################################### # 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 16307 _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 2 '2D 1H-1H TOCSY' . . . 16307 1 3 '2D 1H-1H NOESY' . . . 16307 1 4 '3D HNCO' . . . 16307 1 6 '3D 1H-13C NOESY' . . . 16307 1 7 '3D HCCC(CO)NH' . . . 16307 1 8 '3D (H)CCC(CO)NH' . . . 16307 1 9 '2D 1H-15N HSQC' . . . 16307 1 12 '2D 1H-1H NOESY' . . . 16307 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 2 2 SER HA H 1 4.6 0.01 . 1 . . . . 3 SER HA . 16307 1 2 . 1 1 2 2 SER HB2 H 1 4.28 0.01 . 2 . . . . 3 SER HB2 . 16307 1 3 . 1 1 2 2 SER HB3 H 1 3.99 0.01 . 2 . . . . 3 SER HB3 . 16307 1 4 . 1 1 2 2 SER C C 13 174.7 0.3 . 1 . . . . 3 SER C . 16307 1 5 . 1 1 2 2 SER CA C 13 57.4 0.3 . 1 . . . . 3 SER CA . 16307 1 6 . 1 1 2 2 SER CB C 13 65.7 0.3 . 1 . . . . 3 SER CB . 16307 1 7 . 1 1 3 3 LEU H H 1 8.78 0.01 . 1 . . . . 4 LEU H . 16307 1 8 . 1 1 3 3 LEU HA H 1 3.68 0.01 . 1 . . . . 4 LEU HA . 16307 1 9 . 1 1 3 3 LEU HB2 H 1 1.55 0.01 . 2 . . . . 4 LEU HB2 . 16307 1 10 . 1 1 3 3 LEU HB3 H 1 1.46 0.01 . 2 . . . . 4 LEU HB3 . 16307 1 11 . 1 1 3 3 LEU HD11 H 1 0.68 0.01 . 2 . . . . 4 LEU HD1 . 16307 1 12 . 1 1 3 3 LEU HD12 H 1 0.68 0.01 . 2 . . . . 4 LEU HD1 . 16307 1 13 . 1 1 3 3 LEU HD13 H 1 0.68 0.01 . 2 . . . . 4 LEU HD1 . 16307 1 14 . 1 1 3 3 LEU HD21 H 1 0.54 0.01 . 2 . . . . 4 LEU HD2 . 16307 1 15 . 1 1 3 3 LEU HD22 H 1 0.54 0.01 . 2 . . . . 4 LEU HD2 . 16307 1 16 . 1 1 3 3 LEU HD23 H 1 0.54 0.01 . 2 . . . . 4 LEU HD2 . 16307 1 17 . 1 1 3 3 LEU HG H 1 1.3 0.01 . 1 . . . . 4 LEU HG . 16307 1 18 . 1 1 3 3 LEU C C 13 177.3 0.3 . 1 . . . . 4 LEU C . 16307 1 19 . 1 1 3 3 LEU CA C 13 58.6 0.3 . 1 . . . . 4 LEU CA . 16307 1 20 . 1 1 3 3 LEU CB C 13 42.7 0.3 . 1 . . . . 4 LEU CB . 16307 1 21 . 1 1 3 3 LEU CD1 C 13 25.7 0.3 . 2 . . . . 4 LEU CD1 . 16307 1 22 . 1 1 3 3 LEU CD2 C 13 24.6 0.3 . 2 . . . . 4 LEU CD2 . 16307 1 23 . 1 1 3 3 LEU CG C 13 26.5 0.3 . 1 . . . . 4 LEU CG . 16307 1 24 . 1 1 3 3 LEU N N 15 123.0 0.1 . 1 . . . . 4 LEU N . 16307 1 25 . 1 1 4 4 TYR H H 1 7.43 0.01 . 1 . . . . 5 TYR H . 16307 1 26 . 1 1 4 4 TYR HA H 1 3.75 0.01 . 1 . . . . 5 TYR HA . 16307 1 27 . 1 1 4 4 TYR HB2 H 1 2.96 0.01 . 2 . . . . 5 TYR HB2 . 16307 1 28 . 1 1 4 4 TYR HB3 H 1 2.86 0.01 . 2 . . . . 5 TYR HB3 . 16307 1 29 . 1 1 4 4 TYR HD1 H 1 6.97 0.01 . 3 . . . . 5 TYR HD1 . 16307 1 30 . 1 1 4 4 TYR HD2 H 1 6.97 0.01 . 3 . . . . 5 TYR HD2 . 16307 1 31 . 1 1 4 4 TYR HE1 H 1 6.89 0.01 . 3 . . . . 5 TYR HE1 . 16307 1 32 . 1 1 4 4 TYR HE2 H 1 6.89 0.01 . 3 . . . . 5 TYR HE2 . 16307 1 33 . 1 1 4 4 TYR C C 13 178.4 0.3 . 1 . . . . 5 TYR C . 16307 1 34 . 1 1 4 4 TYR CA C 13 60.8 0.3 . 1 . . . . 5 TYR CA . 16307 1 35 . 1 1 4 4 TYR CB C 13 38.3 0.3 . 1 . . . . 5 TYR CB . 16307 1 36 . 1 1 4 4 TYR CD1 C 13 132.6 0.3 . 3 . . . . 5 TYR CD1 . 16307 1 37 . 1 1 4 4 TYR CD2 C 13 132.6 0.3 . 