################################### # 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 18222 _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 3 '3D HNCACB' . . . 18222 1 5 '3D 1H-15N NOESY' . . . 18222 1 8 '3D HNCA' . . . 18222 1 9 '3D HN(CO)CA' . . . 18222 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 CA C 13 54.68 0.1 . 1 . . . A 1 MET CA . 18222 1 2 . 1 1 2 2 VAL H H 1 8.01 0.01 . 1 . . . A 2 VAL H . 18222 1 3 . 1 1 2 2 VAL CA C 13 61.6 0.1 . 1 . . . A 2 VAL CA . 18222 1 4 . 1 1 2 2 VAL CB C 13 31.9 0.1 . 1 . . . A 2 VAL CB . 18222 1 5 . 1 1 2 2 VAL N N 15 121.59 0.1 . 1 . . . A 2 VAL N . 18222 1 6 . 1 1 3 3 ASN H H 1 8.36 0.01 . 1 . . . A 3 ASN H . 18222 1 7 . 1 1 3 3 ASN HA H 1 4.02 0.01 . 1 . . . A 3 ASN HA . 18222 1 8 . 1 1 3 3 ASN HB2 H 1 2.63 0.01 . 2 . . . A 3 ASN HB2 . 18222 1 9 . 1 1 3 3 ASN HB3 H 1 2.76 0.01 . 2 . . . A 3 ASN HB3 . 18222 1 10 . 1 1 3 3 ASN CA C 13 52.64 0.1 . 1 . . . A 3 ASN CA . 18222 1 11 . 1 1 3 3 ASN CB C 13 38.33 0.1 . 1 . . . A 3 ASN CB . 18222 1 12 . 1 1 3 3 ASN N N 15 122.52 0.1 . 1 . . . A 3 ASN N . 18222 1 13 . 1 1 4 4 LEU H H 1 8.22 0.01 . 1 . . . A 4 LEU H . 18222 1 14 . 1 1 4 4 LEU HA H 1 4.22 0.01 . 1 . . . A 4 LEU HA . 18222 1 15 . 1 1 4 4 LEU CA C 13 54.62 0.1 . 1 . . . A 4 LEU CA . 18222 1 16 . 1 1 4 4 LEU CB C 13 41.68 0.1 . 1 . . . A 4 LEU CB . 18222 1 17 . 1 1 4 4 LEU N N 15 123.83 0.1 . 1 . . . A 4 LEU N . 18222 1 18 . 1 1 5 5 GLY H H 1 8.03 0.01 . 1 . . . A 5 GLY H . 18222 1 19 . 1 1 5 5 GLY HA2 H 1 3.83 0.01 . 2 . . . A 5 GLY HA2 . 18222 1 20 . 1 1 5 5 GLY HA3 H 1 3.83 0.01 . 2 . . . A 5 GLY HA3 . 18222 1 21 . 1 1 5 5 GLY CA C 13 45.8 0.1 . 1 . . . A 5 GLY CA . 18222 1 22 . 1 1 5 5 GLY N N 15 106.81 0.1 . 1 . . . A 5 GLY N . 18222 1 23 . 1 1 6 6 LEU H H 1 8.03 0.01 . 1 . . . A 6 LEU H . 18222 1 24 . 1 1 6 6 LEU HA H 1 4.05 0.01 . 1 . . . A 6 LEU HA . 18222 1 25 . 1 1 6 6 LEU HB2 H 1 1.59 0.01 . 2 . . . A 6 LEU HB2 . 18222 1 26 . 1 1 6 6 LEU HB3 H 1 1.59 0.01 . 2 . . . A 6 LEU HB3 . 18222 1 27 . 1 1 6 6 LEU CA C 13 55.99 0.1 . 1 . . . A 6 LEU CA . 18222 1 28 . 1 1 6 6 LEU CB C 13 40.8 0.1 . 1 . . . A 6 LEU CB . 18222 1 29 . 1 1 6 6 LEU N N 15 120.82 0.1 . 1 . . . A 6 LEU N . 18222 1 30 . 1 1 7 7 SER H H 1 8.36 0.01 . 1 . . . A 7 SER H . 18222 1 31 . 1 1 7 7 SER HA H 1 4.1 0.01 . 1 . . . A 7 SER HA . 18222 1 32 . 1 1 7 7 SER HB2 H 1 3.82 0.01 . 2 . . . A 7 SER HB2 . 18222 1 33 . 1 1 7 7 SER HB3 H 1 3.82 0.01 . 2 . . . A 7 SER HB3 . 18222 1 34 . 1 1 7 7 SER CA C 13 60.58 0.1 . 1 . . . A 7 SER CA . 18222 1 35 . 1 1 7 7 SER CB C 13 62.06 0.1 . 1 . . . A 7 SER CB . 18222 1 36 . 1 1 7 7 SER N N 15 115.54 0.1 . 1 . . . A 7 SER N . 18222 1 37 . 1 1 8 8 ARG H H 1 7.83 0.01 . 1 . . . A 8 ARG H . 18222 1 38 . 1 1 8 8 ARG HA H 1 4.16 0.01 . 1 . . . A 8 ARG HA . 18222 1 39 . 1 1 8 8 ARG HB2 H 1 1.81 0.01 . 2 . . . A 8 ARG HB2 . 18222 1 40 . 1 1 8 8 ARG HB3 H 1 1.81 0.01 . 2 . . . A 8 ARG HB3 . 18222 1 41 . 1 1 8 8 ARG HD2 H 1 2.99 0.01 . 2 . . . A 8 ARG HD2 . 18222 1 42 . 1 1 8 8 ARG HD3 H 1 2.99 0.01 . 2 . . . A 8 ARG HD3 . 18222 1 43 . 1 1 8 8 ARG CA C 13 57.35 0.1 . 1 . . . A 8 ARG CA . 18222 1 44 . 1 1 8 8 ARG CB C 13 29.23 0.1 . 1 . . . A 8 ARG CB . 18222 1 45 . 1 1 8 8 ARG N N 15 120.69 0.1 . 1 . . . A 8 ARG N . 18222 1 46 . 1 1 9 9 VAL H H 1 7.62 0.01 . 1 . . . A 9 VAL H . 18222 1 47 . 1 1 9 9 VAL HA H 1 4.17 0.01 . 1 . . . A 9 VAL HA . 18222 1 48 . 1 1 9 9 VAL HB H 1 2.11 0.01 . 1 . . . A 9 VAL HB . 18222 1 49 . 1 1 9 9 VAL HG11 H 1 0.89 0.01 . 2 . . . A 9 VAL HG11 . 18222 1 50 . 1 1 9 9 VAL HG12 H 1 0.89 0.01 . 2 . . . A 9 VAL HG12 . 18222 1 51 . 1 1 9 9 VAL HG13 H 1 0.89 0.01 . 2 . . . A 9 VAL HG13 . 18222 1 52 . 1 1 9 9 VAL HG21 H 1 0.89 0.01 . 2 . . . A 9 VAL HG21 . 18222 1 53 . 1 1 9 9 VAL HG22 H 1 0.89 0.01 . 2 . . . A 9 VAL HG22 . 18222 1 54 . 1 1 9 9 VAL HG23 H 1 0.89 0.01 . 2 . . . A 9 VAL HG23 . 18222 1 55 . 1 1 9 9 VAL CA C 13 64.72 0.1 . 1 . . . A 9 VAL CA . 18222 1 56 . 1 1 9 9 VAL CB C 13 30.9 0.1 . 1 . . . A 9 VAL CB . 18222 1 57 . 1 1 9 9 VAL N N 15 119.33 0.1 . 1 . . . A 9 VAL N . 18222 1 58 . 1 1 10 10 ASP H H 1 8.18 0.01 . 1 . . . A 10 ASP H . 18222 1 59 . 1 1 10 10 ASP CA C 13 54.96 0.1 . 1 . . . A 10 ASP CA . 18222 1 60 . 1 1 10 10 ASP CB C 13 37.8 0.1 . 1 . . . A 10 ASP CB . 18222 1 61 . 1 1 10 10 ASP N N 15 119.52 0.1 . 1 . . . A 10 ASP N . 18222 1 62 . 1 1 11 11 ASP H H 1 7.95 0.01 . 1 . . . A 11 ASP H . 18222 1 63 . 1 1 11 11 ASP CA C 13 54.44 0.1 . 1 . . . A 11 ASP CA . 18222 1 64 . 1 1 11 11 ASP CB C 13 37.84 0.1 . 1 . . . A 11 ASP CB . 18222 1 65 . 1 1 11 11 ASP N N 15 121.55 0.1 . 1 . . . A 11 ASP N . 18222 1 66 . 1 1 12 12 ALA H H 1 8.09 0.01 . 1 . . . A 12 ALA H . 18222 1 67 . 1 1 12 12 ALA CA C 13 54.37 0.1 . 1 . . . A 12 ALA CA . 18222 1 68 . 1 1 12 12 ALA CB C 13 24.73 0.1 . 1 . . . A 12 ALA CB . 18222 1 69 . 1 1 12 12 ALA N N 15 120.22 0.1 . 1 . . . A 12 ALA N . 18222 1 70 . 1 1 13 13 VAL H H 1 7.98 0.01 . 1 . . . A 13 VAL H . 18222 1 71 . 1 1 13 13 VAL HA H 1 4.14 0.01 . 1 . . . A 13 VAL HA . 18222 1 72 . 1 1 13 13 VAL HB H 1 2.1 0.01 . 1 . . . A 13 VAL HB . 18222 1 73 . 1 1 13 13 VAL HG11 H 1 0.93 0.01 . 2 . . . A 13 VAL HG11 . 18222 1 74 . 1 1 13 13 VAL HG12 H 1 0.93 0.01 . 2 . . . A 13 VAL HG12 . 18222 1 75 . 1 1 13 13 VAL HG13 H 1 0.93 0.01 . 2 . . . A 13 VAL HG13 . 18222 1 76 . 1 1 13 13 VAL HG21 H 1 0.93 0.01 . 