################################### # 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 17947 _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' . . . 17947 1 2 '2D 1H-15N HSQC' . . . 17947 1 3 '3D HNCACB' . . . 17947 1 4 '3D CBCA(CO)NH' . . . 17947 1 5 '2D 1H-1H TOCSY' . . . 17947 1 6 '2D DQF-COSY' . . . 17947 1 7 '2D 1H-1H NOESY' . . . 17947 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 3 3 LEU H H 1 8.72 0.01 . 1 . . . . 4 LEU H . 17947 1 2 . 1 1 4 4 TYR H H 1 7.54 0.01 . 1 . . . . 5 TYR H . 17947 1 3 . 1 1 5 5 GLU H H 1 7.68 0.01 . 1 . . . . 6 GLU H . 17947 1 4 . 1 1 6 6 LYS H H 1 8.22 0.01 . 1 . . . . 7 LYS H . 17947 1 5 . 1 1 7 7 LEU H H 1 7.68 0.01 . 1 . . . . 8 LEU H . 17947 1 6 . 1 1 8 8 GLY H H 1 7.25 0.01 . 1 . . . . 9 GLY H . 17947 1 7 . 1 1 9 9 GLY H H 1 8.20 0.01 . 1 . . . . 10 GLY H . 17947 1 8 . 1 1 10 10 ALA H H 1 8.48 0.01 . 1 . . . . 11 ALA H . 17947 1 9 . 1 1 11 11 ALA H H 1 8.41 0.01 . 1 . . . . 12 ALA H . 17947 1 10 . 1 1 12 12 ALA H H 1 7.40 0.01 . 1 . . . . 13 ALA H . 17947 1 11 . 1 1 12 12 ALA HA H 1 4.05 0.01 . 1 . . . . 13 ALA HA . 17947 1 12 . 1 1 13 13 VAL H H 1 7.80 0.01 . 1 . . . . 14 VAL H . 17947 1 13 . 1 1 13 13 VAL HA H 1 3.25 0.01 . 1 . . . . 14 VAL HA . 17947 1 14 . 1 1 14 14 ASP H H 1 8.17 0.01 . 1 . . . . 15 ASP H . 17947 1 15 . 1 1 15 15 LEU H H 1 7.56 0.01 . 1 . . . . 16 LEU H . 17947 1 16 . 1 1 16 16 ALA H H 1 8.03 0.01 . 1 . . . . 17 ALA H . 17947 1 17 . 1 1 16 16 ALA HA H 1 3.81 0.01 . 1 . . . . 17 ALA HA . 17947 1 18 . 1 1 17 17 VAL H H 1 8.83 0.01 . 1 . . . . 18 VAL H . 17947 1 19 . 1 1 18 18 GLU H H 1 7.88 0.01 . 1 . . . . 19 GLU H . 17947 1 20 . 1 1 19 19 LYS H H 1 8.10 0.01 . 1 . . . . 20 LYS H . 17947 1 21 . 1 1 20 20 PHE H H 1 8.67 0.01 . 1 . . . . 21 PHE H . 17947 1 22 . 1 1 21 21 TYR H H 1 8.89 0.01 . 1 . . . . 22 TYR H . 17947 1 23 . 1 1 22 22 GLY H H 1 7.71 0.01 . 1 . . . . 23 GLY H . 17947 1 24 . 1 1 23 23 LYS H H 1 7.81 0.01 . 1 . . . . 24 LYS H . 17947 1 25 . 1 1 24 24 VAL H H 1 7.73 0.01 . 1 . . . . 25 VAL H . 17947 1 26 . 1 1 25 25 LEU H H 1 7.23 0.01 . 1 . . . . 26 LEU H . 17947 1 27 . 1 1 26 26 ALA H H 1 7.04 0.01 . 1 . . . . 27 ALA H . 17947 1 28 . 1 1 26 26 ALA HA H 1 4.29 0.01 . 1 . . . . 27 ALA HA . 17947 1 29 . 1 1 27 27 ASP H H 1 7.28 0.01 . 1 . . . . 28 ASP H . 17947 1 30 . 1 1 27 27 ASP HA H 1 4.60 0.01 . 1 . . . . 28 ASP HA . 17947 1 31 . 1 1 28 28 GLU H H 1 9.09 0.01 . 1 . . . . 29 GLU H . 17947 1 32 . 1 1 28 28 GLU HA H 1 4.18 0.01 . 1 . . . . 29 GLU HA . 17947 1 33 . 1 1 29 29 ARG H H 1 8.87 0.01 . 1 . . . . 30 ARG H . 17947 1 34 . 1 1 30 30 VAL H H 1 7.37 0.01 . 1 . . . . 31 VAL H . 17947 1 35 . 1 1 30 30 VAL HA H 1 5.20 0.01 . 1 . . . . 31 VAL HA . 17947 1 36 . 1 1 31 31 ASN H H 1 9.00 0.01 . 1 . . . . 32 ASN H . 17947 1 37 . 1 1 31 31 ASN HA H 1 4.12 0.01 . 1 . . . . 32 ASN HA . 17947 1 38 . 1 1 32 32 ARG H H 1 8.36 0.01 . 1 . . . . 33 ARG H . 17947 1 39 . 1 1 33 33 PHE H H 1 7.68 0.01 . 1 . . . . 34 PHE H . 17947 1 40 . 1 1 34 34 PHE H H 1 7.61 0.01 . 1 . . . . 35 PHE H . 17947 1 41 . 1 1 35 35 VAL H H 1 7.56 0.01 . 1 . . . . 36 VAL H . 17947 1 42 . 1 1 36 36 ASN H H 1 8.47 0.01 . 1 . . . . 37 ASN H . 17947 1 43 . 