3 . . . . 5 TYR CD2 . 16307 1 38 . 1 1 4 4 TYR CE1 C 13 118.2 0.3 . 3 . . . . 5 TYR CE1 . 16307 1 39 . 1 1 4 4 TYR CE2 C 13 118.2 0.3 . 3 . . . . 5 TYR CE2 . 16307 1 40 . 1 1 4 4 TYR N N 15 114.8 0.1 . 1 . . . . 5 TYR N . 16307 1 41 . 1 1 5 5 GLU H H 1 7.64 0.01 . 1 . . . . 6 GLU H . 16307 1 42 . 1 1 5 5 GLU HA H 1 4.01 0.01 . 1 . . . . 6 GLU HA . 16307 1 43 . 1 1 5 5 GLU HB2 H 1 2.17 0.01 . 2 . . . . 6 GLU HB2 . 16307 1 44 . 1 1 5 5 GLU HB3 H 1 2.07 0.01 . 2 . . . . 6 GLU HB3 . 16307 1 45 . 1 1 5 5 GLU HG2 H 1 2.3 0.01 . 2 . . . . 6 GLU HG2 . 16307 1 46 . 1 1 5 5 GLU HG3 H 1 2.3 0.01 . 2 . . . . 6 GLU HG3 . 16307 1 47 . 1 1 5 5 GLU C C 13 179.2 0.3 . 1 . . . . 6 GLU C . 16307 1 48 . 1 1 5 5 GLU CA C 13 59.1 0.3 . 1 . . . . 6 GLU CA . 16307 1 49 . 1 1 5 5 GLU CB C 13 30.1 0.3 . 1 . . . . 6 GLU CB . 16307 1 50 . 1 1 5 5 GLU CG C 13 37.1 0.3 . 1 . . . . 6 GLU CG . 16307 1 51 . 1 1 5 5 GLU N N 15 119.3 0.1 . 1 . . . . 6 GLU N . 16307 1 52 . 1 1 6 6 LYS H H 1 8.05 0.01 . 1 . . . . 7 LYS H . 16307 1 53 . 1 1 6 6 LYS HA H 1 4.02 0.01 . 1 . . . . 7 LYS HA . 16307 1 54 . 1 1 6 6 LYS HB2 H 1 1.59 0.01 . 2 . . . . 7 LYS HB2 . 16307 1 55 . 1 1 6 6 LYS HB3 H 1 1.59 0.01 . 2 . . . . 7 LYS HB3 . 16307 1 56 . 1 1 6 6 LYS HE2 H 1 2.96 0.01 . 2 . . . . 7 LYS HE2 . 16307 1 57 . 1 1 6 6 LYS HE3 H 1 2.96 0.01 . 2 . . . . 7 LYS HE3 . 16307 1 58 . 1 1 6 6 LYS C C 13 178.0 0.3 . 1 . . . . 7 LYS C . 16307 1 59 . 1 1 6 6 LYS CA C 13 58.9 0.3 . 1 . . . . 7 LYS CA . 16307 1 60 . 1 1 6 6 LYS CB C 13 33.1 0.3 . 1 . . . . 7 LYS CB . 16307 1 61 . 1 1 6 6 LYS CD C 13 30.0 0.3 . 1 . . . . 7 LYS CD . 16307 1 62 . 1 1 6 6 LYS CE C 13 42.1 0.3 . 1 . . . . 7 LYS CE . 16307 1 63 . 1 1 6 6 LYS CG C 13 26.2 0.3 . 1 . . . . 7 LYS CG . 16307 1 64 . 1 1 6 6 LYS N N 15 117.7 0.1 . 1 . . . . 7 LYS N . 16307 1 65 . 1 1 7 7 LEU H H 1 7.68 0.01 . 1 . . . . 8 LEU H . 16307 1 66 . 1 1 7 7 LEU HA H 1 4.31 0.01 . 1 . . . . 8 LEU HA . 16307 1 67 . 1 1 7 7 LEU HB2 H 1 1.51 0.01 . 2 . . . . 8 LEU HB2 . 16307 1 68 . 1 1 7 7 LEU HB3 H 1 1.35 0.01 . 2 . . . . 8 LEU HB3 . 16307 1 69 . 1 1 7 7 LEU HD11 H 1 0.58 0.01 . 2 . . . . 8 LEU HD1 . 16307 1 70 . 1 1 7 7 LEU HD12 H 1 0.58 0.01 . 2 . . . . 8 LEU HD1 . 16307 1 71 . 1 1 7 7 LEU HD13 H 1 0.58 0.01 . 2 . . . . 8 LEU HD1 . 16307 1 72 . 1 1 7 7 LEU HD21 H 1 0.7 0.01 . 2 . . . . 8 LEU HD2 . 16307 1 73 . 1 1 7 7 LEU HD22 H 1 0.7 0.01 . 2 . . . . 8 LEU HD2 . 16307 1 74 . 1 1 7 7 LEU HD23 H 1 0.7 0.01 . 2 . . . . 8 LEU HD2 . 16307 1 75 . 1 1 7 7 LEU HG H 1 1.34 0.01 . 1 . . . . 8 LEU HG . 16307 1 76 . 1 1 7 7 LEU C C 13 176.8 0.3 . 1 . . . . 8 LEU C . 16307 1 77 . 1 1 7 7 LEU CA C 13 54.9 0.3 . 1 . . . . 8 LEU CA . 16307 1 78 . 1 1 7 7 LEU CB C 13 42.1 0.3 . 1 . . . . 8 LEU CB . 16307 1 79 . 1 1 7 7 LEU CD1 C 13 26.2 0.3 . 2 . . . . 8 LEU CD1 . 16307 1 80 . 1 1 7 7 LEU CD2 C 13 23.2 0.3 . 2 . . . . 