2 . . . A 13 VAL HG21 . 18222 1 77 . 1 1 13 13 VAL HG22 H 1 0.93 0.01 . 2 . . . A 13 VAL HG22 . 18222 1 78 . 1 1 13 13 VAL HG23 H 1 0.93 0.01 . 2 . . . A 13 VAL HG23 . 18222 1 79 . 1 1 13 13 VAL CA C 13 64.9 0.1 . 1 . . . A 13 VAL CA . 18222 1 80 . 1 1 13 13 VAL CB C 13 31 0.1 . 1 . . . A 13 VAL CB . 18222 1 81 . 1 1 13 13 VAL N N 15 116.91 0.1 . 1 . . . A 13 VAL N . 18222 1 82 . 1 1 14 14 ALA H H 1 8.03 0.01 . 1 . . . A 14 ALA H . 18222 1 83 . 1 1 14 14 ALA HA H 1 4.02 0.01 . 1 . . . A 14 ALA HA . 18222 1 84 . 1 1 14 14 ALA HB1 H 1 1.37 0.01 . 1 . . . A 14 ALA HB1 . 18222 1 85 . 1 1 14 14 ALA HB2 H 1 1.37 0.01 . 1 . . . A 14 ALA HB2 . 18222 1 86 . 1 1 14 14 ALA HB3 H 1 1.37 0.01 . 1 . . . A 14 ALA HB3 . 18222 1 87 . 1 1 14 14 ALA CA C 13 53.8 0.1 . 1 . . . A 14 ALA CA . 18222 1 88 . 1 1 14 14 ALA CB C 13 17.79 0.1 . 1 . . . A 14 ALA CB . 18222 1 89 . 1 1 14 14 ALA N N 15 122.2 0.1 . 1 . . . A 14 ALA N . 18222 1 90 . 1 1 15 15 ALA H H 1 7.53 0.01 . 1 . . . A 15 ALA H . 18222 1 91 . 1 1 15 15 ALA HB1 H 1 1.34 0.01 . 1 . . . A 15 ALA HB1 . 18222 1 92 . 1 1 15 15 ALA HB2 H 1 1.34 0.01 . 1 . . . A 15 ALA HB2 . 18222 1 93 . 1 1 15 15 ALA HB3 H 1 1.34 0.01 . 1 . . . A 15 ALA HB3 . 18222 1 94 . 1 1 15 15 ALA CA C 13 53.23 0.1 . 1 . . . A 15 ALA CA . 18222 1 95 . 1 1 15 15 ALA CB C 13 18.01 0.1 . 1 . . . A 15 ALA CB . 18222 1 96 . 1 1 15 15 ALA N N 15 118.6 0.1 . 1 . . . A 15 ALA N . 18222 1 97 . 1 1 16 16 LYS H H 1 7.49 0.01 . 1 . . . A 16 LYS H . 18222 1 98 . 1 1 16 16 LYS HA H 1 4.08 0.01 . 1 . . . A 16 LYS HA . 18222 1 99 . 1 1 16 16 LYS CA C 13 55.67 0.1 . 1 . . . A 16 LYS CA . 18222 1 100 . 1 1 16 16 LYS CB C 13 32.64 0.1 . 1 . . . A 16 LYS CB . 18222 1 101 . 1 1 16 16 LYS N N 15 115.82 0.1 . 1 . . . A 16 LYS N . 18222 1 102 . 1 1 17 17 HIS H H 1 8.13 0.01 . 1 . . . A 17 HIS H . 18222 1 103 . 1 1 17 17 HIS HA H 1 4.1 0.01 . 1 . . . A 17 HIS HA . 18222 1 104 . 1 1 17 17 HIS HB2 H 1 2.99 0.01 . 2 . . . A 17 HIS HB2 . 18222 1 105 . 1 1 17 17 HIS HB3 H 1 2.99 0.01 . 2 . . . A 17 HIS HB3 . 18222 1 106 . 1 1 17 17 HIS CA C 13 52.82 0.1 . 1 . . . A 17 HIS CA . 18222 1 107 . 1 1 17 17 HIS CB C 13 28.4 0.1 . 1 . . . A 17 HIS CB . 18222 1 108 . 1 1 17 17 HIS N N 15 116.79 0.1 . 1 . . . A 17 HIS N . 18222 1 109 . 1 1 18 18 PRO CA C 13 63.8 0.1 . 1 . . . A 18 PRO CA . 18222 1 110 . 1 1 18 18 PRO CB C 13 30.8 0.1 . 1 . . . A 18 PRO CB . 18222 1 111 . 1 1 19 19 GLY H H 1 8.73 0.01 . 1 . . . A 19 GLY H . 18222 1 112 . 1 1 19 19 GLY HA2 H 1 3.94 0.01 . 2 . . . A 19 GLY HA2 . 18222 1 113 . 1 1 19 19 GLY HA3 H 1 3.94 0.01 . 2 . . . A 19 GLY HA3 . 18222 1 114 . 1 1 19 19 GLY CA C 13 45.49 0.1 . 1 . . . A 19 GLY CA . 18222 1 115 . 1 1 19 19 GLY N N 15 110.26 0.1 . 1 . . . A 19 GLY N . 18222 1 116 . 1 1 20 20 LEU H H 1 7.98 0.01 . 1 . . . A 20 LEU H . 18222 1 117 . 1 1 20 20 LEU HA H 1 4.09 0.01 . 1 . . . A 20 LEU HA . 18222 1 118 . 1 1 20 20 LEU HB2 H 1 1.63 0.01 . 2 . . . A 20 LEU HB2 . 18222 1 119 . 1 1 20 20 LEU HB3 H 1 1.63 0.01 . 2 . . . A 20 LEU HB3 . 18222 1 120 . 1 1 20 20 LEU CA C 13 57.06 0.1 . 1 . . . A 20 LEU CA . 18222 1 121 . 1 1 20 20 LEU N N 15 122.65 0.1 . 1 . . . A 20 LEU N . 18222 1 122 . 1 1 21 21 GLY H H 1 8.57 0.01 . 1 . . . A 21 GLY H . 18222 1 123 . 1 1 21 21 GLY HA2 H 1 3.8 0.01 . 2 . . . A 21 GLY HA2 . 18222 1 124 . 1 1 21 21 GLY HA3 H 1 3.64 0.01 . 2 . . . A 21 GLY HA3 . 18222 1 125 . 1 1 21 21 GLY CA C 13 46.71 0.1 . 1 . . . A 21 GLY CA . 18222 1 126 . 1 1 21 21 GLY N N 15 107 0.1 . 1 . . . A 21 GLY N . 18222 1 127 . 1 1 22 22 GLU H H 1 8.1 0.01 . 1 . . . A 22 GLU H . 18222 1 128 . 1 1 22 22 GLU HA H 1 3.99 0.01 . 1 . . . A 22 GLU HA . 18222 1 129 . 1 1 22 22 GLU HB2 H 1 1.94 0.01 . 2 . . . A 22 GLU HB2 . 18222 1 130 . 1 1 22 22 GLU HB3 H 1 1.94 0.01 . 2 . . . A 22 GLU HB3 . 18222 1 131 . 1 1 22 22 GLU HG2 H 1 2.21 0.01 . 2 . . . A 22 GLU HG2 . 18222 1 132 . 1 1 22 22 GLU HG3 H 1 2.21 0.01 . 2 . . . A 22 GLU HG3 . 18222 1 133 . 1 1 22 22 GLU CA C 13 58.28 0.1 . 1 . . . A 22 GLU CA . 18222 1 134 . 1 1 22 22 GLU CB C 13 28.01 0.1 . 1 . . . A 22 GLU CB . 18222 1 135 . 1 1 22 22 GLU N N 15 121.61 0.1 . 1 . . . A 22 GLU N . 18222 1 136 . 1 1 23 23 TYR H H 1 7.91 0.01 . 1 . . . A 23 TYR H . 18222 1 137 . 1 1 23 23 TYR CA C 13 60.38 0.1 . 1 . . . A 23 TYR CA . 18222 1 138 . 1 1 23 23 TYR CB C 13 37.75 0.1 . 1 . . . A 23 TYR CB . 18222 1 139 . 1 1 23 23 TYR N N 15 120.87 0.1 . 1 . . . A 23 TYR N . 18222 1 140 . 1 1 24 24 ALA H H 1 8.41 0.01 . 1 . . . A 24 ALA H . 18222 1 141 . 1 1 24 24 ALA HA H 1 4.14 0.01 . 1 . . . A 24 ALA HA . 18222 1 142 . 1 1 24 24 ALA HB1 H 1 1.35 0.01 . 1 . . . A 24 ALA HB1 . 18222 1 143 . 1 1 24 24 ALA HB2 H 1 1.35 0.01 . 1 . . . A 24 ALA HB2 . 18222 1 144 . 1 1 24 24 ALA HB3 H 1 1.35 0.01 . 1 . . . A 24 ALA HB3 . 18222 1 145 . 1 1 24 24 ALA CA C 13 54.26 0.1 . 1 . . . A 24 ALA CA . 18222 1 146 . 1 1 24 24 ALA N N 15 121.42 0.1 . 1 . . . A 24 ALA N . 18222 1 147 . 1 1 25 25 ALA H H 1 8.09 0.01 . 1 . . . A 25 ALA H . 18222 1 148 . 1 1 25 25 ALA CA C 13 54.37 0.1 . 1 . . . A 25 ALA CA . 18222 1 149 . 1 1 25 25 ALA N N 15 120.22 0.1 . 1 . . . A 25 ALA N . 18222 1 150 . 1 1 26 26 CYS H H 1 7.95 0.01 . 1 . . . A 26 CYS H . 18222 1 151 . 1 1 26 26 CYS CA C 13 61.18 0.1 . 1 . . . A 26 CYS CA . 18222 1 152 . 1 1 26 26 CYS CB C 13 26.39 0.1 . 1 . . . A 26 CYS CB . 18222 1 153 . 1 1 26 26 CYS N N 15 116.76 0.1 . 