1 1 36 36 ASN HA H 1 4.95 0.01 . 1 . . . . 37 ASN HA . 17947 1 44 . 1 1 37 37 THR H H 1 7.79 0.01 . 1 . . . . 38 THR H . 17947 1 45 . 1 1 38 38 ASP H H 1 8.82 0.01 . 1 . . . . 39 ASP H . 17947 1 46 . 1 1 39 39 MET H H 1 8.73 0.01 . 9 . . . . 40 MET H . 17947 1 47 . 1 1 40 40 ALA H H 1 8.47 0.01 . 1 . . . . 41 ALA H . 17947 1 48 . 1 1 41 41 LYS H H 1 7.65 0.01 . 1 . . . . 42 LYS H . 17947 1 49 . 1 1 42 42 GLN H H 1 8.19 0.01 . 1 . . . . 43 GLN H . 17947 1 50 . 1 1 43 43 LYS H H 1 7.84 0.01 . 1 . . . . 44 LYS H . 17947 1 51 . 1 1 44 44 GLN H H 1 7.72 0.01 . 9 . . . . 45 GLN H . 17947 1 52 . 1 1 45 45 HIS H H 1 7.56 0.01 . 1 . . . . 46 HIS H . 17947 1 53 . 1 1 46 46 GLN H H 1 6.84 0.01 . 1 . . . . 47 GLN H . 17947 1 54 . 1 1 47 47 LYS H H 1 7.77 0.01 . 1 . . . . 48 LYS H . 17947 1 55 . 1 1 48 48 ASP H H 1 8.68 0.01 . 1 . . . . 49 ASP H . 17947 1 56 . 1 1 49 49 PHE H H 1 8.20 0.01 . 1 . . . . 50 PHE H . 17947 1 57 . 1 1 51 51 THR H H 1 8.73 0.01 . 1 . . . . 52 THR H . 17947 1 58 . 1 1 52 52 TYR H H 1 8.45 0.01 . 1 . . . . 53 TYR H . 17947 1 59 . 1 1 53 53 ALA H H 1 8.13 0.01 . 1 . . . . 54 ALA H . 17947 1 60 . 1 1 54 54 PHE H H 1 7.65 0.01 . 1 . . . . 55 PHE H . 17947 1 61 . 1 1 55 55 GLY H H 1 8.16 0.01 . 1 . . . . 56 GLY H . 17947 1 62 . 1 1 56 56 GLY H H 1 8.56 0.01 . 1 . . . . 57 GLY H . 17947 1 63 . 1 1 57 57 THR H H 1 7.71 0.01 . 1 . . . . 58 THR H . 17947 1 64 . 1 1 58 58 ASP H H 1 8.63 0.01 . 1 . . . . 59 ASP H . 17947 1 65 . 1 1 59 59 ARG H H 1 7.39 0.01 . 1 . . . . 60 ARG H . 17947 1 66 . 1 1 62 62 GLY H H 1 9.54 0.02 . 1 . . . . 63 GLY H . 17947 1 67 . 1 1 66 66 ARG H H 1 8.13 0.01 . 1 . . . . 67 ARG H . 17947 1 68 . 1 1 67 67 ALA H H 1 6.95 0.01 . 1 . . . . 68 ALA H . 17947 1 69 . 1 1 67 67 ALA HA H 1 3.85 0.01 . 1 . . . . 68 ALA HA . 17947 1 70 . 1 1 68 68 ALA H H 1 7.63 0.01 . 1 . . . . 69 ALA H . 17947 1 71 . 1 1 69 69 HIS H H 1 5.69 0.01 . 1 . . . . 70 HIS H . 17947 1 72 . 1 1 69 69 HIS HA H 1 3.15 0.01 . 1 . . . . 70 HIS HA . 17947 1 73 . 1 1 70 70 GLN H H 1 6.78 0.01 . 1 . . . . 71 GLN H . 17947 1 74 . 1 1 71 71 ASP H H 1 8.46 0.01 . 1 . . . . 72 ASP H . 17947 1 75 . 1 1 72 72 LEU H H 1 7.19 0.01 . 1 . . . . 73 LEU H . 17947 1 76 . 1 1 72 72 LEU HA H 1 4.08 0.01 . 1 . . . . 73 LEU HA . 17947 1 77 . 1 1 73 73 VAL H H 1 7.39 0.01 . 1 . . . . 74 VAL H . 17947 1 78 . 1 1 74 74 GLU H H 1 8.22 0.01 . 1 . . . . 75 GLU H . 17947 1 79 . 1 1 75 75 ASN H H 1 8.42 0.01 . 1 . . . . 76 ASN H . 17947 1 80 . 1 1 75 75 ASN HA H 1 5.07 0.01 . 1 . . . . 76 ASN HA . 17947 1 81 . 1 1 76 76 ALA H H 1 7.44 0.01 . 1 . . . . 77 ALA H . 17947 1 82 . 1 1 76 76 ALA HA H 1 4.89 0.01 . 1 . . . . 77 ALA HA . 17947 1 83 . 1 1 77 77 GLY H H 1 7.75 0.01 . 1 . . . . 78 GLY H . 17947 1 84 . 1 1 78 78 LEU H H 1 7.33 0.01 . 1 . . . . 79 LEU H . 17947 1 85 . 1 1 78 78 LEU HA H 1 4.45 0.01 . 1 . . . . 79 LEU HA . 17947 1 86 . 1 1 79 79 THR H H 1 11.35 0.01 . 1 . . . . 80 THR H . 17947 1 87 . 1 1 80 80 ASP H H 1 8.88 0.01 . 1 . . . . 81 ASP H . 17947 1 88 . 1 1 81 81 VAL H H 1 7.98 0.01 . 1 . . . . 82 VAL H . 17947 1 89 . 1 1 82 82 HIS H H 1 7.14 0.01 . 1 . . . . 83 HIS H . 17947 1 90 . 1 1 82 82 HIS HA H 1 4.30 0.01 . 1 . . . . 83 HIS HA . 