 0.02 . 2 . . . . 52 GLU HB2 . 16961 1 618 . 1 1 52 52 GLU HB3 H 1 1.98 0.02 . 2 . . . . 52 GLU HB3 . 16961 1 619 . 1 1 52 52 GLU HG2 H 1 2.09 0.02 . 2 . . . . 52 GLU HG2 . 16961 1 620 . 1 1 52 52 GLU HG3 H 1 2.32 0.02 . 2 . . . . 52 GLU HG3 . 16961 1 621 . 1 1 52 52 GLU C C 13 175 0.2 . 1 . . . . 52 GLU C . 16961 1 622 . 1 1 52 52 GLU CA C 13 54.5 0.2 . 1 . . . . 52 GLU CA . 16961 1 623 . 1 1 52 52 GLU CB C 13 32.6 0.2 . 1 . . . . 52 GLU CB . 16961 1 624 . 1 1 52 52 GLU CG C 13 34.9 0.2 . 1 . . . . 52 GLU CG . 16961 1 625 . 1 1 52 52 GLU N N 15 124.6 0.2 . 1 . . . . 52 GLU N . 16961 1 626 . 1 1 53 53 VAL H H 1 9.75 0.02 . 1 . . . . 53 VAL H . 16961 1 627 . 1 1 53 53 VAL HA H 1 4.90 0.02 . 1 . . . . 53 VAL HA . 16961 1 628 . 1 1 53 53 VAL HB H 1 1.95 0.02 . 1 . . . . 53 VAL HB . 16961 1 629 . 1 1 53 53 VAL HG11 H 1 0.87 0.02 . 2 . . . . 53 VAL HG1 . 16961 1 630 . 1 1 53 53 VAL HG12 H 1 0.87 0.02 . 2 . . . . 53 VAL HG1 . 16961 1 631 . 1 1 53 53 VAL HG13 H 1 0.87 0.02 . 2 . . . . 53 VAL HG1 . 16961 1 632 . 1 1 53 53 VAL HG21 H 1 0.87 0.02 . 2 . . . . 53 VAL HG2 . 16961 1 633 . 1 1 53 53 VAL HG22 H 1 0.87 0.02 . 2 . . . . 53 VAL HG2 . 16961 1 634 . 1 1 53 53 VAL HG23 H 1 0.87 0.02 . 2 . . . . 53 VAL HG2 . 16961 1 635 . 1 1 53 53 VAL C C 13 173.1 0.2 . 1 . . . . 53 VAL C . 16961 1 636 . 1 1 53 53 VAL CA C 13 60.2 0.2 . 1 . . . . 53 VAL CA . 16961 1 637 . 1 1 53 53 VAL CB C 13 35.0 0.2 . 1 . . . . 53 VAL CB . 16961 1 638 . 1 1 53 53 VAL CG1 C 13 21.5 0.2 . 2 . . . . 53 VAL CG1 . 16961 1 639 . 1 1 53 53 VAL CG2 C 13 20.9 0.2 . 2 . . . . 53 VAL CG2 . 16961 1 640 . 1 1 53 53 VAL N N 15 127.1 0.2 . 1 . . . . 53 VAL N . 16961 1 641 . 1 1 54 54 GLU H H 1 8.74 0.02 . 1 . . . . 54 GLU H . 16961 1 642 . 1 1 54 54 GLU HA H 1 5.6 0.02 . 1 . . . . 54 GLU HA . 16961 1 643 . 1 1 54 54 GLU HB2 H 1 1.62 0.02 . 2 . . . . 54 GLU HB2 . 16961 1 644 . 1 1 54 54 GLU HB3 H 1 1.75 0.02 . 2 . . . . 54 GLU HB3 . 16961 1 645 . 1 1 54 54 GLU HG2 H 1 1.87 0.02 . 2 . . . . 54 GLU HG2 . 16961 1 646 . 1 1 54 54 GLU HG3 H 1 1.97 0.02 . 2 . . . . 54 GLU HG3 . 16961 1 647 . 1 1 54 54 GLU C C 13 174.5 0.2 . 1 . . . . 54 GLU C . 16961 1 648 . 1 1 54 54 GLU CA C 13 52.6 0.2 . 1 . . . . 54 GLU CA . 16961 1 649 . 1 1 54 54 GLU CB C 13 33.6 0.2 . 