1 . . . A 26 CYS N . 18222 1 154 . 1 1 27 27 GLN H H 1 8.06 0.01 . 1 . . . A 27 GLN H . 18222 1 155 . 1 1 27 27 GLN CA C 13 55.97 0.1 . 1 . . . A 27 GLN CA . 18222 1 156 . 1 1 27 27 GLN N N 15 118.69 0.1 . 1 . . . A 27 GLN N . 18222 1 157 . 1 1 28 28 SER H H 1 7.98 0.01 . 1 . . . A 28 SER H . 18222 1 158 . 1 1 28 28 SER HA H 1 3.99 0.01 . 1 . . . A 28 SER HA . 18222 1 159 . 1 1 28 28 SER CA C 13 61.11 0.1 . 1 . . . A 28 SER CA . 18222 1 160 . 1 1 28 28 SER N N 15 115.49 0.1 . 1 . . . A 28 SER N . 18222 1 161 . 1 1 29 29 HIS H H 1 8.18 0.01 . 1 . . . A 29 HIS H . 18222 1 162 . 1 1 29 29 HIS CA C 13 58.19 0.1 . 1 . . . A 29 HIS CA . 18222 1 163 . 1 1 29 29 HIS CB C 13 27.46 0.1 . 1 . . . A 29 HIS CB . 18222 1 164 . 1 1 29 29 HIS N N 15 120.88 0.1 . 1 . . . A 29 HIS N . 18222 1 165 . 1 1 30 30 ALA H H 1 8.04 0.01 . 1 . . . A 30 ALA H . 18222 1 166 . 1 1 30 30 ALA CA C 13 54.56 0.1 . 1 . . . A 30 ALA CA . 18222 1 167 . 1 1 30 30 ALA CB C 13 17.49 0.1 . 1 . . . A 30 ALA CB . 18222 1 168 . 1 1 30 30 ALA N N 15 122.92 0.1 . 1 . . . A 30 ALA N . 18222 1 169 . 1 1 31 31 PHE H H 1 8.23 0.01 . 1 . . . A 31 PHE H . 18222 1 170 . 1 1 31 31 PHE HB2 H 1 3.12 0.01 . 2 . . . A 31 PHE HB2 . 18222 1 171 . 1 1 31 31 PHE HB3 H 1 3.12 0.01 . 2 . . . A 31 PHE HB3 . 18222 1 172 . 1 1 31 31 PHE CA C 13 60.37 0.1 . 1 . . . A 31 PHE CA . 18222 1 173 . 1 1 31 31 PHE CB C 13 38.52 0.1 . 1 . . . A 31 PHE CB . 18222 1 174 . 1 1 31 31 PHE N N 15 119.34 0.1 . 1 . . . A 31 PHE N . 18222 1 175 . 1 1 32 32 MET H H 1 8.12 0.01 . 1 . . . A 32 MET H . 18222 1 176 . 1 1 32 32 MET HA H 1 4.05 0.01 . 1 . . . A 32 MET HA . 18222 1 177 . 1 1 32 32 MET HB2 H 1 2.42 0.01 . 2 . . . A 32 MET HB2 . 18222 1 178 . 1 1 32 32 MET HB3 H 1 2.42 0.01 . 2 . . . A 32 MET HB3 . 18222 1 179 . 1 1 32 32 MET HG2 H 1 2.61 0.01 . 2 . . . A 32 MET HG2 . 18222 1 180 . 1 1 32 32 MET HG3 H 1 2.61 0.01 . 2 . . . A 32 MET HG3 . 18222 1 181 . 1 1 32 32 MET CA C 13 58.28 0.1 . 1 . . . A 32 MET CA . 18222 1 182 . 1 1 32 32 MET CB C 13 31.09 0.1 . 1 . . . A 32 MET CB . 18222 1 183 . 1 1 32 32 MET N N 15 118.11 0.1 . 1 . . . A 32 MET N . 18222 1 184 . 1 1 33 33 LYS H H 1 7.97 0.01 . 1 . . . A 33 LYS H . 18222 1 185 . 1 1 33 33 LYS HA H 1 3.93 0.01 . 1 . . . A 33 LYS HA . 18222 1 186 . 1 1 33 33 LYS HB2 H 1 1.75 0.01 . 2 . . . A 33 LYS HB2 . 18222 1 187 . 1 1 33 33 LYS HB3 H 1 1.75 0.01 . 2 . . . A 33 LYS HB3 . 18222 1 188 . 1 1 33 33 LYS CA C 13 59.04 0.1 . 1 . . . A 33 LYS CA . 18222 1 189 . 1 1 33 33 LYS CB C 13 30.99 0.1 . 1 . . . A 33 LYS CB . 18222 1 190 . 1 1 33 33 LYS N N 15 119.04 0.1 . 1 . . . A 33 LYS N . 18222 1 191 . 1 1 34 34 GLY H H 1 8.03 0.01 . 1 . . . A 34 GLY H . 18222 1 192 . 1 1 34 34 GLY HA2 H 1 3.79 0.01 . 2 . . . A 34 GLY HA2 . 18222 1 193 . 1 1 34 34 GLY HA3 H 1 3.79 0.01 . 2 . . . A 34 GLY HA3 . 18222 1 194 . 1 1 34 34 GLY CA C 13 46.61 0.1 . 1 . . . A 34 GLY CA . 18222 1 195 . 1 1 34 34 GLY N N 15 108.84 0.1 . 1 . . . A 34 GLY N . 18222 1 196 . 1 1 35 35 VAL H H 1 8.09 0.01 . 1 . . . A 35 VAL H . 18222 1 197 . 1 1 35 35 VAL HA H 1 4.22 0.01 . 1 . . . A 35 VAL HA . 18222 1 198 . 1 1 35 35 VAL HB H 1 2.02 0.01 . 1 . . . A 35 VAL HB . 18222 1 199 . 1 1 35 35 VAL HG11 H 1 0.63 0.01 . 1 . . . A 35 VAL HG11 . 18222 1 200 . 1 1 35 35 VAL HG12 H 1 0.63 0.01 . 1 . . . A 35 VAL HG12 . 18222 1 201 . 1 1 35 35 VAL HG13 H 1 0.63 0.01 . 1 . . . A 35 VAL HG13 . 18222 1 202 . 1 1 35 35 VAL HG21 H 1 0.77 0.01 . 1 . . . A 35 VAL HG21 . 18222 1 203 . 1 1 35 35 VAL HG22 H 1 0.77 0.01 . 1 . . . A 35 VAL HG22 . 18222 1 204 . 1 1 35 35 VAL HG23 H 1 0.77 0.01 . 1 . . . A 35 VAL HG23 . 18222 1 205 . 1 1 35 35 VAL CA C 13 66.31 0.1 . 1 . . . A 35 VAL CA . 18222 1 206 . 1 1 35 35 VAL CB C 13 30.56 0.1 . 1 . . . A 35 VAL CB . 18222 1 207 . 1 1 35 35 VAL N N 15 122.91 0.1 . 1 . . . A 35 VAL N . 18222 1 208 . 1 1 36 36 PHE H H 1 8.35 0.01 . 1 . . . A 36 PHE H . 18222 1 209 . 1 1 36 36 PHE HB2 H 1 3.1 0.01 . 2 . . . A 36 PHE HB2 . 18222 1 210 . 1 1 36 36 PHE HB3 H 1 3.23 0.01 . 2 . . . A 36 PHE HB3 . 18222 1 211 . 1 1 36 36 PHE CA C 13 61.35 0.1 . 1 . . . A 36 PHE CA . 18222 1 212 . 1 1 36 36 PHE CB C 13 38.09 0.1 . 1 . . . A 36 PHE CB . 18222 1 213 . 1 1 36 36 PHE N N 15 120.02 0.1 . 1 . . . A 36 PHE N . 18222 1 214 . 1 1 37 37 THR H H 1 8.52 0.01 . 1 . . . A 37 THR H . 18222 1 215 . 1 1 37 37 THR HA H 1 4.05 0.01 . 1 . . . A 37 THR HA . 18222 1 216 . 1 1 37 37 THR CA C 13 66 0.1 . 1 . . . A 37 THR CA . 18222 1 217 . 1 1 37 37 THR CB C 13 68.27 0.1 . 1 . . . A 37 THR CB . 18222 1 218 . 1 1 37 37 THR N N 15 116.98 0.1 . 1 . . . A 37 THR N . 18222 1 219 . 1 1 38 38 PHE H H 1 8.01 0.01 . 1 . . . A 38 PHE H . 18222 1 220 . 1 1 38 38 PHE HA H 1 4.36 0.01 . 1 . . . A 38 PHE HA . 18222 1 221 . 1 1 38 38 PHE HB2 H 1 3.14 0.01 . 2 . . . A 38 PHE HB2 . 18222 1 222 . 1 1 38 38 PHE HB3 H 1 3.14 0.01 . 2 . . . A 38 PHE HB3 . 18222 1 223 . 1 1 38 38 PHE CA C 13 61.14 0.1 . 1 . . . A 38 PHE CA . 18222 1 224 . 1 1 38 38 PHE CB C 13 41.2 0.1 . 1 . . . A 38 PHE CB . 18222 1 225 . 1 1 38 38 PHE N N 15 123.09 0.1 . 1 . . . A 38 PHE N . 18222 1 226 . 1 1 39 39 VAL H H 1 8.53 0.01 . 1 . . . A 39 VAL H . 18222 1 227 . 1 1 39 39 VAL HA H 1 4.21 0.01 . 1 . . . A 39 VAL HA . 18222 1 228 . 1 1 39 39 VAL HB H 1 2.07 0.01 . 1 . . . A 39 VAL HB . 18222 1 229 . 1 1 39 39 VAL HG11 H 1 1.17 0.01 . 2 . . . A 39 VAL HG11 . 18222 1 230 . 