17947 1 91 . 1 1 83 83 PHE H H 1 7.70 0.01 . 1 . . . . 84 PHE H . 17947 1 92 . 1 1 84 84 ASP H H 1 9.04 0.01 . 1 . . . . 85 ASP H . 17947 1 93 . 1 1 84 84 ASP HA H 1 4.64 0.01 . 1 . . . . 85 ASP HA . 17947 1 94 . 1 1 85 85 ALA H H 1 8.10 0.01 . 1 . . . . 86 ALA H . 17947 1 95 . 1 1 85 85 ALA HA H 1 4.19 0.01 . 1 . . . . 86 ALA HA . 17947 1 96 . 1 1 86 86 ILE H H 1 8.15 0.01 . 1 . . . . 87 ILE H . 17947 1 97 . 1 1 87 87 ALA H H 1 7.87 0.01 . 1 . . . . 88 ALA H . 17947 1 98 . 1 1 88 88 GLU H H 1 8.53 0.01 . 1 . . . . 89 GLU H . 17947 1 99 . 1 1 89 89 ASN H H 1 7.92 0.01 . 1 . . . . 90 ASN H . 17947 1 100 . 1 1 90 90 LEU H H 1 7.98 0.01 . 1 . . . . 91 LEU H . 17947 1 101 . 1 1 91 91 VAL H H 1 8.00 0.01 . 1 . . . . 92 VAL H . 17947 1 102 . 1 1 92 92 LEU H H 1 8.58 0.01 . 1 . . . . 93 LEU H . 17947 1 103 . 1 1 93 93 THR H H 1 7.51 0.01 . 1 . . . . 94 THR H . 17947 1 104 . 1 1 94 94 LEU H H 1 7.87 0.01 . 1 . . . . 95 LEU H . 17947 1 105 . 1 1 95 95 GLN H H 1 8.61 0.01 . 1 . . . . 96 GLN H . 17947 1 106 . 1 1 96 96 GLU H H 1 8.25 0.01 . 1 . . . . 97 GLU H . 17947 1 107 . 1 1 97 97 LEU H H 1 7.42 0.01 . 1 . . . . 98 LEU H . 17947 1 108 . 1 1 98 98 ASN H H 1 8.05 0.01 . 1 . . . . 99 ASN H . 17947 1 109 . 1 1 99 99 VAL H H 1 7.60 0.01 . 1 . . . . 100 VAL H . 17947 1 110 . 1 1 100 100 SER H H 1 8.39 0.01 . 1 . . . . 101 SER H . 17947 1 111 . 1 1 101 101 GLN H H 1 8.91 0.01 . 1 . . . . 102 GLN H . 17947 1 112 . 1 1 102 102 ASP H H 1 8.37 0.01 . 1 . . . . 103 ASP H . 17947 1 113 . 1 1 103 103 LEU H H 1 7.29 0.01 . 1 . . . . 104 LEU H . 17947 1 114 . 1 1 104 104 ILE H H 1 7.73 0.01 . 1 . . . . 105 ILE H . 17947 1 115 . 1 1 105 105 ASP H H 1 8.75 0.01 . 1 . . . . 106 ASP H . 17947 1 116 . 1 1 106 106 GLU H H 1 7.33 0.01 . 1 . . . . 107 GLU H . 17947 1 117 . 1 1 107 107 VAL H H 1 7.93 0.01 . 1 . . . . 108 VAL H . 17947 1 118 . 1 1 108 108 VAL H H 1 8.65 0.01 . 1 . . . . 109 VAL H . 17947 1 119 . 1 1 109 109 THR H H 1 7.72 0.01 . 1 . . . . 110 THR H . 17947 1 120 . 1 1 110 110 ILE H H 1 7.87 0.01 . 1 . . . . 111 ILE H . 17947 1 121 . 1 1 111 111 VAL H H 1 9.04 0.01 . 1 . . . . 112 VAL H . 17947 1 122 . 1 1 112 112 GLY H H 1 7.67 0.01 . 1 . . . . 113 GLY H . 17947 1 123 . 1 1 113 113 SER H H 1 7.45 0.01 . 1 . . . . 114 SER H . 17947 1 124 . 1 1 114 114 VAL H H 1 8.62 0.01 . 1 . . . . 115 VAL H . 17947 1 125 . 1 1 115 115 GLN H H 1 8.20 0.01 . 1 . . . . 116 GLN H . 17947 1 126 . 1 1 116 116 HIS H H 1 8.08 0.01 . 1 . . . . 117 HIS H . 17947 1 127 . 1 1 117 117 ARG H H 1 8.00 0.01 . 1 . . . . 118 ARG H . 17947 1 128 . 1 1 118 118 ASN H H 1 8.16 0.01 . 1 . . . . 119 ASN H . 17947 1 129 . 1 1 119 119 ASP H H 1 7.85 0.01 . 1 . . . . 120 ASP H . 17947 1 130 . 1 1 120 120 VAL H H 1 7.86 0.01 . 1 . . . . 121 VAL H . 17947 1 131 . 1 1 120 120 VAL HA H 1 1.76 0.01 . 1 . . . . 121 VAL HA . 17947 1 132 . 1 1 121 121 LEU H H 1 7.34 0.01 . 1 . . . . 122 LEU H . 17947 1 133 . 1 1 122 122 ASN H H 1 7.64 0.01 . 1 . . . . 123 ASN H . 17947 1 134 . 1 1 123 123 ARG H H 1 8.75 0.01 . 1 . . . . 124 ARG H . 