8 LEU CD2 . 16307 1 81 . 1 1 7 7 LEU CG C 13 27.5 0.3 . 1 . . . . 8 LEU CG . 16307 1 82 . 1 1 7 7 LEU N N 15 113.8 0.1 . 1 . . . . 8 LEU N . 16307 1 83 . 1 1 8 8 GLY H H 1 7.3 0.01 . 1 . . . . 9 GLY H . 16307 1 84 . 1 1 8 8 GLY HA2 H 1 3.8 0.01 . 1 . . . . 9 GLY HA2 . 16307 1 85 . 1 1 8 8 GLY HA3 H 1 4.27 0.01 . 1 . . . . 9 GLY HA3 . 16307 1 86 . 1 1 8 8 GLY C C 13 175.3 0.3 . 1 . . . . 9 GLY C . 16307 1 87 . 1 1 8 8 GLY CA C 13 46.0 0.3 . 1 . . . . 9 GLY CA . 16307 1 88 . 1 1 8 8 GLY N N 15 104.8 0.1 . 1 . . . . 9 GLY N . 16307 1 89 . 1 1 9 9 GLY H H 1 8.31 0.01 . 1 . . . . 10 GLY H . 16307 1 90 . 1 1 9 9 GLY HA2 H 1 3.59 0.01 . 1 . . . . 10 GLY HA2 . 16307 1 91 . 1 1 9 9 GLY HA3 H 1 4.56 0.01 . 1 . . . . 10 GLY HA3 . 16307 1 92 . 1 1 9 9 GLY C C 13 173.4 0.3 . 1 . . . . 10 GLY C . 16307 1 93 . 1 1 9 9 GLY CA C 13 44.1 0.3 . 1 . . . . 10 GLY CA . 16307 1 94 . 1 1 9 9 GLY N N 15 108.9 0.1 . 1 . . . . 10 GLY N . 16307 1 95 . 1 1 10 10 ALA H H 1 8.54 0.01 . 1 . . . . 11 ALA H . 16307 1 96 . 1 1 10 10 ALA HA H 1 4 0.01 . 1 . . . . 11 ALA HA . 16307 1 97 . 1 1 10 10 ALA HB1 H 1 1.51 0.01 . 1 . . . . 11 ALA HB . 16307 1 98 . 1 1 10 10 ALA HB2 H 1 1.51 0.01 . 1 . . . . 11 ALA HB . 16307 1 99 . 1 1 10 10 ALA HB3 H 1 1.51 0.01 . 1 . . . . 11 ALA HB . 16307 1 100 . 1 1 10 10 ALA C C 13 179.1 0.3 . 1 . . . . 11 ALA C . 16307 1 101 . 1 1 10 10 ALA CA C 13 56.1 0.3 . 1 . . . . 11 ALA CA . 16307 1 102 . 1 1 10 10 ALA CB C 13 18.6 0.3 . 1 . . . . 11 ALA CB . 16307 1 103 . 1 1 10 10 ALA N N 15 121.3 0.1 . 1 . . . . 11 ALA N . 16307 1 104 . 1 1 11 11 ALA H H 1 8.47 0.01 . 1 . . . . 12 ALA H . 16307 1 105 . 1 1 11 11 ALA HA H 1 4.21 0.01 . 1 . . . . 12 ALA HA . 16307 1 106 . 1 1 11 11 ALA HB1 H 1 1.45 0.01 . 1 . . . . 12 ALA HB . 16307 1 107 . 1 1 11 11 ALA HB2 H 1 1.45 0.01 . 1 . . . . 12 ALA HB . 16307 1 108 . 1 1 11 11 ALA HB3 H 1 1.45 0.01 . 1 . . . . 12 ALA HB . 16307 1 109 . 1 1 11 11 ALA C C 13 180.5 0.3 . 1 . . . . 12 ALA C . 16307 1 110 . 1 1 11 11 ALA CA C 13 55.4 0.3 . 1 . . . . 12 ALA CA . 16307 1 111 . 1 1 11 11 ALA CB C 13 17.7 0.3 . 1 . . . . 12 ALA CB . 16307 1 112 . 1 1 11 11 ALA N N 15 119.6 0.1 . 1 . . . . 12 ALA N . 16307 1 113 . 1 1 12 12 ALA H H 1 7.65 0.01 . 1 . . . . 13 ALA H . 16307 1 114 . 1 1 12 12 ALA HA H 1 4.14 0.01 . 1 . . . . 13 ALA HA . 16307 1 115 . 1 1 12 12 ALA HB1 H 1 1.37 0.01 . 1 . . . . 13 ALA HB . 16307 1 116 . 1 1 12 12 ALA HB2 H 1 1.37 0.01 . 1 . . . . 13 ALA HB . 16307 1 117 . 1 1 12 12 ALA HB3 H 1 1.37 0.01 . 1 . . . . 13 ALA HB . 16307 1 118 . 1 1 12 12 ALA C C 13 180.5 0.3 . 1 . . . . 13 ALA C . 16307 1 119 . 1 1 12 12 ALA CA C 13 54.9 0.3 . 1 . . . . 13 ALA CA . 16307 1 120 . 1 1 12 12 ALA CB C 13 19.0 0.3 . 1 . . . . 13 ALA CB . 16307 1 121 . 1 1 12 12 ALA N N 15 121.6 0.1 . 1 . . . . 13 ALA N . 16307 1 122 . 1 1 13 13 VAL H H 1 7.86 0.01 . 1 . . . . 14 VAL H . 