1 . . . . 54 GLU CB . 16961 1 650 . 1 1 54 54 GLU CG C 13 33.6 0.2 . 1 . . . . 54 GLU CG . 16961 1 651 . 1 1 54 54 GLU N N 15 122.3 0.2 . 1 . . . . 54 GLU N . 16961 1 652 . 1 1 55 55 GLY H H 1 8.16 0.02 . 1 . . . . 55 GLY H . 16961 1 653 . 1 1 55 55 GLY HA2 H 1 3.73 0.02 . 2 . . . . 55 GLY HA2 . 16961 1 654 . 1 1 55 55 GLY HA3 H 1 4.39 0.02 . 2 . . . . 55 GLY HA3 . 16961 1 655 . 1 1 55 55 GLY C C 13 171 0.2 . 1 . . . . 55 GLY C . 16961 1 656 . 1 1 55 55 GLY CA C 13 45.6 0.2 . 1 . . . . 55 GLY CA . 16961 1 657 . 1 1 55 55 GLY N N 15 105.8 0.2 . 1 . . . . 55 GLY N . 16961 1 658 . 1 1 56 56 LEU H H 1 7.96 0.02 . 1 . . . . 56 LEU H . 16961 1 659 . 1 1 56 56 LEU HA H 1 4.75 0.02 . 1 . . . . 56 LEU HA . 16961 1 660 . 1 1 56 56 LEU HB2 H 1 1.44 0.02 . 2 . . . . 56 LEU HB2 . 16961 1 661 . 1 1 56 56 LEU HB3 H 1 1.89 0.02 . 2 . . . . 56 LEU HB3 . 16961 1 662 . 1 1 56 56 LEU HD11 H 1 0.82 0.02 . 2 . . . . 56 LEU HD1 . 16961 1 663 . 1 1 56 56 LEU HD12 H 1 0.82 0.02 . 2 . . . . 56 LEU HD1 . 16961 1 664 . 1 1 56 56 LEU HD13 H 1 0.82 0.02 . 2 . . . . 56 LEU HD1 . 16961 1 665 . 1 1 56 56 LEU HD21 H 1 0.72 0.02 . 2 . . . . 56 LEU HD2 . 16961 1 666 . 1 1 56 56 LEU HD22 H 1 0.72 0.02 . 2 . . . . 56 LEU HD2 . 16961 1 667 . 1 1 56 56 LEU HD23 H 1 0.72 0.02 . 2 . . . . 56 LEU HD2 . 16961 1 668 . 1 1 56 56 LEU HG H 1 1.46 0.02 . 1 . . . . 56 LEU HG . 16961 1 669 . 1 1 56 56 LEU C C 13 175.2 0.2 . 1 . . . . 56 LEU C . 16961 1 670 . 1 1 56 56 LEU CA C 13 53.7 0.2 . 1 . . . . 56 LEU CA . 16961 1 671 . 1 1 56 56 LEU CB C 13 39.5 0.2 . 1 . . . . 56 LEU CB . 16961 1 672 . 1 1 56 56 LEU CD1 C 13 25.2 0.2 . 2 . . . . 56 LEU CD1 . 16961 1 673 . 1 1 56 56 LEU CD2 C 13 23.9 0.2 . 2 . . . . 56 LEU CD2 . 16961 1 674 . 1 1 56 56 LEU CG C 13 27.3 0.2 . 1 . . . . 56 LEU CG . 16961 1 675 . 1 1 56 56 LEU N N 15 122.6 0.2 . 1 . . . . 56 LEU N . 16961 1 676 . 1 1 57 57 ILE H H 1 8.35 0.02 . 1 . . . . 57 ILE H . 16961 1 677 . 1 1 57 57 ILE HA H 1 3.88 0.02 . 1 . . . . 57 ILE HA . 16961 1 678 . 1 1 57 57 ILE HB H 1 1.72 0.02 . 1 . . . . 57 ILE HB . 16961 1 679 . 1 1 57 57 ILE HD11 H 1 0.53 0.02 . 1 . . . . 57 ILE HD1 . 16961 1 680 . 1 1 57 57 ILE HD12 H 1 0.53 0.02 . 1 . . . . 57 ILE HD1 . 16961 1 681 . 