17947 1 stop_ save_ ################################### # 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_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 17947 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3 _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 11 '2D 1H-15N HSQC' . . . 17947 2 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 3 3 LEU H H 1 8.76 0.02 . 1 . . . . 4 LEU H . 17947 2 2 . 1 1 3 3 LEU N N 15 123.57 0.2 . 1 . . . . 4 LEU N . 17947 2 3 . 1 1 4 4 TYR H H 1 7.54 0.02 . 1 . . . . 5 TYR H . 17947 2 4 . 1 1 4 4 TYR N N 15 115.48 0.2 . 1 . . . . 5 TYR N . 17947 2 5 . 1 1 5 5 GLU H H 1 7.68 0.02 . 1 . . . . 6 GLU H . 17947 2 6 . 1 1 5 5 GLU N N 15 118.64 0.2 . 1 . . . . 6 GLU N . 17947 2 7 . 1 1 6 6 LYS H H 1 8.22 0.02 . 1 . . . . 7 LYS H . 17947 2 8 . 1 1 6 6 LYS N N 15 118.63 0.2 . 1 . . . . 7 LYS N . 17947 2 9 . 1 1 7 7 LEU H H 1 7.68 0.02 . 1 . . . . 8 LEU H . 17947 2 10 . 1 1 7 7 LEU N N 15 115.04 0.2 . 1 . . . . 8 LEU N . 17947 2 11 . 1 1 8 8 GLY H H 1 7.25 0.02 . 1 . . . . 9 GLY H . 17947 2 12 . 1 1 8 8 GLY N N 15 104 0.2 . 1 . . . . 9 GLY N . 17947 2 13 . 1 1 9 9 GLY H H 1 8.2 0.02 . 1 . . . . 10 GLY H . 17947 2 14 . 1 1 9 9 GLY N N 15 109.25 0.2 . 1 . . . . 10 GLY N . 17947 2 15 . 1 1 10 10 ALA H H 1 8.48 0.02 . 1 . . . . 11 ALA H . 17947 2 16 . 1 1 10 10 ALA N N 15 122.15 0.2 . 1 . . . . 11 ALA N . 17947 2 17 . 1 1 11 11 ALA H H 1 8.41 0.02 . 1 . . . . 12 ALA H . 17947 2 18 . 1 1 11 11 ALA N N 15 119.17 0.2 . 1 . . . . 12 ALA N . 17947 2 19 . 1 1 12 12 ALA H H 1 7.4 0.02 . 1 . . . . 13 ALA H . 17947 2 20 . 1 1 12 12 ALA N N 15 121.14 0.2 . 1 . . . . 13 ALA N . 17947 2 21 . 1 1 13 13 VAL H H 1 7.8 0.02 . 1 . . . . 14 VAL H . 17947 2 22 . 1 1 13 13 VAL N N 15 119.11 0.2 . 1 . . . . 14 VAL N . 17947 2 23 . 1 1 14 14 ASP H H 1 8.17 0.02 . 1 . . . . 15 ASP H . 17947 2 24 . 1 1 14 14 ASP N N 15 118.91 0.2 . 1 . . . . 15 ASP N . 17947 2 25 . 1 1 15 15 LEU H H 1 7.56 0.02 . 1 . . . . 16 LEU H . 17947 2 26 . 1 1 15 15 LEU N N 15 119.98 0.2 . 1 . . . . 16 LEU N . 17947 2 27 . 1 1 16 16 ALA H H 1 8.03 0.02 . 1 . . . . 17 ALA H . 17947 2 28 . 1 1 16 16 ALA N N 15 122.05 0.2 . 1 . . . . 17 ALA N . 17947 2 29 . 1 1 17 17 VAL H H 1 8.83 0.02 . 1 . . . . 18 VAL H . 17947 2 30 . 1 1 17 17 VAL N N 15 118.32 0.2 . 1 . . . . 18 VAL N . 17947 2 31 . 1 1 18 18 GLU H H 1 7.88 0.02 . 1 . . . . 19 GLU H . 17947 2 32 . 1 1 18 18 GLU N N 15 119.24 0.2 . 1 . . . . 19 GLU N . 17947 2 33 . 1 1 19 19 LYS H H 1 8.1 0.02 . 1 . . . . 20 LYS H . 17947 2 34 . 1 1 19 19 LYS N N 15 119.97 0.2 . 1 . . . . 20 LYS N . 17947 2 35 . 1 1 20 20 PHE H H 1 8.67 0.02 . 1 . . . . 21 PHE H . 17947 2 36 . 1 1 20 20 PHE N N 15 122.35 0.2 . 1 . . . . 21 PHE N . 17947 2 37 . 1 1 21 21 TYR H H 1 8.89 0.02 . 1 . . . . 22 TYR H . 17947 2 38 . 1 1 21 21 TYR N N 15 118.93 0.2 . 1 . . . . 22 TYR N . 17947 2 39 . 1 1 22 22 GLY H H 1 7.71 0.02 . 1 . . . . 23 GLY H . 17947 2 40 . 1 1 22 22 GLY N N 15 105.95 0.2 . 1 . . . . 23 GLY N . 17947 2 41 . 1 1 23 23 LYS H H 1 7.81 0.02 . 1 . . . . 24 LYS H . 17947 2 42 . 1 1 23 23 LYS N N 15 121.89 0.2 . 1 . . . . 24 LYS N . 17947 2 43 . 1 1 24 24 VAL H H 1 7.73 0.02 . 1 . . . . 25 VAL H . 17947 2 44 . 1 1 24 24 VAL N N 15 119.22 0.2 . 1 . . . . 25 VAL N . 17947 2 45 . 1 1 25 25 LEU H H 1 7.23 0.02 . 1 . . . . 26 LEU H . 