16307 1 123 . 1 1 13 13 VAL HA H 1 3.42 0.01 . 1 . . . . 14 VAL HA . 16307 1 124 . 1 1 13 13 VAL HB H 1 2.07 0.01 . 1 . . . . 14 VAL HB . 16307 1 125 . 1 1 13 13 VAL HG11 H 1 0.81 0.01 . 1 . . . . 14 VAL HG1 . 16307 1 126 . 1 1 13 13 VAL HG12 H 1 0.81 0.01 . 1 . . . . 14 VAL HG1 . 16307 1 127 . 1 1 13 13 VAL HG13 H 1 0.81 0.01 . 1 . . . . 14 VAL HG1 . 16307 1 128 . 1 1 13 13 VAL HG21 H 1 0.57 0.01 . 1 . . . . 14 VAL HG2 . 16307 1 129 . 1 1 13 13 VAL HG22 H 1 0.57 0.01 . 1 . . . . 14 VAL HG2 . 16307 1 130 . 1 1 13 13 VAL HG23 H 1 0.57 0.01 . 1 . . . . 14 VAL HG2 . 16307 1 131 . 1 1 13 13 VAL C C 13 177.3 0.3 . 1 . . . . 14 VAL C . 16307 1 132 . 1 1 13 13 VAL CA C 13 67.0 0.3 . 1 . . . . 14 VAL CA . 16307 1 133 . 1 1 13 13 VAL CB C 13 31.6 0.3 . 1 . . . . 14 VAL CB . 16307 1 134 . 1 1 13 13 VAL CG1 C 13 21.5 0.3 . 1 . . . . 14 VAL CG1 . 16307 1 135 . 1 1 13 13 VAL CG2 C 13 24.4 0.3 . 1 . . . . 14 VAL CG2 . 16307 1 136 . 1 1 13 13 VAL N N 15 118.9 0.1 . 1 . . . . 14 VAL N . 16307 1 137 . 1 1 14 14 ASP H H 1 8.42 0.01 . 1 . . . . 15 ASP H . 16307 1 138 . 1 1 14 14 ASP HA H 1 4.45 0.01 . 1 . . . . 15 ASP HA . 16307 1 139 . 1 1 14 14 ASP HB2 H 1 2.8 0.01 . 2 . . . . 15 ASP HB2 . 16307 1 140 . 1 1 14 14 ASP HB3 H 1 2.76 0.01 . 2 . . . . 15 ASP HB3 . 16307 1 141 . 1 1 14 14 ASP C C 13 179.4 0.3 . 1 . . . . 15 ASP C . 16307 1 142 . 1 1 14 14 ASP CA C 13 58.1 0.3 . 1 . . . . 15 ASP CA . 16307 1 143 . 1 1 14 14 ASP CB C 13 40.2 0.3 . 1 . . . . 15 ASP CB . 16307 1 144 . 1 1 14 14 ASP N N 15 119.2 0.1 . 1 . . . . 15 ASP N . 16307 1 145 . 1 1 15 15 LEU H H 1 7.86 0.01 . 1 . . . . 16 LEU H . 16307 1 146 . 1 1 15 15 LEU HA H 1 4.3 0.01 . 1 . . . . 16 LEU HA . 16307 1 147 . 1 1 15 15 LEU HB2 H 1 1.81 0.01 . 2 . . . . 16 LEU HB2 . 16307 1 148 . 1 1 15 15 LEU HB3 H 1 1.81 0.01 . 2 . . . . 16 LEU HB3 . 16307 1 149 . 1 1 15 15 LEU HD11 H 1 1.03 0.01 . 2 . . . . 16 LEU HD1 . 16307 1 150 . 1 1 15 15 LEU HD12 H 1 1.03 0.01 . 2 . . . . 16 LEU HD1 . 16307 1 151 . 1 1 15 15 LEU HD13 H 1 1.03 0.01 . 2 . . . . 16 LEU HD1 . 16307 1 152 . 1 1 15 15 LEU HD21 H 1 0.99 0.01 . 2 . . . . 16 LEU HD2 . 16307 1 153 . 1 1 15 15 LEU HD22 H 1 0.99 0.01 . 2 . . . . 16 LEU HD2 . 16307 1 154 . 1 1 15 15 LEU HD23 H 1 0.99 0.01 . 2 . . . . 16 LEU HD2 . 16307 1 155 . 1 1 15 15 LEU HG H 1 1.71 0.01 . 1 . . . . 16 LEU HG . 16307 1 156 . 1 1 15 15 LEU C C 13 179.0 0.3 . 1 . . . . 16 LEU C . 16307 1 157 . 1 1 15 15 LEU CA C 13 58.1 0.3 . 1 . . . . 16 LEU CA . 16307 1 158 . 1 1 15 15 LEU CB C 13 42.4 0.3 . 1 . . . . 16 LEU CB . 16307 1 159 . 1 1 15 15 LEU CD1 C 13 24.4 0.3 . 2 . . . . 16 LEU CD1 . 16307 1 160 . 1 1 15 15 LEU CD2 C 13 24.9 0.3 . 2 . . . . 16 LEU CD2 . 16307 1 161 . 1 1 15 15 LEU CG C 13 27.4 0.3 . 1 . . . . 16 LEU CG . 16307 1 162 . 1 1 15 15 LEU N N 15 120.5 0.1 . 1 . . . . 16 LEU N . 16307 1 163 . 1 1 16 16 ALA H H 1 8.18 0.01 . 