1 1 39 39 VAL HG12 H 1 1.17 0.01 . 2 . . . A 39 VAL HG12 . 18222 1 231 . 1 1 39 39 VAL HG13 H 1 1.17 0.01 . 2 . . . A 39 VAL HG13 . 18222 1 232 . 1 1 39 39 VAL HG21 H 1 1.17 0.01 . 2 . . . A 39 VAL HG21 . 18222 1 233 . 1 1 39 39 VAL HG22 H 1 1.17 0.01 . 2 . . . A 39 VAL HG22 . 18222 1 234 . 1 1 39 39 VAL HG23 H 1 1.17 0.01 . 2 . . . A 39 VAL HG23 . 18222 1 235 . 1 1 39 39 VAL CA C 13 66 0.1 . 1 . . . A 39 VAL CA . 18222 1 236 . 1 1 39 39 VAL CB C 13 30.86 0.1 . 1 . . . A 39 VAL CB . 18222 1 237 . 1 1 39 39 VAL N N 15 117.28 0.1 . 1 . . . A 39 VAL N . 18222 1 238 . 1 1 40 40 THR H H 1 7.7 0.01 . 1 . . . A 40 THR H . 18222 1 239 . 1 1 40 40 THR HA H 1 4.06 0.01 . 1 . . . A 40 THR HA . 18222 1 240 . 1 1 40 40 THR CA C 13 63.39 0.1 . 1 . . . A 40 THR CA . 18222 1 241 . 1 1 40 40 THR CB C 13 68.65 0.1 . 1 . . . A 40 THR CB . 18222 1 242 . 1 1 40 40 THR N N 15 109.47 0.1 . 1 . . . A 40 THR N . 18222 1 243 . 1 1 41 41 GLY H H 1 7.7 0.01 . 1 . . . A 41 GLY H . 18222 1 244 . 1 1 41 41 GLY HA2 H 1 4.01 0.01 . 2 . . . A 41 GLY HA2 . 18222 1 245 . 1 1 41 41 GLY HA3 H 1 4.01 0.01 . 2 . . . A 41 GLY HA3 . 18222 1 246 . 1 1 41 41 GLY CA C 13 45.58 0.1 . 1 . . . A 41 GLY CA . 18222 1 247 . 1 1 41 41 GLY N N 15 110.77 0.1 . 1 . . . A 41 GLY N . 18222 1 248 . 1 1 42 42 THR H H 1 7.72 0.01 . 1 . . . A 42 THR H . 18222 1 249 . 1 1 42 42 THR CA C 13 63.3 0.1 . 1 . . . A 42 THR CA . 18222 1 250 . 1 1 42 42 THR CB C 13 69.49 0.1 . 1 . . . A 42 THR CB . 18222 1 251 . 1 1 42 42 THR N N 15 114.52 0.1 . 1 . . . A 42 THR N . 18222 1 252 . 1 1 43 43 GLY H H 1 8.11 0.01 . 1 . . . A 43 GLY H . 18222 1 253 . 1 1 43 43 GLY HA2 H 1 3.72 0.01 . 2 . . . A 43 GLY HA2 . 18222 1 254 . 1 1 43 43 GLY HA3 H 1 3.72 0.01 . 2 . . . A 43 GLY HA3 . 18222 1 255 . 1 1 43 43 GLY CA C 13 46.25 0.1 . 1 . . . A 43 GLY CA . 18222 1 256 . 1 1 43 43 GLY N N 15 109.54 0.1 . 1 . . . A 43 GLY N . 18222 1 257 . 1 1 44 44 MET H H 1 7.73 0.01 . 1 . . . A 44 MET H . 18222 1 258 . 1 1 44 44 MET HA H 1 4.1 0.01 . 1 . . . A 44 MET HA . 18222 1 259 . 1 1 44 44 MET HB2 H 1 1.95 0.01 . 2 . . . A 44 MET HB2 . 18222 1 260 . 1 1 44 44 MET HB3 H 1 1.95 0.01 . 2 . . . A 44 MET HB3 . 18222 1 261 . 1 1 44 44 MET HG2 H 1 2.42 0.01 . 2 . . . A 44 MET HG2 . 18222 1 262 . 1 1 44 44 MET HG3 H 1 2.27 0.01 . 2 . . . A 44 MET HG3 . 18222 1 263 . 1 1 44 44 MET CA C 13 57.7 0.1 . 1 . . . A 44 MET CA . 18222 1 264 . 1 1 44 44 MET CB C 13 32.03 0.1 . 1 . . . A 44 MET CB . 18222 1 265 . 1 1 44 44 MET N N 15 120.24 0.1 . 1 . . . A 44 MET N . 18222 1 266 . 1 1 45 45 ALA H H 1 7.95 0.01 . 1 . . . A 45 ALA H . 18222 1 267 . 1 1 45 45 ALA CA C 13 54.44 0.1 . 1 . . . A 45 ALA CA . 18222 1 268 . 1 1 45 45 ALA CB C 13 17.4 0.1 . 1 . . . A 45 ALA CB . 18222 1 269 . 1 1 45 45 ALA N N 15 121.56 0.1 . 1 . . . A 45 ALA N . 18222 1 270 . 1 1 46 46 PHE H H 1 7.86 0.01 . 1 . . . A 46 PHE H . 18222 1 271 . 1 1 46 46 PHE HA H 1 3.93 0.01 . 1 . . . A 46 PHE HA . 18222 1 272 . 1 1 46 46 PHE HB2 H 1 3.05 0.01 . 2 . . . A 46 PHE HB2 . 18222 1 273 . 1 1 46 46 PHE HB3 H 1 3.05 0.01 . 2 . . . A 46 PHE HB3 . 18222 1 274 . 1 1 46 46 PHE CA C 13 59.82 0.1 . 1 . . . A 46 PHE CA . 18222 1 275 . 1 1 46 46 PHE CB C 13 38.26 0.1 . 1 . . . A 46 PHE CB . 18222 1 276 . 1 1 46 46 PHE N N 15 118.26 0.1 . 1 . . . A 46 PHE N . 18222 1 277 . 1 1 47 47 GLY H H 1 8.2 0.01 . 1 . . . A 47 GLY H . 18222 1 278 . 1 1 47 47 GLY HA2 H 1 3.71 0.01 . 2 . . . A 47 GLY HA2 . 18222 1 279 . 1 1 47 47 GLY HA3 H 1 3.71 0.01 . 2 . . . A 47 GLY HA3 . 18222 1 280 . 1 1 47 47 GLY CA C 13 46.56 0.1 . 1 . . . A 47 GLY CA . 18222 1 281 . 1 1 47 47 GLY N N 15 107.3 0.1 . 1 . . . A 47 GLY N . 18222 1 282 . 1 1 48 48 LEU H H 1 8.18 0.01 . 1 . . . A 48 LEU H . 18222 1 283 . 1 1 48 48 LEU HA H 1 4.04 0.01 . 1 . . . A 48 LEU HA . 18222 1 284 . 1 1 48 48 LEU HB2 H 1 1.65 0.01 . 2 . . . A 48 LEU HB2 . 18222 1 285 . 1 1 48 48 LEU HB3 H 1 1.65 0.01 . 2 . . . A 48 LEU HB3 . 18222 1 286 . 1 1 48 48 LEU CA C 13 57.58 0.1 . 1 . . . A 48 LEU CA . 18222 1 287 . 1 1 48 48 LEU CB C 13 40.79 0.1 . 1 . . . A 48 LEU CB . 18222 1 288 . 1 1 48 48 LEU N N 15 121.92 0.1 . 1 . . . A 48 LEU N . 18222 1 289 . 1 1 49 49 GLN H H 1 8.08 0.01 . 1 . . . A 49 GLN H . 18222 1 290 . 1 1 49 49 GLN HA H 1 3.83 0.01 . 1 . . . A 49 GLN HA . 18222 1 291 . 1 1 49 49 GLN HB2 H 1 1.66 0.01 . 2 . . . A 49 GLN HB2 . 18222 1 292 . 1 1 49 49 GLN HB3 H 1 1.66 0.01 . 2 . . . A 49 GLN HB3 . 18222 1 293 . 1 1 49 49 GLN HG2 H 1 2.01 0.01 . 2 . . . A 49 GLN HG2 . 18222 1 294 . 1 1 49 49 GLN HG3 H 1 2.01 0.01 . 2 . . . A 49 GLN HG3 . 18222 1 295 . 1 1 49 49 GLN CA C 13 58.88 0.1 . 1 . . . A 49 GLN CA . 18222 1 296 . 1 1 49 49 GLN CB C 13 27.24 0.1 . 1 . . . A 49 GLN CB . 18222 1 297 . 1 1 49 49 GLN N N 15 118.27 0.1 . 1 . . . A 49 GLN N . 18222 1 298 . 1 1 50 50 MET H H 1 7.88 0.01 . 1 . . . A 50 MET H . 18222 1 299 . 1 1 50 50 MET HA H 1 4.01 0.01 . 1 . . . A 50 MET HA . 18222 1 300 . 1 1 50 50 MET HB2 H 1 2.01 0.01 . 2 . . . A 50 MET HB2 . 18222 1 301 . 1 1 50 50 MET HB3 H 1 2.01 0.01 . 2 . . . A 50 MET HB3 . 18222 1 302 . 1 1 50 50 MET HG2 H 1 2.23 0.01 . 2 . . . A 50 MET HG2 . 18222 1 303 . 1 1 50 50 MET HG3 H 1 2.23 0.01 . 2 . . . A 50 MET HG3 . 18222 1 304 . 1 1 50 50 MET CA C 13 57.73 0.1 . 1 . . . A 50 MET CA . 18222 1 305 . 1 1 50 50 MET CB C 13 27.16 0.1 . 1 . . . A 50 MET CB . 18222 1 306 . 1 1 50 50 MET N N 15 117.63 0.1 . 