17947 2 46 . 1 1 25 25 LEU N N 15 116.18 0.2 . 1 . . . . 26 LEU N . 17947 2 47 . 1 1 26 26 ALA H H 1 7.04 0.02 . 1 . . . . 27 ALA H . 17947 2 48 . 1 1 26 26 ALA N N 15 119.11 0.2 . 1 . . . . 27 ALA N . 17947 2 49 . 1 1 27 27 ASP H H 1 7.28 0.02 . 1 . . . . 28 ASP H . 17947 2 50 . 1 1 27 27 ASP N N 15 119.8 0.2 . 1 . . . . 28 ASP N . 17947 2 51 . 1 1 28 28 GLU H H 1 9.09 0.02 . 1 . . . . 29 GLU H . 17947 2 52 . 1 1 28 28 GLU N N 15 128.22 0.2 . 1 . . . . 29 GLU N . 17947 2 53 . 1 1 29 29 ARG H H 1 8.87 0.02 . 1 . . . . 30 ARG H . 17947 2 54 . 1 1 29 29 ARG N N 15 117.67 0.2 . 1 . . . . 30 ARG N . 17947 2 55 . 1 1 30 30 VAL H H 1 7.37 0.02 . 1 . . . . 31 VAL H . 17947 2 56 . 1 1 30 30 VAL N N 15 104.84 0.2 . 1 . . . . 31 VAL N . 17947 2 57 . 1 1 31 31 ASN H H 1 9 0.02 . 1 . . . . 32 ASN H . 17947 2 58 . 1 1 31 31 ASN N N 15 122.79 0.2 . 1 . . . . 32 ASN N . 17947 2 59 . 1 1 32 32 ARG H H 1 8.36 0.02 . 1 . . . . 33 ARG H . 17947 2 60 . 1 1 32 32 ARG N N 15 120.5 0.2 . 1 . . . . 33 ARG N . 17947 2 61 . 1 1 33 33 PHE H H 1 7.68 0.02 . 1 . . . . 34 PHE H . 17947 2 62 . 1 1 33 33 PHE N N 15 117.56 0.2 . 1 . . . . 34 PHE N . 17947 2 63 . 1 1 34 34 PHE H H 1 7.61 0.02 . 1 . . . . 35 PHE H . 17947 2 64 . 1 1 34 34 PHE N N 15 113.58 0.2 . 1 . . . . 35 PHE N . 17947 2 65 . 1 1 35 35 VAL H H 1 7.56 0.02 . 1 . . . . 36 VAL H . 17947 2 66 . 1 1 35 35 VAL N N 15 117.06 0.2 . 1 . . . . 36 VAL N . 17947 2 67 . 1 1 36 36 ASN H H 1 8.47 0.02 . 1 . . . . 37 ASN H . 17947 2 68 . 1 1 36 36 ASN N N 15 117.85 0.2 . 1 . . . . 37 ASN N . 17947 2 69 . 1 1 37 37 THR H H 1 7.79 0.02 . 1 . . . . 38 THR H . 17947 2 70 . 1 1 37 37 THR N N 15 117.2 0.2 . 1 . . . . 38 THR N . 17947 2 71 . 1 1 38 38 ASP H H 1 8.82 0.02 . 1 . . . . 39 ASP H . 17947 2 72 . 1 1 38 38 ASP N N 15 126.07 0.2 . 1 . . . . 39 ASP N . 17947 2 73 . 1 1 39 39 MET H H 1 8.73 0.02 . 1 . . . . 40 MET H . 17947 2 74 . 1 1 39 39 MET N N 15 123.54 0.2 . 1 . . . . 40 MET N . 17947 2 75 . 1 1 40 40 ALA H H 1 8.47 0.02 . 1 . . . . 41 ALA H . 17947 2 76 . 1 1 40 40 ALA N N 15 121.12 0.2 . 1 . . . . 41 ALA N . 17947 2 77 . 1 1 41 41 LYS H H 1 7.65 0.02 . 1 . . . . 42 LYS H . 17947 2 78 . 1 1 41 41 LYS N N 15 120.34 0.2 . 1 . . . . 42 LYS N . 17947 2 79 . 1 1 42 42 GLN H H 1 8.19 0.02 . 1 . . . . 43 GLN H . 17947 2 80 . 1 1 42 42 GLN N N 15 120.53 0.2 . 1 . . . . 43 GLN N . 17947 2 81 . 1 1 43 43 LYS H H 1 7.84 0.02 . 1 . . . . 44 LYS H . 17947 2 82 . 1 1 43 43 LYS N N 15 118.04 0.2 . 1 . . . . 44 LYS N . 17947 2 83 . 1 1 44 44 GLN H H 1 7.72 0.02 . 1 . . . . 45 GLN H . 17947 2 84 . 1 1 44 44 GLN N N 15 118.69 0.2 . 1 . . . . 45 GLN N . 17947 2 85 . 1 1 45 45 HIS H H 1 7.56 0.02 . 1 . . . . 46 HIS H . 17947 2 86 . 1 1 45 45 HIS N N 15 118.12 0.2 . 1 . . . . 46 HIS N . 17947 2 87 . 1 1 46 46 GLN H H 1 6.84 0.02 . 1 . . . . 47 GLN H . 17947 2 88 . 1 1 46 46 GLN N N 15 118.5 0.2 . 1 . . . . 47 GLN N . 17947 2 89 . 1 1 47 47 LYS H H 1 7.77 0.02 . 1 . . . . 48 LYS H . 17947 2 90 . 1 1 47 47 LYS N N 15 121.02 0.2 . 1 . . . . 48 LYS N . 17947 2 91 . 1 1 48 48 ASP H H 1 8.68 0.02 . 1 . . . . 49 ASP H . 17947 2 92 . 1 1 48 48 ASP N N 15 126.05 0.2 . 1 . . . . 49 ASP N . 17947 2 93 . 