1 1 57 57 ILE HD13 H 1 0.53 0.02 . 1 . . . . 57 ILE HD1 . 16961 1 682 . 1 1 57 57 ILE HG12 H 1 1.46 0.02 . 2 . . . . 57 ILE HG12 . 16961 1 683 . 1 1 57 57 ILE HG13 H 1 1.46 0.02 . 2 . . . . 57 ILE HG13 . 16961 1 684 . 1 1 57 57 ILE HG21 H 1 0.8 0.02 . 1 . . . . 57 ILE HG2 . 16961 1 685 . 1 1 57 57 ILE HG22 H 1 0.8 0.02 . 1 . . . . 57 ILE HG2 . 16961 1 686 . 1 1 57 57 ILE HG23 H 1 0.8 0.02 . 1 . . . . 57 ILE HG2 . 16961 1 687 . 1 1 57 57 ILE C C 13 175.2 0.2 . 1 . . . . 57 ILE C . 16961 1 688 . 1 1 57 57 ILE CA C 13 62.3 0.2 . 1 . . . . 57 ILE CA . 16961 1 689 . 1 1 57 57 ILE CB C 13 38.7 0.2 . 1 . . . . 57 ILE CB . 16961 1 690 . 1 1 57 57 ILE CD1 C 13 12.7 0.2 . 1 . . . . 57 ILE CD1 . 16961 1 691 . 1 1 57 57 ILE CG1 C 13 27.4 0.2 . 1 . . . . 57 ILE CG1 . 16961 1 692 . 1 1 57 57 ILE CG2 C 13 16.9 0.2 . 1 . . . . 57 ILE CG2 . 16961 1 693 . 1 1 57 57 ILE N N 15 123.6 0.2 . 1 . . . . 57 ILE N . 16961 1 694 . 1 1 58 58 ASP H H 1 9.71 0.02 . 1 . . . . 58 ASP H . 16961 1 695 . 1 1 58 58 ASP HA H 1 4.91 0.02 . 1 . . . . 58 ASP HA . 16961 1 696 . 1 1 58 58 ASP HB2 H 1 2.49 0.02 . 2 . . . . 58 ASP HB2 . 16961 1 697 . 1 1 58 58 ASP HB3 H 1 2.67 0.02 . 2 . . . . 58 ASP HB3 . 16961 1 698 . 1 1 58 58 ASP C C 13 175 0.2 . 1 . . . . 58 ASP C . 16961 1 699 . 1 1 58 58 ASP CA C 13 54.4 0.2 . 1 . . . . 58 ASP CA . 16961 1 700 . 1 1 58 58 ASP CB C 13 41.4 0.2 . 1 . . . . 58 ASP CB . 16961 1 701 . 1 1 58 58 ASP N N 15 127.6 0.2 . 1 . . . . 58 ASP N . 16961 1 702 . 1 1 59 59 ALA H H 1 8.06 0.02 . 1 . . . . 59 ALA H . 16961 1 703 . 1 1 59 59 ALA HA H 1 4.8 0.02 . 1 . . . . 59 ALA HA . 16961 1 704 . 1 1 59 59 ALA HB1 H 1 1.37 0.02 . 1 . . . . 59 ALA HB . 16961 1 705 . 1 1 59 59 ALA HB2 H 1 1.37 0.02 . 1 . . . . 59 ALA HB . 16961 1 706 . 1 1 59 59 ALA HB3 H 1 1.37 0.02 . 1 . . . . 59 ALA HB . 16961 1 707 . 1 1 59 59 ALA C C 13 176 0.2 . 1 . . . . 59 ALA C . 16961 1 708 . 1 1 59 59 ALA CA C 13 52.5 0.2 . 1 . . . . 59 ALA CA . 16961 1 709 . 1 1 59 59 ALA CB C 13 22.2 0.2 . 1 . . . . 59 ALA CB . 16961 1 710 . 1 1 59 59 ALA N N 15 118.7 0.2 . 1 . . . . 59 ALA N . 16961 1 711 . 1 1 60 60 LEU H H 1 8.95 0.02 . 1 . . . . 60 LEU H . 16961 1 712 . 1 1 60 60 LEU HA H 1 5.52 0.02 . 1 . . . . 60 LEU HA . 16961 1 713 . 1 1 60 60 LEU HB2 H 1 1.27 0.02 . 