1 . . . A 50 MET N . 18222 1 307 . 1 1 51 51 PHE H H 1 7.89 0.01 . 1 . . . A 51 PHE H . 18222 1 308 . 1 1 51 51 PHE CA C 13 60.85 0.1 . 1 . . . A 51 PHE CA . 18222 1 309 . 1 1 51 51 PHE CB C 13 38.72 0.1 . 1 . . . A 51 PHE CB . 18222 1 310 . 1 1 51 51 PHE N N 15 119.55 0.1 . 1 . . . A 51 PHE N . 18222 1 311 . 1 1 52 52 ILE H H 1 8.11 0.01 . 1 . . . A 52 ILE H . 18222 1 312 . 1 1 52 52 ILE HA H 1 4.05 0.01 . 1 . . . A 52 ILE HA . 18222 1 313 . 1 1 52 52 ILE HB H 1 1.93 0.01 . 1 . . . A 52 ILE HB . 18222 1 314 . 1 1 52 52 ILE CA C 13 63.56 0.1 . 1 . . . A 52 ILE CA . 18222 1 315 . 1 1 52 52 ILE CB C 13 36.81 0.1 . 1 . . . A 52 ILE CB . 18222 1 316 . 1 1 52 52 ILE N N 15 117.95 0.1 . 1 . . . A 52 ILE N . 18222 1 317 . 1 1 53 53 GLN H H 1 7.93 0.01 . 1 . . . A 53 GLN H . 18222 1 318 . 1 1 53 53 GLN CA C 13 57.2 0.1 . 1 . . . A 53 GLN CA . 18222 1 319 . 1 1 53 53 GLN CB C 13 27.87 0.1 . 1 . . . A 53 GLN CB . 18222 1 320 . 1 1 53 53 GLN N N 15 117.36 0.1 . 1 . . . A 53 GLN N . 18222 1 321 . 1 1 54 54 ARG H H 1 7.54 0.01 . 1 . . . A 54 ARG H . 18222 1 322 . 1 1 54 54 ARG HA H 1 3.95 0.01 . 1 . . . A 54 ARG HA . 18222 1 323 . 1 1 54 54 ARG HB2 H 1 1.67 0.01 . 2 . . . A 54 ARG HB2 . 18222 1 324 . 1 1 54 54 ARG HB3 H 1 1.67 0.01 . 2 . . . A 54 ARG HB3 . 18222 1 325 . 1 1 54 54 ARG CA C 13 56.48 0.1 . 1 . . . A 54 ARG CA . 18222 1 326 . 1 1 54 54 ARG CB C 13 28.97 0.1 . 1 . . . A 54 ARG CB . 18222 1 327 . 1 1 54 54 ARG N N 15 116.84 0.1 . 1 . . . A 54 ARG N . 18222 1 328 . 1 1 55 55 LYS H H 1 7.66 0.01 . 1 . . . A 55 LYS H . 18222 1 329 . 1 1 55 55 LYS HA H 1 4.08 0.01 . 1 . . . A 55 LYS HA . 18222 1 330 . 1 1 55 55 LYS CA C 13 55.03 0.1 . 1 . . . A 55 LYS CA . 18222 1 331 . 1 1 55 55 LYS CB C 13 32.01 0.1 . 1 . . . A 55 LYS CB . 18222 1 332 . 1 1 55 55 LYS N N 15 117.9 0.1 . 1 . . . A 55 LYS N . 18222 1 333 . 1 1 56 56 PHE H H 1 8.08 0.01 . 1 . . . A 56 PHE H . 18222 1 334 . 1 1 56 56 PHE HB2 H 1 2.83 0.01 . 2 . . . A 56 PHE HB2 . 18222 1 335 . 1 1 56 56 PHE HB3 H 1 2.98 0.01 . 2 . . . A 56 PHE HB3 . 18222 1 336 . 1 1 56 56 PHE CA C 13 55.19 0.1 . 1 . . . A 56 PHE CA . 18222 1 337 . 1 1 56 56 PHE CB C 13 38.97 0.1 . 1 . . . A 56 PHE CB . 18222 1 338 . 1 1 56 56 PHE N N 15 121.06 0.1 . 1 . . . A 56 PHE N . 18222 1 339 . 1 1 57 57 PRO CA C 13 62.39 0.1 . 1 . . . A 57 PRO CA . 18222 1 340 . 1 1 57 57 PRO CB C 13 30.58 0.1 . 1 . . . A 57 PRO CB . 18222 1 341 . 1 1 58 58 TYR H H 1 7.7 0.01 . 1 . . . A 58 TYR H . 18222 1 342 . 1 1 58 58 TYR CA C 13 55.77 0.1 . 1 . . . A 58 TYR CA . 18222 1 343 . 1 1 58 58 TYR CB C 13 40.22 0.1 . 1 . . . A 58 TYR CB . 18222 1 344 . 1 1 58 58 TYR N N 15 120.24 0.1 . 1 . . . A 58 TYR N . 18222 1 345 . 1 1 59 59 PRO CA C 13 62.13 0.1 . 1 . . . A 59 PRO CA . 18222 1 346 . 1 1 59 59 PRO CB C 13 33.34 0.1 . 1 . . . A 59 PRO CB . 18222 1 347 . 1 1 60 60 LEU H H 1 7.88 0.01 . 1 . . . A 60 LEU H . 18222 1 348 . 1 1 60 60 LEU CA C 13 54.25 0.1 . 1 . . . A 60 LEU CA . 18222 1 349 . 1 1 60 60 LEU CB C 13 41.47 0.1 . 1 . . . A 60 LEU CB . 18222 1 350 . 1 1 60 60 LEU N N 15 122.21 0.1 . 1 . . . A 60 LEU N . 18222 1 351 . 1 1 61 61 GLN H H 1 7.97 0.01 . 1 . . . A 61 GLN H . 18222 1 352 . 1 1 61 61 GLN CA C 13 54.17 0.1 . 1 . . . A 61 GLN CA . 18222 1 353 . 1 1 61 61 GLN N N 15 122.47 0.1 . 1 . . . A 61 GLN N . 18222 1 354 . 1 1 62 62 TRP H H 1 8.24 0.01 . 1 . . . A 62 TRP H . 18222 1 355 . 1 1 62 62 TRP HB2 H 1 3.18 0.01 . 2 . . . A 62 TRP HB2 . 18222 1 356 . 1 1 62 62 TRP HB3 H 1 3.18 0.01 . 2 . . . A 62 TRP HB3 . 18222 1 357 . 1 1 62 62 TRP CA C 13 59.83 0.1 . 1 . . . A 62 TRP CA . 18222 1 358 . 1 1 62 62 TRP CB C 13 28.8 0.1 . 1 . . . A 62 TRP CB . 18222 1 359 . 1 1 62 62 TRP N N 15 124.59 0.1 . 1 . . . A 62 TRP N . 18222 1 360 . 1 1 63 63 SER H H 1 8.41 0.01 . 1 . . . A 63 SER H . 18222 1 361 . 1 1 63 63 SER CA C 13 61.1 0.1 . 1 . . . A 63 SER CA . 18222 1 362 . 1 1 63 63 SER N N 15 113.32 0.1 . 1 . . . A 63 SER N . 18222 1 363 . 1 1 64 64 LEU H H 1 7.23 0.01 . 1 . . . A 64 LEU H . 18222 1 364 . 1 1 64 64 LEU CA C 13 56.88 0.1 . 1 . . . A 64 LEU CA . 18222 1 365 . 1 1 64 64 LEU CB C 13 40.83 0.1 . 1 . . . A 64 LEU CB . 18222 1 366 . 1 1 64 64 LEU N N 15 123.23 0.1 . 1 . . . A 64 LEU N . 18222 1 367 . 1 1 65 65 LEU H H 1 7.51 0.01 . 1 . . . A 65 LEU H . 18222 1 368 . 1 1 65 65 LEU HA H 1 3.89 0.01 . 1 . . . A 65 LEU HA . 18222 1 369 . 1 1 65 65 LEU HB2 H 1 1.62 0.01 . 2 . . . A 65 LEU HB2 . 18222 1 370 . 1 1 65 65 LEU HB3 H 1 1.62 0.01 . 2 . . . A 65 LEU HB3 . 18222 1 371 . 1 1 65 65 LEU HG H 1 1.45 0.01 . 1 . . . A 65 LEU HG . 18222 1 372 . 1 1 65 65 LEU CA C 13 57.58 0.1 . 1 . . . A 65 LEU CA . 18222 1 373 . 1 1 65 65 LEU CB C 13 40.71 0.1 . 1 . . . A 65 LEU CB . 18222 1 374 . 1 1 65 65 LEU N N 15 119.4 0.1 . 1 . . . A 65 LEU N . 18222 1 375 . 1 1 66 66 VAL H H 1 7.95 0.01 . 1 . . . A 66 VAL H . 18222 1 376 . 1 1 66 66 VAL HA H 1 3.96 0.01 . 1 . . . A 66 VAL HA . 18222 1 377 . 1 1 66 66 VAL HB H 1 1.94 0.01 . 1 . . . A 66 VAL HB . 18222 1 378 . 1 1 66 66 VAL CA C 13 66.26 0.1 . 1 . . . A 66 VAL CA . 18222 1 379 . 1 1 66 66 VAL CB C 13 30.57 0.1 . 1 . . . A 66 VAL CB . 18222 1 380 . 1 1 66 66 VAL N N 15 116.95 0.1 . 1 . . . A 66 VAL N . 18222 1 381 . 1 1 67 67 ALA H H 1 7.45 0.01 . 1 . . . A 67 ALA H . 18222 1 382 . 1 1 67 67 ALA HA H 1 4 0.01 . 1 . . . A 67 ALA HA . 18222 1 383 . 1 1 67 67 ALA HB1 H 1 1.44 0.01 . 1 . . . A 67 ALA HB1 . 