1 1 49 49 PHE H H 1 8.2 0.02 . 1 . . . . 50 PHE H . 17947 2 94 . 1 1 49 49 PHE N N 15 122.13 0.2 . 1 . . . . 50 PHE N . 17947 2 95 . 1 1 50 50 MET H H 1 7.93 0.02 . 1 . . . . 51 MET H . 17947 2 96 . 1 1 50 50 MET N N 15 116.42 0.2 . 1 . . . . 51 MET N . 17947 2 97 . 1 1 51 51 THR H H 1 8.73 0.02 . 1 . . . . 52 THR H . 17947 2 98 . 1 1 51 51 THR N N 15 116.59 0.2 . 1 . . . . 52 THR N . 17947 2 99 . 1 1 52 52 TYR H H 1 8.45 0.02 . 1 . . . . 53 TYR H . 17947 2 100 . 1 1 52 52 TYR N N 15 124.21 0.2 . 1 . . . . 53 TYR N . 17947 2 101 . 1 1 53 53 ALA H H 1 8.12 0.02 . 1 . . . . 54 ALA H . 17947 2 102 . 1 1 53 53 ALA N N 15 119.5 0.2 . 1 . . . . 54 ALA N . 17947 2 103 . 1 1 54 54 PHE H H 1 7.65 0.02 . 1 . . . . 55 PHE H . 17947 2 104 . 1 1 54 54 PHE N N 15 110.63 0.2 . 1 . . . . 55 PHE N . 17947 2 105 . 1 1 55 55 GLY H H 1 8.19 0.02 . 1 . . . . 56 GLY H . 17947 2 106 . 1 1 55 55 GLY N N 15 106.85 0.2 . 1 . . . . 56 GLY N . 17947 2 107 . 1 1 56 56 GLY H H 1 8.56 0.02 . 1 . . . . 57 GLY H . 17947 2 108 . 1 1 56 56 GLY N N 15 113.29 0.2 . 1 . . . . 57 GLY N . 17947 2 109 . 1 1 57 57 THR H H 1 7.71 0.02 . 1 . . . . 58 THR H . 17947 2 110 . 1 1 57 57 THR N N 15 111.14 0.2 . 1 . . . . 58 THR N . 17947 2 111 . 1 1 58 58 ASP H H 1 8.63 0.02 . 1 . . . . 59 ASP H . 17947 2 112 . 1 1 58 58 ASP N N 15 121.83 0.2 . 1 . . . . 59 ASP N . 17947 2 113 . 1 1 59 59 ARG H H 1 7.39 0.02 . 1 . . . . 60 ARG H . 17947 2 114 . 1 1 59 59 ARG N N 15 116.95 0.2 . 1 . . . . 60 ARG N . 17947 2 115 . 1 1 62 62 GLY H H 1 9.54 0.02 . 1 . . . . 63 GLY H . 17947 2 116 . 1 1 62 62 GLY N N 15 111.18 0.2 . 1 . . . . 63 GLY N . 17947 2 117 . 1 1 66 66 ARG H H 1 8.13 0.02 . 1 . . . . 67 ARG H . 17947 2 118 . 1 1 66 66 ARG N N 15 122.39 0.2 . 1 . . . . 67 ARG N . 17947 2 119 . 1 1 67 67 ALA H H 1 6.95 0.02 . 1 . . . . 68 ALA H . 17947 2 120 . 1 1 67 67 ALA N N 15 119.38 0.2 . 1 . . . . 68 ALA N . 17947 2 121 . 1 1 68 68 ALA H H 1 7.63 0.02 . 1 . . . . 69 ALA H . 17947 2 122 . 1 1 68 68 ALA N N 15 117 0.2 . 1 . . . . 69 ALA N . 17947 2 123 . 1 1 69 69 HIS H H 1 5.69 0.02 . 1 . . . . 70 HIS H . 17947 2 124 . 1 1 69 69 HIS N N 15 109.15 0.2 . 1 . . . . 70 HIS N . 17947 2 125 . 1 1 70 70 GLN H H 1 6.78 0.02 . 1 . . . . 71 GLN H . 17947 2 126 . 1 1 70 70 GLN N N 15 121.41 0.2 . 1 . . . . 71 GLN N . 17947 2 127 . 1 1 71 71 ASP H H 1 8.46 0.02 . 1 . . . . 72 ASP H . 17947 2 128 . 1 1 71 71 ASP N N 15 118.64 0.2 . 1 . . . . 72 ASP N . 17947 2 129 . 1 1 72 72 LEU H H 1 7.19 0.02 . 1 . . . . 73 LEU H . 17947 2 130 . 1 1 72 72 LEU N N 15 118.17 0.2 . 1 . . . . 73 LEU N . 17947 2 131 . 1 1 73 73 VAL H H 1 7.39 0.02 . 1 . . . . 74 VAL H . 17947 2 132 . 1 1 73 73 VAL N N 15 120.2 0.2 . 1 . . . . 74 VAL N . 17947 2 133 . 1 1 74 74 GLU H H 1 8.26 0.02 . 1 . . . . 75 GLU H . 17947 2 134 . 1 1 74 74 GLU N N 15 117.18 0.2 . 1 . . . . 75 GLU N . 17947 2 135 . 1 1 75 75 ASN H H 1 8.46 0.02 . 1 . . . . 76 ASN H . 17947 2 136 . 1 1 75 75 ASN N N 15 112.01 0.2 . 1 . . . . 76 ASN N . 17947 2 137 . 1 1 76 76 ALA H H 1 7.48 0.02 . 1 . . . . 77 ALA H . 17947 2 138 . 1 1 76 76 ALA N N 15 121.44 0.2 . 1 . . . . 77 ALA N . 17947 2 139 . 1 1 77 77 GLY H H 1 7.8 0.02 . 1 . . . . 78 GLY H . 