2 . . . . 60 LEU HB2 . 16961 1 714 . 1 1 60 60 LEU HB3 H 1 1.70 0.02 . 2 . . . . 60 LEU HB3 . 16961 1 715 . 1 1 60 60 LEU HD11 H 1 0.63 0.02 . 2 . . . . 60 LEU HD1 . 16961 1 716 . 1 1 60 60 LEU HD12 H 1 0.63 0.02 . 2 . . . . 60 LEU HD1 . 16961 1 717 . 1 1 60 60 LEU HD13 H 1 0.63 0.02 . 2 . . . . 60 LEU HD1 . 16961 1 718 . 1 1 60 60 LEU HD21 H 1 0.94 0.02 . 2 . . . . 60 LEU HD2 . 16961 1 719 . 1 1 60 60 LEU HD22 H 1 0.94 0.02 . 2 . . . . 60 LEU HD2 . 16961 1 720 . 1 1 60 60 LEU HD23 H 1 0.94 0.02 . 2 . . . . 60 LEU HD2 . 16961 1 721 . 1 1 60 60 LEU HG H 1 1.67 0.02 . 1 . . . . 60 LEU HG . 16961 1 722 . 1 1 60 60 LEU C C 13 175.6 0.2 . 1 . . . . 60 LEU C . 16961 1 723 . 1 1 60 60 LEU CA C 13 54.2 0.2 . 1 . . . . 60 LEU CA . 16961 1 724 . 1 1 60 60 LEU CB C 13 46.8 0.2 . 1 . . . . 60 LEU CB . 16961 1 725 . 1 1 60 60 LEU CD1 C 13 25.5 0.2 . 2 . . . . 60 LEU CD1 . 16961 1 726 . 1 1 60 60 LEU CD2 C 13 27.0 0.2 . 2 . . . . 60 LEU CD2 . 16961 1 727 . 1 1 60 60 LEU CG C 13 27.0 0.2 . 1 . . . . 60 LEU CG . 16961 1 728 . 1 1 60 60 LEU N N 15 120 0.2 . 1 . . . . 60 LEU N . 16961 1 729 . 1 1 61 61 VAL H H 1 8.62 0.02 . 1 . . . . 61 VAL H . 16961 1 730 . 1 1 61 61 VAL HA H 1 4.59 0.02 . 1 . . . . 61 VAL HA . 16961 1 731 . 1 1 61 61 VAL HB H 1 2.05 0.02 . 1 . . . . 61 VAL HB . 16961 1 732 . 1 1 61 61 VAL HG11 H 1 0.96 0.02 . 2 . . . . 61 VAL HG1 . 16961 1 733 . 1 1 61 61 VAL HG12 H 1 0.96 0.02 . 2 . . . . 61 VAL HG1 . 16961 1 734 . 1 1 61 61 VAL HG13 H 1 0.96 0.02 . 2 . . . . 61 VAL HG1 . 16961 1 735 . 1 1 61 61 VAL HG21 H 1 0.98 0.02 . 2 . . . . 61 VAL HG2 . 16961 1 736 . 1 1 61 61 VAL HG22 H 1 0.98 0.02 . 2 . . . . 61 VAL HG2 . 16961 1 737 . 1 1 61 61 VAL HG23 H 1 0.98 0.02 . 2 . . . . 61 VAL HG2 . 16961 1 738 . 1 1 61 61 VAL C C 13 174 0.2 . 1 . . . . 61 VAL C . 16961 1 739 . 1 1 61 61 VAL CA C 13 62.1 0.2 . 1 . . . . 61 VAL CA . 16961 1 740 . 1 1 61 61 VAL CB C 13 35.6 0.2 . 1 . . . . 61 VAL CB . 16961 1 741 . 1 1 61 61 VAL CG1 C 13 21.3 0.2 . 2 . . . . 61 VAL CG1 . 16961 1 742 . 1 1 61 61 VAL CG2 C 13 21.4 0.2 . 2 . . . . 61 VAL CG2 . 16961 1 743 . 1 1 61 61 VAL N N 15 119.9 0.2 . 1 . . . . 61 VAL N . 16961 1 744 . 1 1 62 62 TYR H H 1 8.35 0.02 . 1 . . . . 62 TYR H . 16961 1 745 . 