18222 1 384 . 1 1 67 67 ALA HB2 H 1 1.44 0.01 . 1 . . . A 67 ALA HB2 . 18222 1 385 . 1 1 67 67 ALA HB3 H 1 1.44 0.01 . 1 . . . A 67 ALA HB3 . 18222 1 386 . 1 1 67 67 ALA CA C 13 54.78 0.1 . 1 . . . A 67 ALA CA . 18222 1 387 . 1 1 67 67 ALA CB C 13 17.44 0.1 . 1 . . . A 67 ALA CB . 18222 1 388 . 1 1 67 67 ALA N N 15 120.65 0.1 . 1 . . . A 67 ALA N . 18222 1 389 . 1 1 68 68 VAL H H 1 7.96 0.01 . 1 . . . A 68 VAL H . 18222 1 390 . 1 1 68 68 VAL HA H 1 3.75 0.01 . 1 . . . A 68 VAL HA . 18222 1 391 . 1 1 68 68 VAL HB H 1 2.11 0.01 . 1 . . . A 68 VAL HB . 18222 1 392 . 1 1 68 68 VAL HG11 H 1 0.99 0.01 . 2 . . . A 68 VAL HG11 . 18222 1 393 . 1 1 68 68 VAL HG12 H 1 0.99 0.01 . 2 . . . A 68 VAL HG12 . 18222 1 394 . 1 1 68 68 VAL HG13 H 1 0.99 0.01 . 2 . . . A 68 VAL HG13 . 18222 1 395 . 1 1 68 68 VAL HG21 H 1 0.99 0.01 . 2 . . . A 68 VAL HG21 . 18222 1 396 . 1 1 68 68 VAL HG22 H 1 0.99 0.01 . 2 . . . A 68 VAL HG22 . 18222 1 397 . 1 1 68 68 VAL HG23 H 1 0.99 0.01 . 2 . . . A 68 VAL HG23 . 18222 1 398 . 1 1 68 68 VAL CA C 13 65.25 0.1 . 1 . . . A 68 VAL CA . 18222 1 399 . 1 1 68 68 VAL CB C 13 30.85 0.1 . 1 . . . A 68 VAL CB . 18222 1 400 . 1 1 68 68 VAL N N 15 118.44 0.1 . 1 . . . A 68 VAL N . 18222 1 401 . 1 1 69 69 VAL H H 1 8.08 0.01 . 1 . . . A 69 VAL H . 18222 1 402 . 1 1 69 69 VAL HA H 1 4.22 0.01 . 1 . . . A 69 VAL HA . 18222 1 403 . 1 1 69 69 VAL HB H 1 2.1 0.01 . 1 . . . A 69 VAL HB . 18222 1 404 . 1 1 69 69 VAL CA C 13 66.02 0.1 . 1 . . . A 69 VAL CA . 18222 1 405 . 1 1 69 69 VAL CB C 13 30.85 0.1 . 1 . . . A 69 VAL CB . 18222 1 406 . 1 1 69 69 VAL N N 15 120.8 0.1 . 1 . . . A 69 VAL N . 18222 1 407 . 1 1 70 70 ALA H H 1 8.66 0.01 . 1 . . . A 70 ALA H . 18222 1 408 . 1 1 70 70 ALA HA H 1 3.92 0.01 . 1 . . . A 70 ALA HA . 18222 1 409 . 1 1 70 70 ALA HB1 H 1 1.36 0.01 . 1 . . . A 70 ALA HB1 . 18222 1 410 . 1 1 70 70 ALA HB2 H 1 1.36 0.01 . 1 . . . A 70 ALA HB2 . 18222 1 411 . 1 1 70 70 ALA HB3 H 1 1.36 0.01 . 1 . . . A 70 ALA HB3 . 18222 1 412 . 1 1 70 70 ALA CA C 13 54.92 0.1 . 1 . . . A 70 ALA CA . 18222 1 413 . 1 1 70 70 ALA CB C 13 17.62 0.1 . 1 . . . A 70 ALA CB . 18222 1 414 . 1 1 70 70 ALA N N 15 121.74 0.1 . 1 . . . A 70 ALA N . 18222 1 415 . 1 1 71 71 GLY H H 1 8.01 0.01 . 1 . . . A 71 GLY H . 18222 1 416 . 1 1 71 71 GLY HA2 H 1 3.84 0.01 . 2 . . . A 71 GLY HA2 . 18222 1 417 . 1 1 71 71 GLY HA3 H 1 3.84 0.01 . 2 . . . A 71 GLY HA3 . 18222 1 418 . 1 1 71 71 GLY CA C 13 46.3 0.1 . 1 . . . A 71 GLY CA . 18222 1 419 . 1 1 71 71 GLY N N 15 103.45 0.1 . 1 . . . A 71 GLY N . 18222 1 420 . 1 1 72 72 SER H H 1 7.87 0.01 . 1 . . . A 72 SER H . 18222 1 421 . 1 1 72 72 SER CA C 13 61.26 0.1 . 1 . . . A 72 SER CA . 18222 1 422 . 1 1 72 72 SER CB C 13 62.87 0.1 . 1 . . . A 72 SER CB . 18222 1 423 . 1 1 72 72 SER N N 15 118.16 0.1 . 1 . . . A 72 SER N . 18222 1 424 . 1 1 73 73 VAL H H 1 8.05 0.01 . 1 . . . A 73 VAL H . 18222 1 425 . 1 1 73 73 VAL CA C 13 65.75 0.1 . 1 . . . A 73 VAL CA . 18222 1 426 . 1 1 73 73 VAL CB C 13 30.74 0.1 . 1 . . . A 73 VAL CB . 18222 1 427 . 1 1 73 73 VAL N N 15 121.34 0.1 . 1 . . . A 73 VAL N . 18222 1 428 . 1 1 74 74 VAL H H 1 7.88 0.01 . 1 . . . A 74 VAL H . 18222 1 429 . 1 1 74 74 VAL CA C 13 65.77 0.1 . 1 . . . A 74 VAL CA . 18222 1 430 . 1 1 74 74 VAL CB C 13 30.74 0.1 . 1 . . . A 74 VAL CB . 18222 1 431 . 1 1 74 74 VAL N N 15 118.68 0.1 . 1 . . . A 74 VAL N . 18222 1 432 . 1 1 75 75 SER H H 1 7.87 0.01 . 1 . . . A 75 SER H . 18222 1 433 . 1 1 75 75 SER HA H 1 4.1 0.01 . 1 . . . A 75 SER HA . 18222 1 434 . 1 1 75 75 SER CA C 13 60.87 0.1 . 1 . . . A 75 SER CA . 18222 1 435 . 1 1 75 75 SER CB C 13 62.34 0.1 . 1 . . . A 75 SER CB . 18222 1 436 . 1 1 75 75 SER N N 15 114.75 0.1 . 1 . . . A 75 SER N . 18222 1 437 . 1 1 76 76 TYR H H 1 7.86 0.01 . 1 . . . A 76 TYR H . 18222 1 438 . 1 1 76 76 TYR CA C 13 60.05 0.1 . 1 . . . A 76 TYR CA . 18222 1 439 . 1 1 76 76 TYR CB C 13 37.98 0.1 . 1 . . . A 76 TYR CB . 18222 1 440 . 1 1 76 76 TYR N N 15 121.11 0.1 . 1 . . . A 76 TYR N . 18222 1 441 . 1 1 77 77 GLY H H 1 8.2 0.01 . 1 . . . A 77 GLY H . 18222 1 442 . 1 1 77 77 GLY HA2 H 1 3.71 0.01 . 2 . . . A 77 GLY HA2 . 18222 1 443 . 1 1 77 77 GLY HA3 H 1 3.71 0.01 . 2 . . . A 77 GLY HA3 . 18222 1 444 . 1 1 77 77 GLY CA C 13 46.56 0.1 . 1 . . . A 77 GLY CA . 18222 1 445 . 1 1 77 77 GLY N N 15 107.3 0.1 . 1 . . . A 77 GLY N . 18222 1 446 . 1 1 78 78 VAL H H 1 8.14 0.01 . 1 . . . A 78 VAL H . 18222 1 447 . 1 1 78 78 VAL HA H 1 4.17 0.01 . 1 . . . A 78 VAL HA . 18222 1 448 . 1 1 78 78 VAL HB H 1 2.1 0.01 . 1 . . . A 78 VAL HB . 18222 1 449 . 1 1 78 78 VAL CA C 13 64.65 0.1 . 1 . . . A 78 VAL CA . 18222 1 450 . 1 1 78 78 VAL N N 15 119.47 0.1 . 1 . . . A 78 VAL N . 18222 1 451 . 1 1 79 79 THR H H 1 7.64 0.01 . 1 . . . A 79 THR H . 18222 1 452 . 1 1 79 79 THR CA C 13 63.46 0.1 . 1 . . . A 79 THR CA . 18222 1 453 . 1 1 79 79 THR CB C 13 68.65 0.1 . 1 . . . A 79 THR CB . 18222 1 454 . 1 1 79 79 THR N N 15 112.1 0.1 . 1 . . . A 79 THR N . 18222 1 455 . 1 1 80 80 ARG H H 1 7.68 0.01 . 1 . . . A 80 ARG H . 18222 1 456 . 1 1 80 80 ARG HA H 1 4.16 0.01 . 1 . . . A 80 ARG HA . 18222 1 457 . 1 1 80 80 ARG HB2 H 1 1.64 0.01 . 2 . . . A 80 ARG HB2 . 18222 1 458 . 1 1 80 80 ARG HB3 H 1 1.64 0.01 . 2 . . . A 80 ARG HB3 . 18222 1 459 . 1 1 80 80 ARG CA C 13 56.79 0.1 . 1 . . . A 80 ARG CA . 18222 1 460 . 1 1 80 80 ARG CB C 13 29.43 0.1 . 