17947 2 140 . 1 1 77 77 GLY N N 15 107.35 0.2 . 1 . . . . 78 GLY N . 17947 2 141 . 1 1 78 78 LEU H H 1 7.39 0.02 . 1 . . . . 79 LEU H . 17947 2 142 . 1 1 78 78 LEU N N 15 121.05 0.2 . 1 . . . . 79 LEU N . 17947 2 143 . 1 1 79 79 THR H H 1 11.35 0.02 . 1 . . . . 80 THR H . 17947 2 144 . 1 1 79 79 THR N N 15 126.65 0.2 . 1 . . . . 80 THR N . 17947 2 145 . 1 1 80 80 ASP H H 1 8.88 0.02 . 1 . . . . 81 ASP H . 17947 2 146 . 1 1 80 80 ASP N N 15 121.14 0.2 . 1 . . . . 81 ASP N . 17947 2 147 . 1 1 81 81 VAL H H 1 7.98 0.02 . 1 . . . . 82 VAL H . 17947 2 148 . 1 1 81 81 VAL N N 15 114.41 0.2 . 1 . . . . 82 VAL N . 17947 2 149 . 1 1 82 82 HIS H H 1 7.14 0.02 . 1 . . . . 83 HIS H . 17947 2 150 . 1 1 82 82 HIS N N 15 121.87 0.2 . 1 . . . . 83 HIS N . 17947 2 151 . 1 1 83 83 PHE H H 1 7.7 0.02 . 1 . . . . 84 PHE H . 17947 2 152 . 1 1 83 83 PHE N N 15 120.35 0.2 . 1 . . . . 84 PHE N . 17947 2 153 . 1 1 84 84 ASP H H 1 9.04 0.02 . 1 . . . . 85 ASP H . 17947 2 154 . 1 1 84 84 ASP N N 15 117.56 0.2 . 1 . . . . 85 ASP N . 17947 2 155 . 1 1 85 85 ALA H H 1 8.1 0.02 . 1 . . . . 86 ALA H . 17947 2 156 . 1 1 85 85 ALA N N 15 122.67 0.2 . 1 . . . . 86 ALA N . 17947 2 157 . 1 1 86 86 ILE H H 1 8.15 0.02 . 1 . . . . 87 ILE H . 17947 2 158 . 1 1 86 86 ILE N N 15 117.86 0.2 . 1 . . . . 87 ILE N . 17947 2 159 . 1 1 87 87 ALA H H 1 7.87 0.02 . 1 . . . . 88 ALA H . 17947 2 160 . 1 1 87 87 ALA N N 15 123.43 0.2 . 1 . . . . 88 ALA N . 17947 2 161 . 1 1 88 88 GLU H H 1 8.53 0.02 . 1 . . . . 89 GLU H . 17947 2 162 . 1 1 88 88 GLU N N 15 119.22 0.2 . 1 . . . . 89 GLU N . 17947 2 163 . 1 1 89 89 ASN H H 1 7.92 0.02 . 1 . . . . 90 ASN H . 17947 2 164 . 1 1 89 89 ASN N N 15 116.09 0.2 . 1 . . . . 90 ASN N . 17947 2 165 . 1 1 90 90 LEU H H 1 7.98 0.02 . 1 . . . . 91 LEU H . 17947 2 166 . 1 1 90 90 LEU N N 15 125.39 0.2 . 1 . . . . 91 LEU N . 17947 2 167 . 1 1 91 91 VAL H H 1 8 0.02 . 1 . . . . 92 VAL H . 17947 2 168 . 1 1 91 91 VAL N N 15 121.73 0.2 . 1 . . . . 92 VAL N . 17947 2 169 . 1 1 92 92 LEU H H 1 8.58 0.02 . 1 . . . . 93 LEU H . 17947 2 170 . 1 1 92 92 LEU N N 15 117.79 0.2 . 1 . . . . 93 LEU N . 17947 2 171 . 1 1 93 93 THR H H 1 7.51 0.02 . 1 . . . . 94 THR H . 17947 2 172 . 1 1 93 93 THR N N 15 116.05 0.2 . 1 . . . . 94 THR N . 17947 2 173 . 1 1 94 94 LEU H H 1 7.87 0.02 . 1 . . . . 95 LEU H . 17947 2 174 . 1 1 94 94 LEU N N 15 118.42 0.2 . 1 . . . . 95 LEU N . 17947 2 175 . 1 1 95 95 GLN H H 1 8.61 0.02 . 1 . . . . 96 GLN H . 17947 2 176 . 1 1 95 95 GLN N N 15 118.75 0.2 . 1 . . . . 96 GLN N . 17947 2 177 . 1 1 96 96 GLU H H 1 8.25 0.02 . 1 . . . . 97 GLU H . 17947 2 178 . 1 1 96 96 GLU N N 15 121.49 0.2 . 1 . . . . 97 GLU N . 17947 2 179 . 1 1 97 97 LEU H H 1 7.42 0.02 . 1 . . . . 98 LEU H . 17947 2 180 . 1 1 97 97 LEU N N 15 118.15 0.2 . 1 . . . . 98 LEU N . 17947 2 181 . 1 1 98 98 ASN H H 1 8.05 0.02 . 1 . . . . 99 ASN H . 17947 2 182 . 1 1 98 98 ASN N N 15 115.22 0.2 . 1 . . . . 99 ASN N . 17947 2 183 . 1 1 99 99 VAL H H 1 7.6 0.02 . 1 . . . . 100 VAL H . 17947 2 184 . 1 1 99 99 VAL N N 15 118.92 0.2 . 1 . . . . 100 VAL N . 17947 2 185 . 1 1 100 100 SER H H 1 8.39 0.02 . 1 . . . . 101 SER H . 17947 2 186 . 1 1 100 100 SER N N 15 120.09 0.2 . 