1 1 62 62 TYR HA H 1 5.34 0.02 . 1 . . . . 62 TYR HA . 16961 1 746 . 1 1 62 62 TYR HB2 H 1 2.66 0.02 . 2 . . . . 62 TYR HB2 . 16961 1 747 . 1 1 62 62 TYR HB3 H 1 3.36 0.02 . 2 . . . . 62 TYR HB3 . 16961 1 748 . 1 1 62 62 TYR HD1 H 1 6.8 0.02 . 3 . . . . 62 TYR HD1 . 16961 1 749 . 1 1 62 62 TYR HD2 H 1 6.8 0.02 . 3 . . . . 62 TYR HD2 . 16961 1 750 . 1 1 62 62 TYR HE1 H 1 6.46 0.02 . 3 . . . . 62 TYR HE1 . 16961 1 751 . 1 1 62 62 TYR HE2 H 1 6.46 0.02 . 3 . . . . 62 TYR HE2 . 16961 1 752 . 1 1 62 62 TYR CA C 13 53.2 0.2 . 1 . . . . 62 TYR CA . 16961 1 753 . 1 1 62 62 TYR CB C 13 43.4 0.2 . 1 . . . . 62 TYR CB . 16961 1 754 . 1 1 62 62 TYR CD1 C 13 131.4 0.2 . 3 . . . . 62 TYR CD1 . 16961 1 755 . 1 1 62 62 TYR CD2 C 13 131.4 0.2 . 3 . . . . 62 TYR CD2 . 16961 1 756 . 1 1 62 62 TYR CE1 C 13 118.4 0.2 . 3 . . . . 62 TYR CE1 . 16961 1 757 . 1 1 62 62 TYR CE2 C 13 118.4 0.2 . 3 . . . . 62 TYR CE2 . 16961 1 758 . 1 1 62 62 TYR N N 15 126 0.2 . 1 . . . . 62 TYR N . 16961 1 759 . 1 1 63 63 PRO HA H 1 4.61 0.02 . 1 . . . . 63 PRO HA . 16961 1 760 . 1 1 63 63 PRO HB2 H 1 1.54 0.02 . 2 . . . . 63 PRO HB2 . 16961 1 761 . 1 1 63 63 PRO HB3 H 1 1.88 0.02 . 2 . . . . 63 PRO HB3 . 16961 1 762 . 1 1 63 63 PRO HD2 H 1 3.43 0.02 . 2 . . . . 63 PRO HD2 . 16961 1 763 . 1 1 63 63 PRO HD3 H 1 3.46 0.02 . 2 . . . . 63 PRO HD3 . 16961 1 764 . 1 1 63 63 PRO HG2 H 1 1.3 0.02 . 2 . . . . 63 PRO HG2 . 16961 1 765 . 1 1 63 63 PRO HG3 H 1 1.76 0.02 . 2 . . . . 63 PRO HG3 . 16961 1 766 . 1 1 63 63 PRO C C 13 176.2 0.2 . 1 . . . . 63 PRO C . 16961 1 767 . 1 1 63 63 PRO CA C 13 62.5 0.2 . 1 . . . . 63 PRO CA . 16961 1 768 . 1 1 63 63 PRO CB C 13 33.2 0.2 . 1 . . . . 63 PRO CB . 16961 1 769 . 1 1 63 63 PRO CD C 13 49.6 0.2 . 1 . . . . 63 PRO CD . 16961 1 770 . 1 1 63 63 PRO CG C 13 25 0.2 . 1 . . . . 63 PRO CG . 16961 1 771 . 1 1 64 64 LEU H H 1 9.08 0.02 . 1 . . . . 64 LEU H . 16961 1 772 . 1 1 64 64 LEU HA H 1 4.17 0.02 . 1 . . . . 64 LEU HA . 16961 1 773 . 1 1 64 64 LEU HB2 H 1 1.42 0.02 . 2 . . . . 64 LEU HB2 . 16961 1 774 . 1 1 64 64 LEU HB3 H 1 1.62 0.02 . 2 . . . . 64 LEU HB3 . 16961 1 775 . 1 1 64 64 LEU HD11 H 1 0.87 0.02 . 2 . . . . 64 LEU HD1 . 16961 1 776 . 1 1 64 64 LEU HD12 H 1 0.87 0.02 . 2 . . . . 64 LEU HD1 . 