1 . . . A 80 ARG CB . 18222 1 461 . 1 1 80 80 ARG N N 15 120.77 0.1 . 1 . . . A 80 ARG N . 18222 1 462 . 1 1 81 81 VAL H H 1 7.73 0.01 . 1 . . . A 81 VAL H . 18222 1 463 . 1 1 81 81 VAL HA H 1 3.92 0.01 . 1 . . . A 81 VAL HA . 18222 1 464 . 1 1 81 81 VAL HB H 1 2.05 0.01 . 1 . . . A 81 VAL HB . 18222 1 465 . 1 1 81 81 VAL CA C 13 63.34 0.1 . 1 . . . A 81 VAL CA . 18222 1 466 . 1 1 81 81 VAL CB C 13 31.26 0.1 . 1 . . . A 81 VAL CB . 18222 1 467 . 1 1 81 81 VAL N N 15 118.37 0.1 . 1 . . . A 81 VAL N . 18222 1 468 . 1 1 82 82 GLU H H 1 7.92 0.01 . 1 . . . A 82 GLU H . 18222 1 469 . 1 1 82 82 GLU CA C 13 56.32 0.1 . 1 . . . A 82 GLU CA . 18222 1 470 . 1 1 82 82 GLU CB C 13 27.93 0.1 . 1 . . . A 82 GLU CB . 18222 1 471 . 1 1 82 82 GLU N N 15 120.62 0.1 . 1 . . . A 82 GLU N . 18222 1 472 . 1 1 83 83 SER H H 1 7.96 0.01 . 1 . . . A 83 SER H . 18222 1 473 . 1 1 83 83 SER CA C 13 59.25 0.1 . 1 . . . A 83 SER CA . 18222 1 474 . 1 1 83 83 SER CB C 13 63.16 0.1 . 1 . . . A 83 SER CB . 18222 1 475 . 1 1 83 83 SER N N 15 116.24 0.1 . 1 . . . A 83 SER N . 18222 1 476 . 1 1 84 84 GLU H H 1 8.47 0.01 . 1 . . . A 84 GLU H . 18222 1 477 . 1 1 84 84 GLU HA H 1 4.08 0.01 . 1 . . . A 84 GLU HA . 18222 1 478 . 1 1 84 84 GLU HB2 H 1 2.01 0.01 . 2 . . . A 84 GLU HB2 . 18222 1 479 . 1 1 84 84 GLU HB3 H 1 2.01 0.01 . 2 . . . A 84 GLU HB3 . 18222 1 480 . 1 1 84 84 GLU HG2 H 1 2.26 0.01 . 2 . . . A 84 GLU HG2 . 18222 1 481 . 1 1 84 84 GLU HG3 H 1 2.26 0.01 . 2 . . . A 84 GLU HG3 . 18222 1 482 . 1 1 84 84 GLU CA C 13 57.86 0.1 . 1 . . . A 84 GLU CA . 18222 1 483 . 1 1 84 84 GLU CB C 13 28.19 0.1 . 1 . . . A 84 GLU CB . 18222 1 484 . 1 1 84 84 GLU N N 15 123.28 0.1 . 1 . . . A 84 GLU N . 18222 1 485 . 1 1 85 85 LYS H H 1 7.94 0.01 . 1 . . . A 85 LYS H . 18222 1 486 . 1 1 85 85 LYS HA H 1 4.1 0.01 . 1 . . . A 85 LYS HA . 18222 1 487 . 1 1 85 85 LYS HB2 H 1 1.77 0.01 . 2 . . . A 85 LYS HB2 . 18222 1 488 . 1 1 85 85 LYS HB3 H 1 1.77 0.01 . 2 . . . A 85 LYS HB3 . 18222 1 489 . 1 1 85 85 LYS CA C 13 57.78 0.1 . 1 . . . A 85 LYS CA . 18222 1 490 . 1 1 85 85 LYS CB C 13 31.38 0.1 . 1 . . . A 85 LYS CB . 18222 1 491 . 1 1 85 85 LYS N N 15 118.65 0.1 . 1 . . . A 85 LYS N . 18222 1 492 . 1 1 86 86 CYS H H 1 7.84 0.01 . 1 . . . A 86 CYS H . 18222 1 493 . 1 1 86 86 CYS CA C 13 60.91 0.1 . 1 . . . A 86 CYS CA . 18222 1 494 . 1 1 86 86 CYS CB C 13 26.74 0.1 . 1 . . . A 86 CYS CB . 18222 1 495 . 1 1 86 86 CYS N N 15 117.07 0.1 . 1 . . . A 86 CYS N . 18222 1 496 . 1 1 87 87 ASN H H 1 8.11 0.01 . 1 . . . A 87 ASN H . 18222 1 497 . 1 1 87 87 ASN HA H 1 4.13 0.01 . 1 . . . A 87 ASN HA . 18222 1 498 . 1 1 87 87 ASN HB2 H 1 2.76 0.01 . 2 . . . A 87 ASN HB2 . 18222 1 499 . 1 1 87 87 ASN HB3 H 1 2.76 0.01 . 2 . . . A 87 ASN HB3 . 18222 1 500 . 1 1 87 87 ASN CA C 13 55.75 0.1 . 1 . . . A 87 ASN CA . 18222 1 501 . 1 1 87 87 ASN CB C 13 38.05 0.1 . 1 . . . A 87 ASN CB . 18222 1 502 . 1 1 87 87 ASN N N 15 119.37 0.1 . 1 . . . A 87 ASN N . 18222 1 503 . 1 1 88 88 ASN H H 1 8.28 0.01 . 1 . . . A 88 ASN H . 18222 1 504 . 1 1 88 88 ASN HA H 1 4.28 0.01 . 1 . . . A 88 ASN HA . 18222 1 505 . 1 1 88 88 ASN HB2 H 1 2.79 0.01 . 2 . . . A 88 ASN HB2 . 18222 1 506 . 1 1 88 88 ASN HB3 H 1 2.79 0.01 . 2 . . . A 88 ASN HB3 . 18222 1 507 . 1 1 88 88 ASN CA C 13 55.19 0.1 . 1 . . . A 88 ASN CA . 18222 1 508 . 1 1 88 88 ASN CB C 13 37.4 0.1 . 1 . . . A 88 ASN CB . 18222 1 509 . 1 1 88 88 ASN N N 15 117.57 0.1 . 1 . . . A 88 ASN N . 18222 1 510 . 1 1 89 89 LEU H H 1 7.79 0.01 . 1 . . . A 89 LEU H . 18222 1 511 . 1 1 89 89 LEU HA H 1 4.07 0.01 . 1 . . . A 89 LEU HA . 18222 1 512 . 1 1 89 89 LEU HB2 H 1 1.56 0.01 . 2 . . . A 89 LEU HB2 . 18222 1 513 . 1 1 89 89 LEU HB3 H 1 1.56 0.01 . 2 . . . A 89 LEU HB3 . 18222 1 514 . 1 1 89 89 LEU CA C 13 57.58 0.1 . 1 . . . A 89 LEU CA . 18222 1 515 . 1 1 89 89 LEU CB C 13 40.49 0.1 . 1 . . . A 89 LEU CB . 18222 1 516 . 1 1 89 89 LEU N N 15 121.94 0.1 . 1 . . . A 89 LEU N . 18222 1 517 . 1 1 90 90 TRP H H 1 7.85 0.01 . 1 . . . A 90 TRP H . 18222 1 518 . 1 1 90 90 TRP CA C 13 59.12 0.1 . 1 . . . A 90 TRP CA . 18222 1 519 . 1 1 90 90 TRP CB C 13 28.8 0.1 . 1 . . . A 90 TRP CB . 18222 1 520 . 1 1 90 90 TRP N N 15 119.22 0.1 . 1 . . . A 90 TRP N . 18222 1 521 . 1 1 91 91 LEU H H 1 7.92 0.01 . 1 . . . A 91 LEU H . 18222 1 522 . 1 1 91 91 LEU CA C 13 57.3 0.1 . 1 . . . A 91 LEU CA . 18222 1 523 . 1 1 91 91 LEU CB C 13 40.61 0.1 . 1 . . . A 91 LEU CB . 18222 1 524 . 1 1 91 91 LEU N N 15 117.87 0.1 . 1 . . . A 91 LEU N . 18222 1 525 . 1 1 92 92 PHE H H 1 7.86 0.01 . 1 . . . A 92 PHE H . 18222 1 526 . 1 1 92 92 PHE CA C 13 60.39 0.1 . 1 . . . A 92 PHE CA . 18222 1 527 . 1 1 92 92 PHE CB C 13 37.98 0.1 . 1 . . . A 92 PHE CB . 18222 1 528 . 1 1 92 92 PHE N N 15 121.28 0.1 . 1 . . . A 92 PHE N . 18222 1 529 . 1 1 93 93 LEU H H 1 7.98 0.01 . 1 . . . A 93 LEU H . 18222 1 530 . 1 1 93 93 LEU CA C 13 56.86 0.1 . 1 . . . A 93 LEU CA . 18222 1 531 . 1 1 93 93 LEU CB C 13 40.55 0.1 . 1 . . . A 93 LEU CB . 18222 1 532 . 1 1 93 93 LEU N N 15 119.86 0.1 . 1 . . . A 93 LEU N . 18222 1 533 . 1 1 94 94 GLU H H 1 7.89 0.01 . 1 . . . A 94 GLU H . 18222 1 534 . 1 1 94 94 GLU HA H 1 3.81 0.01 . 1 . . . A 94 GLU HA . 18222 1 535 . 1 1 94 94 GLU HB2 H 1 1.79 0.01 . 2 . . . A 94 GLU HB2 . 18222 1 536 . 1 1 94 94 GLU HB3 H 1 1.79 0.01 . 2 . . . A 94 GLU HB3 . 18222 1 537 . 