1 . . . . 17 ALA H . 16307 1 164 . 1 1 16 16 ALA HA H 1 4.03 0.01 . 1 . . . . 17 ALA HA . 16307 1 165 . 1 1 16 16 ALA HB1 H 1 1.46 0.01 . 1 . . . . 17 ALA HB . 16307 1 166 . 1 1 16 16 ALA HB2 H 1 1.46 0.01 . 1 . . . . 17 ALA HB . 16307 1 167 . 1 1 16 16 ALA HB3 H 1 1.46 0.01 . 1 . . . . 17 ALA HB . 16307 1 168 . 1 1 16 16 ALA C C 13 179.6 0.3 . 1 . . . . 17 ALA C . 16307 1 169 . 1 1 16 16 ALA CA C 13 55.8 0.3 . 1 . . . . 17 ALA CA . 16307 1 170 . 1 1 16 16 ALA CB C 13 18.1 0.3 . 1 . . . . 17 ALA CB . 16307 1 171 . 1 1 16 16 ALA N N 15 122.1 0.1 . 1 . . . . 17 ALA N . 16307 1 172 . 1 1 17 17 VAL H H 1 9.17 0.01 . 1 . . . . 18 VAL H . 16307 1 173 . 1 1 17 17 VAL HA H 1 3.91 0.01 . 1 . . . . 18 VAL HA . 16307 1 174 . 1 1 17 17 VAL HB H 1 2.51 0.01 . 1 . . . . 18 VAL HB . 16307 1 175 . 1 1 17 17 VAL HG11 H 1 1.38 0.01 . 1 . . . . 18 VAL HG1 . 16307 1 176 . 1 1 17 17 VAL HG12 H 1 1.38 0.01 . 1 . . . . 18 VAL HG1 . 16307 1 177 . 1 1 17 17 VAL HG13 H 1 1.38 0.01 . 1 . . . . 18 VAL HG1 . 16307 1 178 . 1 1 17 17 VAL HG21 H 1 1.38 0.01 . 1 . . . . 18 VAL HG2 . 16307 1 179 . 1 1 17 17 VAL HG22 H 1 1.38 0.01 . 1 . . . . 18 VAL HG2 . 16307 1 180 . 1 1 17 17 VAL HG23 H 1 1.38 0.01 . 1 . . . . 18 VAL HG2 . 16307 1 181 . 1 1 17 17 VAL C C 13 178.0 0.3 . 1 . . . . 18 VAL C . 16307 1 182 . 1 1 17 17 VAL CA C 13 68.2 0.3 . 1 . . . . 18 VAL CA . 16307 1 183 . 1 1 17 17 VAL CB C 13 31.9 0.3 . 1 . . . . 18 VAL CB . 16307 1 184 . 1 1 17 17 VAL CG1 C 13 22.4 0.3 . 1 . . . . 18 VAL CG1 . 16307 1 185 . 1 1 17 17 VAL CG2 C 13 24.7 0.3 . 1 . . . . 18 VAL CG2 . 16307 1 186 . 1 1 17 17 VAL N N 15 118.5 0.1 . 1 . . . . 18 VAL N . 16307 1 187 . 1 1 18 18 GLU H H 1 8.41 0.01 . 1 . . . . 19 GLU H . 16307 1 188 . 1 1 18 18 GLU HA H 1 4.25 0.01 . 1 . . . . 19 GLU HA . 16307 1 189 . 1 1 18 18 GLU HB2 H 1 2.43 0.01 . 2 . . . . 19 GLU HB2 . 16307 1 190 . 1 1 18 18 GLU HB3 H 1 2.38 0.01 . 2 . . . . 19 GLU HB3 . 16307 1 191 . 1 1 18 18 GLU HG2 H 1 2.56 0.01 . 2 . . . . 19 GLU HG2 . 16307 1 192 . 1 1 18 18 GLU HG3 H 1 2.56 0.01 . 2 . . . . 19 GLU HG3 . 16307 1 193 . 1 1 18 18 GLU C C 13 180.1 0.3 . 1 . . . . 19 GLU C . 16307 1 194 . 1 1 18 18 GLU CA C 13 60.5 0.3 . 1 . . . . 19 GLU CA . 16307 1 195 . 1 1 18 18 GLU CB C 13 29.9 0.3 . 1 . . . . 19 GLU CB . 16307 1 196 . 1 1 18 18 GLU CG C 13 36.0 0.3 . 1 . . . . 19 GLU CG . 16307 1 197 . 1 1 18 18 GLU N N 15 119.9 0.1 . 1 . . . . 19 GLU N . 16307 1 198 . 1 1 19 19 LYS H H 1 8.54 0.01 . 1 . . . . 20 LYS H . 16307 1 199 . 1 1 19 19 LYS HA H 1 4.31 0.01 . 1 . . . . 20 LYS HA . 16307 1 200 . 1 1 19 19 LYS HB2 H 1 2.21 0.01 . 2 . . . . 20 LYS HB2 . 16307 1 201 . 1 1 19 19 LYS HB3 H 1 1.97 0.01 . 2 . . . . 20 LYS HB3 . 16307 1 202 . 1 1 19 19 LYS HD2 H 1 1.74 0.01 . 2 . . . . 20 LYS HD2 . 16307 1 203 . 1 1 19 19 LYS HD3 H 1 1.74 0.01 . 2 . . . . 20 LYS HD3 . 16307 1 204 . 1 1 19 19 LYS HE2 H 1 3.06 0.01 . 