16961 1 777 . 1 1 64 64 LEU HD13 H 1 0.87 0.02 . 2 . . . . 64 LEU HD1 . 16961 1 778 . 1 1 64 64 LEU HD21 H 1 0.84 0.02 . 2 . . . . 64 LEU HD2 . 16961 1 779 . 1 1 64 64 LEU HD22 H 1 0.84 0.02 . 2 . . . . 64 LEU HD2 . 16961 1 780 . 1 1 64 64 LEU HD23 H 1 0.84 0.02 . 2 . . . . 64 LEU HD2 . 16961 1 781 . 1 1 64 64 LEU HG H 1 1.52 0.02 . 1 . . . . 64 LEU HG . 16961 1 782 . 1 1 64 64 LEU C C 13 177.1 0.2 . 1 . . . . 64 LEU C . 16961 1 783 . 1 1 64 64 LEU CA C 13 56 0.2 . 1 . . . . 64 LEU CA . 16961 1 784 . 1 1 64 64 LEU CB C 13 42.7 0.2 . 1 . . . . 64 LEU CB . 16961 1 785 . 1 1 64 64 LEU CD1 C 13 24.3 0.2 . 2 . . . . 64 LEU CD1 . 16961 1 786 . 1 1 64 64 LEU CD2 C 13 25 0.2 . 2 . . . . 64 LEU CD2 . 16961 1 787 . 1 1 64 64 LEU CG C 13 26.8 0.2 . 1 . . . . 64 LEU CG . 16961 1 788 . 1 1 64 64 LEU N N 15 124.4 0.2 . 1 . . . . 64 LEU N . 16961 1 789 . 1 1 65 65 GLU H H 1 8.63 0.02 . 1 . . . . 65 GLU H . 16961 1 790 . 1 1 65 65 GLU HA H 1 4.3 0.02 . 1 . . . . 65 GLU HA . 16961 1 791 . 1 1 65 65 GLU HB2 H 1 1.88 0.02 . 2 . . . . 65 GLU HB2 . 16961 1 792 . 1 1 65 65 GLU HB3 H 1 1.88 0.02 . 2 . . . . 65 GLU HB3 . 16961 1 793 . 1 1 65 65 GLU HG2 H 1 2.22 0.02 . 2 . . . . 65 GLU HG2 . 16961 1 794 . 1 1 65 65 GLU HG3 H 1 2.22 0.02 . 2 . . . . 65 GLU HG3 . 16961 1 795 . 1 1 65 65 GLU C C 13 175.8 0.2 . 1 . . . . 65 GLU C . 16961 1 796 . 1 1 65 65 GLU CA C 13 55.8 0.2 . 1 . . . . 65 GLU CA . 16961 1 797 . 1 1 65 65 GLU CB C 13 30.4 0.2 . 1 . . . . 65 GLU CB . 16961 1 798 . 1 1 65 65 GLU CG C 13 35.2 0.2 . 1 . . . . 65 GLU CG . 16961 1 799 . 1 1 65 65 GLU N N 15 122.7 0.2 . 1 . . . . 65 GLU N . 16961 1 800 . 1 1 66 66 HIS H H 1 8.59 0.02 . 1 . . . . 66 HIS H . 16961 1 801 . 1 1 66 66 HIS HA H 1 4.59 0.02 . 1 . . . . 66 HIS HA . 16961 1 802 . 1 1 66 66 HIS HB2 H 1 3.03 0.02 . 2 . . . . 66 HIS HB2 . 16961 1 803 . 1 1 66 66 HIS HB3 H 1 3.13 0.02 . 2 . . . . 66 HIS HB3 . 16961 1 804 . 1 1 66 66 HIS CA C 13 55.2 0.2 . 1 . . . . 66 HIS CA . 16961 1 805 . 1 1 66 66 HIS CB C 13 29 0.2 . 1 . . . . 66 HIS CB . 16961 1 806 . 1 1 66 66 HIS N N 15 119.4 0.2 . 1 . . . . 66 HIS N . 16961 1 807 . 1 1 67 67 HIS H H 1 8.62 0.02 . 1 . . . . 67 HIS H . 16961 1 808 . 1 1 67 67 HIS HA H 1 4.61 0.02 . 1 . . . . 67 HIS HA . 