1 1 94 94 GLU HG2 H 1 2.08 0.01 . 2 . . . A 94 GLU HG2 . 18222 1 538 . 1 1 94 94 GLU HG3 H 1 2.08 0.01 . 2 . . . A 94 GLU HG3 . 18222 1 539 . 1 1 94 94 GLU CA C 13 57.21 0.1 . 1 . . . A 94 GLU CA . 18222 1 540 . 1 1 94 94 GLU CB C 13 28.47 0.1 . 1 . . . A 94 GLU CB . 18222 1 541 . 1 1 94 94 GLU N N 15 114.66 0.1 . 1 . . . A 94 GLU N . 18222 1 542 . 1 1 95 95 THR H H 1 7.69 0.01 . 1 . . . A 95 THR H . 18222 1 543 . 1 1 95 95 THR CA C 13 62.15 0.1 . 1 . . . A 95 THR CA . 18222 1 544 . 1 1 95 95 THR CB C 13 70.81 0.1 . 1 . . . A 95 THR CB . 18222 1 545 . 1 1 95 95 THR N N 15 108.26 0.1 . 1 . . . A 95 THR N . 18222 1 546 . 1 1 96 96 GLY H H 1 8.24 0.01 . 1 . . . A 96 GLY H . 18222 1 547 . 1 1 96 96 GLY HA2 H 1 3.73 0.01 . 2 . . . A 96 GLY HA2 . 18222 1 548 . 1 1 96 96 GLY HA3 H 1 3.73 0.01 . 2 . . . A 96 GLY HA3 . 18222 1 549 . 1 1 96 96 GLY CA C 13 45.41 0.1 . 1 . . . A 96 GLY CA . 18222 1 550 . 1 1 96 96 GLY N N 15 112.22 0.1 . 1 . . . A 96 GLY N . 18222 1 551 . 1 1 97 97 GLN H H 1 7.64 0.01 . 1 . . . A 97 GLN H . 18222 1 552 . 1 1 97 97 GLN HA H 1 4.2 0.01 . 1 . . . A 97 GLN HA . 18222 1 553 . 1 1 97 97 GLN HB2 H 1 1.69 0.01 . 2 . . . A 97 GLN HB2 . 18222 1 554 . 1 1 97 97 GLN HB3 H 1 1.69 0.01 . 2 . . . A 97 GLN HB3 . 18222 1 555 . 1 1 97 97 GLN HG2 H 1 2.13 0.01 . 2 . . . A 97 GLN HG2 . 18222 1 556 . 1 1 97 97 GLN HG3 H 1 2.13 0.01 . 2 . . . A 97 GLN HG3 . 18222 1 557 . 1 1 97 97 GLN CA C 13 54.43 0.1 . 1 . . . A 97 GLN CA . 18222 1 558 . 1 1 97 97 GLN CB C 13 29.91 0.1 . 1 . . . A 97 GLN CB . 18222 1 559 . 1 1 97 97 GLN N N 15 117.95 0.1 . 1 . . . A 97 GLN N . 18222 1 560 . 1 1 98 98 LEU H H 1 8.27 0.01 . 1 . . . A 98 LEU H . 18222 1 561 . 1 1 98 98 LEU HA H 1 4.36 0.01 . 1 . . . A 98 LEU HA . 18222 1 562 . 1 1 98 98 LEU CA C 13 52.65 0.1 . 1 . . . A 98 LEU CA . 18222 1 563 . 1 1 98 98 LEU CB C 13 40.46 0.1 . 1 . . . A 98 LEU CB . 18222 1 564 . 1 1 98 98 LEU N N 15 123.81 0.1 . 1 . . . A 98 LEU N . 18222 1 565 . 1 1 99 99 PRO CA C 13 63.18 0.1 . 1 . . . A 99 PRO CA . 18222 1 566 . 1 1 99 99 PRO CB C 13 30.84 0.1 . 1 . . . A 99 PRO CB . 18222 1 567 . 1 1 100 100 LYS H H 1 8.09 0.01 . 1 . . . A 100 LYS H . 18222 1 568 . 1 1 100 100 LYS CA C 13 55.73 0.1 . 1 . . . A 100 LYS CA . 18222 1 569 . 1 1 100 100 LYS CB C 13 32.28 0.1 . 1 . . . A 100 LYS CB . 18222 1 570 . 1 1 100 100 LYS N N 15 120.63 0.1 . 1 . . . A 100 LYS N . 18222 1 571 . 1 1 101 101 ASP H H 1 8.19 0.01 . 1 . . . A 101 ASP H . 18222 1 572 . 1 1 101 101 ASP HA H 1 4.19 0.01 . 1 . . . A 101 ASP HA . 18222 1 573 . 1 1 101 101 ASP HB2 H 1 2.58 0.01 . 2 . . . A 101 ASP HB2 . 18222 1 574 . 1 1 101 101 ASP HB3 H 1 2.63 0.01 . 2 . . . A 101 ASP HB3 . 18222 1 575 . 1 1 101 101 ASP CA C 13 54 0.1 . 1 . . . A 101 ASP CA . 18222 1 576 . 1 1 101 101 ASP CB C 13 40.33 0.1 . 1 . . . A 101 ASP CB . 18222 1 577 . 1 1 101 101 ASP N N 15 120.92 0.1 . 1 . . . A 101 ASP N . 18222 1 578 . 1 1 102 102 ARG H H 1 8.13 0.01 . 1 . . . A 102 ARG H . 18222 1 579 . 1 1 102 102 ARG CA C 13 55.59 0.1 . 1 . . . A 102 ARG CA . 18222 1 580 . 1 1 102 102 ARG CB C 13 29.63 0.1 . 1 . . . A 102 ARG CB . 18222 1 581 . 1 1 102 102 ARG N N 15 122.21 0.1 . 1 . . . A 102 ARG N . 18222 1 582 . 1 1 103 103 SER H H 1 8.29 0.01 . 1 . . . A 103 SER H . 18222 1 583 . 1 1 103 103 SER HA H 1 4.28 0.01 . 1 . . . A 103 SER HA . 18222 1 584 . 1 1 103 103 SER HB2 H 1 3.79 0.01 . 2 . . . A 103 SER HB2 . 18222 1 585 . 1 1 103 103 SER HB3 H 1 3.79 0.01 . 2 . . . A 103 SER HB3 . 18222 1 586 . 1 1 103 103 SER CA C 13 58.47 0.1 . 1 . . . A 103 SER CA . 18222 1 587 . 1 1 103 103 SER CB C 13 63.08 0.1 . 1 . . . A 103 SER CB . 18222 1 588 . 1 1 103 103 SER N N 15 117.23 0.1 . 1 . . . A 103 SER N . 18222 1 589 . 1 1 104 104 THR H H 1 8.02 0.01 . 1 . . . A 104 THR H . 18222 1 590 . 1 1 104 104 THR CA C 13 61.57 0.1 . 1 . . . A 104 THR CA . 18222 1 591 . 1 1 104 104 THR CB C 13 69.03 0.1 . 1 . . . A 104 THR CB . 18222 1 592 . 1 1 104 104 THR N N 15 115.43 0.1 . 1 . . . A 104 THR N . 18222 1 593 . 1 1 105 105 ASP H H 1 8.12 0.01 . 1 . . . A 105 ASP H . 18222 1 594 . 1 1 105 105 ASP CA C 13 54.21 0.1 . 1 . . . A 105 ASP CA . 18222 1 595 . 1 1 105 105 ASP CB C 13 40.38 0.1 . 1 . . . A 105 ASP CB . 18222 1 596 . 1 1 105 105 ASP N N 15 122.78 0.1 . 1 . . . A 105 ASP N . 18222 1 597 . 1 1 106 106 GLN H H 1 8.14 0.01 . 1 . . . A 106 GLN H . 18222 1 598 . 1 1 106 106 GLN CA C 13 55.42 0.1 . 1 . . . A 106 GLN CA . 18222 1 599 . 1 1 106 106 GLN CB C 13 28.31 0.1 . 1 . . . A 106 GLN CB . 18222 1 600 . 1 1 106 106 GLN N N 15 120.96 0.1 . 1 . . . A 106 GLN N . 18222 1 601 . 1 1 107 107 ARG H H 1 8.18 0.01 . 1 . . . A 107 ARG H . 18222 1 602 . 1 1 107 107 ARG HA H 1 4.21 0.01 . 1 . . . A 107 ARG HA . 18222 1 603 . 1 1 107 107 ARG HB2 H 1 1.89 0.01 . 2 . . . A 107 ARG HB2 . 18222 1 604 . 1 1 107 107 ARG HB3 H 1 1.89 0.01 . 2 . . . A 107 ARG HB3 . 18222 1 605 . 1 1 107 107 ARG CA C 13 55.56 0.1 . 1 . . . A 107 ARG CA . 18222 1 606 . 1 1 107 107 ARG CB C 13 29.92 0.1 . 1 . . . A 107 ARG CB . 18222 1 607 . 1 1 107 107 ARG N N 15 123.01 0.1 . 1 . . . A 107 ARG N . 18222 1 608 . 1 1 108 108 SER H H 1 7.84 0.01 . 1 . . . A 108 SER H . 18222 1 609 . 1 1 108 108 SER CA C 13 59.54 0.1 . 1 . . . A 108 SER CA . 18222 1 610 . 1 1 108 108 SER CB C 13 64.19 0.1 . 1 . . . A 108 SER CB . 18222 1 611 . 1 1 108 108 SER N N 15 122.88 0.1 . 1 . . . A 108 SER N . 18222 1 stop_ save_