2 . . . . 20 LYS HE2 . 16307 1 205 . 1 1 19 19 LYS HE3 H 1 3.06 0.01 . 2 . . . . 20 LYS HE3 . 16307 1 206 . 1 1 19 19 LYS HG2 H 1 1.74 0.01 . 2 . . . . 20 LYS HG2 . 16307 1 207 . 1 1 19 19 LYS HG3 H 1 1.74 0.01 . 2 . . . . 20 LYS HG3 . 16307 1 208 . 1 1 19 19 LYS C C 13 179.2 0.3 . 1 . . . . 20 LYS C . 16307 1 209 . 1 1 19 19 LYS CA C 13 59.3 0.3 . 1 . . . . 20 LYS CA . 16307 1 210 . 1 1 19 19 LYS CB C 13 32.6 0.3 . 1 . . . . 20 LYS CB . 16307 1 211 . 1 1 19 19 LYS CD C 13 29.3 0.3 . 1 . . . . 20 LYS CD . 16307 1 212 . 1 1 19 19 LYS CE C 13 41.3 0.3 . 1 . . . . 20 LYS CE . 16307 1 213 . 1 1 19 19 LYS CG C 13 24.3 0.3 . 1 . . . . 20 LYS CG . 16307 1 214 . 1 1 19 19 LYS N N 15 120.2 0.1 . 1 . . . . 20 LYS N . 16307 1 215 . 1 1 20 20 PHE H H 1 9.06 0.01 . 1 . . . . 21 PHE H . 16307 1 216 . 1 1 20 20 PHE HA H 1 4.87 0.01 . 1 . . . . 21 PHE HA . 16307 1 217 . 1 1 20 20 PHE HB2 H 1 3.62 0.01 . 1 . . . . 21 PHE HB2 . 16307 1 218 . 1 1 20 20 PHE HB3 H 1 3.73 0.01 . 1 . . . . 21 PHE HB3 . 16307 1 219 . 1 1 20 20 PHE HD1 H 1 7.39 0.01 . 3 . . . . 21 PHE HD1 . 16307 1 220 . 1 1 20 20 PHE HD2 H 1 7.39 0.01 . 3 . . . . 21 PHE HD2 . 16307 1 221 . 1 1 20 20 PHE HE1 H 1 7.83 0.01 . 3 . . . . 21 PHE HE1 . 16307 1 222 . 1 1 20 20 PHE HE2 H 1 7.83 0.01 . 3 . . . . 21 PHE HE2 . 16307 1 223 . 1 1 20 20 PHE HZ H 1 6.72 0.01 . 1 . . . . 21 PHE HZ . 16307 1 224 . 1 1 20 20 PHE C C 13 177.5 0.3 . 1 . . . . 21 PHE C . 16307 1 225 . 1 1 20 20 PHE CA C 13 58.2 0.3 . 1 . . . . 21 PHE CA . 16307 1 226 . 1 1 20 20 PHE CB C 13 40.2 0.3 . 1 . . . . 21 PHE CB . 16307 1 227 . 1 1 20 20 PHE CD1 C 13 130.9 0.3 . 3 . . . . 21 PHE CD1 . 16307 1 228 . 1 1 20 20 PHE CD2 C 13 130.9 0.3 . 3 . . . . 21 PHE CD2 . 16307 1 229 . 1 1 20 20 PHE CE1 C 13 132.3 0.3 . 3 . . . . 21 PHE CE1 . 16307 1 230 . 1 1 20 20 PHE CE2 C 13 132.3 0.3 . 3 . . . . 21 PHE CE2 . 16307 1 231 . 1 1 20 20 PHE CZ C 13 130.1 0.3 . 1 . . . . 21 PHE CZ . 16307 1 232 . 1 1 20 20 PHE N N 15 122.4 0.1 . 1 . . . . 21 PHE N . 16307 1 233 . 1 1 21 21 TYR H H 1 9.64 0.01 . 1 . . . . 22 TYR H . 16307 1 234 . 1 1 21 21 TYR HA H 1 4.44 0.01 . 1 . . . . 22 TYR HA . 16307 1 235 . 1 1 21 21 TYR HB2 H 1 3.55 0.01 . 2 . . . . 22 TYR HB2 . 16307 1 236 . 1 1 21 21 TYR HB3 H 1 3.81 0.01 . 2 . . . . 22 TYR HB3 . 16307 1 237 . 1 1 21 21 TYR HD1 H 1 7.57 0.01 . 3 . . . . 22 TYR HD1 . 16307 1 238 . 1 1 21 21 TYR HD2 H 1 7.57 0.01 . 3 . . . . 22 TYR HD2 . 16307 1 239 . 1 1 21 21 TYR HE1 H 1 7.05 0.01 . 3 . . . . 22 TYR HE1 . 16307 1 240 . 1 1 21 21 TYR HE2 H 1 7.05 0.01 . 3 . . . . 22 TYR HE2 . 16307 1 241 . 1 1 21 21 TYR C C 13 177.6 0.3 . 1 . . . . 22 TYR C . 16307 1 242 . 1 1 21 21 TYR CA C 13 61.1 0.3 . 1 . . . . 22 TYR CA . 16307 1 243 . 1 1 21 21 TYR CB C 13 38.0 0.3 . 1 . . . . 22 TYR CB . 16307 1 244 . 1 1 21 21 TYR CD1 C 13 134.6 0.3 . 3 . . . . 22 TYR CD1 . 16307 1 245 . 