1 . . . . 101 SER N . 17947 2 187 . 1 1 101 101 GLN H H 1 8.91 0.02 . 1 . . . . 102 GLN H . 17947 2 188 . 1 1 101 101 GLN N N 15 125.62 0.2 . 1 . . . . 102 GLN N . 17947 2 189 . 1 1 102 102 ASP H H 1 8.37 0.02 . 1 . . . . 103 ASP H . 17947 2 190 . 1 1 102 102 ASP N N 15 115.77 0.2 . 1 . . . . 103 ASP N . 17947 2 191 . 1 1 103 103 LEU H H 1 7.29 0.02 . 1 . . . . 104 LEU H . 17947 2 192 . 1 1 103 103 LEU N N 15 120.99 0.2 . 1 . . . . 104 LEU N . 17947 2 193 . 1 1 104 104 ILE H H 1 7.74 0.02 . 1 . . . . 105 ILE H . 17947 2 194 . 1 1 104 104 ILE N N 15 120.29 0.2 . 1 . . . . 105 ILE N . 17947 2 195 . 1 1 105 105 ASP H H 1 8.75 0.02 . 1 . . . . 106 ASP H . 17947 2 196 . 1 1 105 105 ASP N N 15 118.3 0.2 . 1 . . . . 106 ASP N . 17947 2 197 . 1 1 106 106 GLU H H 1 7.33 0.02 . 1 . . . . 107 GLU H . 17947 2 198 . 1 1 106 106 GLU N N 15 120.79 0.2 . 1 . . . . 107 GLU N . 17947 2 199 . 1 1 107 107 VAL H H 1 7.93 0.02 . 1 . . . . 108 VAL H . 17947 2 200 . 1 1 107 107 VAL N N 15 121.25 0.2 . 1 . . . . 108 VAL N . 17947 2 201 . 1 1 108 108 VAL H H 1 8.65 0.02 . 1 . . . . 109 VAL H . 17947 2 202 . 1 1 108 108 VAL N N 15 119.79 0.2 . 1 . . . . 109 VAL N . 17947 2 203 . 1 1 109 109 THR H H 1 7.72 0.02 . 1 . . . . 110 THR H . 17947 2 204 . 1 1 109 109 THR N N 15 115.76 0.2 . 1 . . . . 110 THR N . 17947 2 205 . 1 1 110 110 ILE H H 1 7.87 0.02 . 1 . . . . 111 ILE H . 17947 2 206 . 1 1 110 110 ILE N N 15 122.92 0.2 . 1 . . . . 111 ILE N . 17947 2 207 . 1 1 111 111 VAL H H 1 9.04 0.02 . 1 . . . . 112 VAL H . 17947 2 208 . 1 1 111 111 VAL N N 15 118.33 0.2 . 1 . . . . 112 VAL N . 17947 2 209 . 1 1 112 112 GLY H H 1 7.67 0.02 . 1 . . . . 113 GLY H . 17947 2 210 . 1 1 112 112 GLY N N 15 104.96 0.2 . 1 . . . . 113 GLY N . 17947 2 211 . 1 1 113 113 SER H H 1 7.49 0.02 . 1 . . . . 114 SER H . 17947 2 212 . 1 1 113 113 SER N N 15 116.72 0.2 . 1 . . . . 114 SER N . 17947 2 213 . 1 1 114 114 VAL H H 1 8.62 0.02 . 1 . . . . 115 VAL H . 17947 2 214 . 1 1 114 114 VAL N N 15 124.53 0.2 . 1 . . . . 115 VAL N . 17947 2 215 . 1 1 115 115 GLN H H 1 8.2 0.02 . 1 . . . . 116 GLN H . 17947 2 216 . 1 1 115 115 GLN N N 15 118.96 0.2 . 1 . . . . 116 GLN N . 17947 2 217 . 1 1 116 116 HIS H H 1 8.08 0.02 . 1 . . . . 117 HIS H . 17947 2 218 . 1 1 116 116 HIS N N 15 118.35 0.2 . 1 . . . . 117 HIS N . 17947 2 219 . 1 1 118 118 ASN H H 1 8.16 0.02 . 1 . . . . 119 ASN H . 17947 2 220 . 1 1 118 118 ASN N N 15 115.24 0.2 . 1 . . . . 119 ASN N . 17947 2 221 . 1 1 119 119 ASP H H 1 7.85 0.02 . 1 . . . . 120 ASP H . 17947 2 222 . 1 1 119 119 ASP N N 15 119.24 0.2 . 1 . . . . 120 ASP N . 17947 2 223 . 1 1 120 120 VAL H H 1 7.86 0.02 . 1 . . . . 121 VAL H . 17947 2 224 . 1 1 120 120 VAL N N 15 119.92 0.2 . 1 . . . . 121 VAL N . 17947 2 225 . 1 1 121 121 LEU H H 1 7.34 0.02 . 1 . . . . 122 LEU H . 17947 2 226 . 1 1 121 121 LEU N N 15 108.76 0.2 . 1 . . . . 122 LEU N . 17947 2 227 . 1 1 122 122 ASN H H 1 7.64 0.02 . 1 . . . . 123 ASN H . 17947 2 228 . 1 1 122 122 ASN N N 15 118.13 0.2 . 1 . . . . 123 ASN N . 17947 2 229 . 1 1 123 123 ARG H H 1 8.75 0.02 . 1 . . . . 124 ARG H . 17947 2 230 . 1 1 123 123 ARG N N 15 123.4 0.2 . 1 . . . . 124 ARG N . 17947 2 stop_ save_