16961 1 809 . 1 1 67 67 HIS HB2 H 1 3.04 0.02 . 2 . . . . 67 HIS HB2 . 16961 1 810 . 1 1 67 67 HIS HB3 H 1 3.16 0.02 . 2 . . . . 67 HIS HB3 . 16961 1 811 . 1 1 67 67 HIS N N 15 119.4 0.2 . 1 . . . . 67 HIS N . 16961 1 812 . 1 1 68 68 HIS H H 1 8.68 0.02 . 1 . . . . 68 HIS H . 16961 1 813 . 1 1 68 68 HIS HA H 1 4.63 0.02 . 1 . . . . 68 HIS HA . 16961 1 814 . 1 1 68 68 HIS HB2 H 1 3.08 0.02 . 2 . . . . 68 HIS HB2 . 16961 1 815 . 1 1 68 68 HIS HB3 H 1 3.17 0.02 . 2 . . . . 68 HIS HB3 . 16961 1 816 . 1 1 68 68 HIS CA C 13 55.2 0.2 . 1 . . . . 68 HIS CA . 16961 1 817 . 1 1 68 68 HIS CB C 13 29.2 0.2 . 1 . . . . 68 HIS CB . 16961 1 818 . 1 1 68 68 HIS N N 15 119.9 0.2 . 1 . . . . 68 HIS N . 16961 1 819 . 1 1 69 69 HIS H H 1 8.58 0.02 . 1 . . . . 69 HIS H . 16961 1 820 . 1 1 69 69 HIS HA H 1 4.63 0.02 . 1 . . . . 69 HIS HA . 16961 1 821 . 1 1 69 69 HIS HB2 H 1 3.18 0.02 . 2 . . . . 69 HIS HB2 . 16961 1 822 . 1 1 69 69 HIS HB3 H 1 3.18 0.02 . 2 . . . . 69 HIS HB3 . 16961 1 823 . 1 1 69 69 HIS CA C 13 55.2 0.2 . 1 . . . . 69 HIS CA . 16961 1 824 . 1 1 69 69 HIS CB C 13 29.2 0.2 . 1 . . . . 69 HIS CB . 16961 1 825 . 1 1 69 69 HIS N N 15 120.7 0.2 . 1 . . . . 69 HIS N . 16961 1 826 . 1 1 70 70 HIS H H 1 8.68 0.02 . 1 . . . . 70 HIS H . 16961 1 827 . 1 1 70 70 HIS HA H 1 4.60 0.02 . 1 . . . . 70 HIS HA . 16961 1 828 . 1 1 70 70 HIS HB2 H 1 3.2 0.02 . 2 . . . . 70 HIS HB2 . 16961 1 829 . 1 1 70 70 HIS HB3 H 1 3.2 0.02 . 2 . . . . 70 HIS HB3 . 16961 1 830 . 1 1 70 70 HIS C C 13 173.5 0.2 . 1 . . . . 70 HIS C . 16961 1 831 . 1 1 70 70 HIS CA C 13 55.5 0.2 . 1 . . . . 70 HIS CA . 16961 1 832 . 1 1 70 70 HIS CB C 13 29.3 0.2 . 1 . . . . 70 HIS CB . 16961 1 833 . 1 1 70 70 HIS N N 15 120.6 0.2 . 1 . . . . 70 HIS N . 16961 1 834 . 1 1 71 71 HIS H H 1 8.41 0.02 . 1 . . . . 71 HIS H . 16961 1 835 . 1 1 71 71 HIS HA H 1 4.40 0.02 . 1 . . . . 71 HIS HA . 16961 1 836 . 1 1 71 71 HIS HB2 H 1 3.11 0.02 . 2 . . . . 71 HIS HB2 . 16961 1 837 . 1 1 71 71 HIS HB3 H 1 3.11 0.02 . 2 . . . . 71 HIS HB3 . 16961 1 838 . 1 1 71 71 HIS CA C 13 57.1 0.2 . 1 . . . . 71 HIS CA . 16961 1 839 . 1 1 71 71 HIS CB C 13 29.4 0.2 . 1 . . . . 71 HIS CB . 16961 1 840 . 1 1 71 71 HIS N N 15 125.7 0.2 . 1 . . . . 71 HIS N . 16961 1 stop_ save_