1 1 21 21 TYR CD2 C 13 134.6 0.3 . 3 . . . . 22 TYR CD2 . 16307 1 246 . 1 1 21 21 TYR CE1 C 13 118.4 0.3 . 3 . . . . 22 TYR CE1 . 16307 1 247 . 1 1 21 21 TYR CE2 C 13 118.4 0.3 . 3 . . . . 22 TYR CE2 . 16307 1 248 . 1 1 21 21 TYR N N 15 119.9 0.1 . 1 . . . . 22 TYR N . 16307 1 249 . 1 1 22 22 GLY H H 1 8.16 0.01 . 1 . . . . 23 GLY H . 16307 1 250 . 1 1 22 22 GLY HA2 H 1 3.48 0.01 . 1 . . . . 23 GLY HA2 . 16307 1 251 . 1 1 22 22 GLY HA3 H 1 3.99 0.01 . 1 . . . . 23 GLY HA3 . 16307 1 252 . 1 1 22 22 GLY C C 13 176.7 0.3 . 1 . . . . 23 GLY C . 16307 1 253 . 1 1 22 22 GLY CA C 13 47.0 0.3 . 1 . . . . 23 GLY CA . 16307 1 254 . 1 1 22 22 GLY N N 15 107.3 0.1 . 1 . . . . 23 GLY N . 16307 1 255 . 1 1 23 23 LYS H H 1 8.14 0.01 . 1 . . . . 24 LYS H . 16307 1 256 . 1 1 23 23 LYS HA H 1 4.07 0.01 . 1 . . . . 24 LYS HA . 16307 1 257 . 1 1 23 23 LYS HB2 H 1 2.04 0.01 . 2 . . . . 24 LYS HB2 . 16307 1 258 . 1 1 23 23 LYS HB3 H 1 2.04 0.01 . 2 . . . . 24 LYS HB3 . 16307 1 259 . 1 1 23 23 LYS HD2 H 1 1.84 0.05 . 2 . . . . 24 LYS HD2 . 16307 1 260 . 1 1 23 23 LYS HD3 H 1 1.84 0.05 . 2 . . . . 24 LYS HD3 . 16307 1 261 . 1 1 23 23 LYS HE2 H 1 2.77 0.01 . 2 . . . . 24 LYS HE2 . 16307 1 262 . 1 1 23 23 LYS HE3 H 1 2.77 0.01 . 2 . . . . 24 LYS HE3 . 16307 1 263 . 1 1 23 23 LYS HG2 H 1 1.54 0.01 . 2 . . . . 24 LYS HG2 . 16307 1 264 . 1 1 23 23 LYS HG3 H 1 1.76 0.01 . 2 . . . . 24 LYS HG3 . 16307 1 265 . 1 1 23 23 LYS C C 13 179.6 0.3 . 1 . . . . 24 LYS C . 16307 1 266 . 1 1 23 23 LYS CA C 13 60.5 0.3 . 1 . . . . 24 LYS CA . 16307 1 267 . 1 1 23 23 LYS CB C 13 32.8 0.3 . 1 . . . . 24 LYS CB . 16307 1 268 . 1 1 23 23 LYS CD C 13 29.5 0.3 . 1 . . . . 24 LYS CD . 16307 1 269 . 1 1 23 23 LYS CE C 13 42.5 0.3 . 1 . . . . 24 LYS CE . 16307 1 270 . 1 1 23 23 LYS CG C 13 26.4 0.3 . 1 . . . . 24 LYS CG . 16307 1 271 . 1 1 23 23 LYS N N 15 122.3 0.1 . 1 . . . . 24 LYS N . 16307 1 272 . 1 1 24 24 VAL H H 1 8.03 0.01 . 1 . . . . 25 VAL H . 16307 1 273 . 1 1 24 24 VAL HA H 1 3.29 0.01 . 1 . . . . 25 VAL HA . 16307 1 274 . 1 1 24 24 VAL HB H 1 2.05 0.01 . 1 . . . . 25 VAL HB . 16307 1 275 . 1 1 24 24 VAL HG11 H 1 0.56 0.01 . 1 . . . . 25 VAL HG1 . 16307 1 276 . 1 1 24 24 VAL HG12 H 1 0.56 0.01 . 1 . . . . 25 VAL HG1 . 16307 1 277 . 1 1 24 24 VAL HG13 H 1 0.56 0.01 . 1 . . . . 25 VAL HG1 . 16307 1 278 . 1 1 24 24 VAL HG21 H 1 0.66 0.01 . 1 . . . . 25 VAL HG2 . 16307 1 279 . 1 1 24 24 VAL HG22 H 1 0.66 0.01 . 1 . . . . 25 VAL HG2 . 16307 1 280 . 1 1 24 24 VAL HG23 H 1 0.66 0.01 . 1 . . . . 25 VAL HG2 . 16307 1 281 . 1 1 24 24 VAL C C 13 177.3 0.3 . 1 . . . . 25 VAL C . 16307 1 282 . 1 1 24 24 VAL CA C 13 67.2 0.3 . 1 . . . . 25 VAL CA . 16307 1 283 . 1 1 24 24 VAL CB C 13 31.4 0.3 . 1 . . . . 25 VAL CB . 16307 1 284 . 1 1 24 24 VAL CG1 C 13 22.2 0.3 . 1 . . . . 25 VAL CG1 . 16307 1 285 . 1 1 24 24 VAL CG2 C 13 25.5 0.3 . 1 . . . . 25 VAL CG2 . 16307 1 286 . 1 1 24 24 VAL N N 15 119.2 0.1 . 1 . . . . 25 VAL N . 16307 1 287 . 1 1 25 25 LEU H H 1 7.58 0.01 . 1 . . . . 26 LEU H . 16307 1 288 . 1 1 25 25 LEU HA H 1 4.05 0.01 . 1 . . . . 26 LEU HA . 16307 1 289 . 1 1 25 25 LEU HB2 H 1 1.56 0.01 . 2 . . . . 26 LEU HB2 . 16307 1 290 . 1 1 25 25 LEU HB3 H 1 1.5 0.01 . 2 . . . . 26 LEU HB3 . 16307 1 291 . 1 1 25 25 LEU HD11 H 1 0.99 0.01 . 2 . . . . 26 LEU HD1 . 16307 1 292 . 1 1 25 25 LEU HD12 H 1 0.99 0.01 . 2 . . . . 26 LEU HD1 . 16307 1 293 . 1 1 25 25 LEU HD13 H 1 0.99 0.01 . 2 . . . . 26 LEU HD1 . 16307 1 294 . 1 1 25 25 LEU HD21 H 1 0.95 0.01 . 2 . . . . 26 LEU HD2 . 16307 1 295 . 1 1 25 25 LEU HD22 H 1 0.95 0.01 . 2 . . . . 26 LEU HD2 . 16307 1 296 . 1 1 25 25 LEU HD23 H 1 0.95 0.01 . 2 . . . . 26 LEU HD2 . 16307 1 297 . 1 1 25 25 LEU HG H 1 1.62 0.01 . 1 . . . . 26 LEU HG . 16307 1 298 . 1 1 25 25 LEU C C 13 178.3 0.3 . 1 . . . . 26 LEU C . 16307 1 299 . 1 1 25 25 LEU CA C 13 57.1 0.3 . 1 . . . . 26 LEU CA . 16307 1 300 . 1 1 25 25 LEU CB C 13 42.2 0.3 . 1 . . . . 26 LEU CB . 16307 1 301 . 1 1 25 25 LEU CD1 C 13 24.5 0.3 . 2 . . . . 26 LEU CD1 . 16307 1 302 . 1 1 25 25 LEU CD2 C 13 24.5 0.3 . 2 . . . . 26 LEU CD2 . 16307 1 303 . 1 1 25 25 LEU CG C 13 27.0 0.3 . 1 . . . . 26 LEU CG . 16307 1 304 . 1 1 25 25 LEU N N 15 117.2 0.1 . 1 . . . . 26 LEU N . 16307 1 305 . 1 1 26 26 ALA H H 1 7.12 0.01 . 1 . . . . 27 ALA H . 16307 1 306 . 1 1 26 26 ALA HA H 1 4.36 0.01 . 1 . . . . 27 ALA HA . 16307 1 307 . 1 1 26 26 ALA HB1 H 1 1.44 0.01 . 1 . . . . 27 ALA HB . 16307 1 308 . 1 1 26 26 ALA HB2 H 1 1.44 0.01 . 1 . . . . 27 ALA HB . 16307 1 309 . 1 1 26 26 ALA HB3 H 1 1.44 0.01 . 1 . . . . 27 ALA HB . 16307 1 310 . 1 1 26 26 ALA C C 13 176.5 0.3 . 1 . . . . 27 ALA C . 16307 1 311 . 1 1 26 26 ALA CA C 13 51.8 0.3 . 1 . . . . 27 ALA CA . 16307 1 312 . 1 1 26 26 ALA CB C 13 19.6 0.3 . 1 . . . . 27 ALA CB . 16307 1 313 . 1 1 26 26 ALA N N 15 118.6 0.1 . 1 . . . . 27 ALA N . 16307 1 314 . 1 1 27 27 ASP H H 1 7.35 0.01 . 1 . . . . 28 ASP H . 16307 1 315 . 1 1 27 27 ASP HA H 1 4.56 0.01 . 1 . . . . 28 ASP HA . 16307 1 316 . 1 1 27 27 ASP HB2 H 1 2.68 0.01 . 1 . . . . 28 ASP HB2 . 16307 1 317 . 1 1 27 27 ASP HB3 H 1 3.12 0.01 . 1 . . . . 28 ASP HB3 . 16307 1 318 . 1 1 27 27 ASP C C 13 176.5 0.3 . 1 . . . . 28 ASP C . 16307 1 319 . 1 1 27 27 ASP CA C 13 53.6 0.3 . 1 . . . . 28 ASP CA . 16307 1 320 . 1 1 27 27 ASP CB C 13 40.9 0.3 . 1 . . . . 28 ASP CB . 16307 1 321 . 1 1 27 27 ASP N N 15 119.7 0.1 . 1 . . . . 28 ASP N . 16307 1 322 . 1 1 28 28 GLU H H 1 9.01 0.01 . 1 . . . . 29 GLU H . 16307 1 323 . 1 1 28 28 GLU HA H 1 4.1 0.01 . 1 . . . . 29 GLU HA . 16307 1 324 . 1 1 28 28 GLU HB2 H 1 2.12 0.01 . 2 . . . . 29 GLU HB2 . 16307 1 325 . 1 1 28 28 GLU HB3 H 1 2.01 0.01 . 2 . . . . 29 GLU HB3 . 16307 1 326 . 1 1 28 28 GLU HG2 H 1 2.3 0.01 . 2 . . . . 29 GLU HG2 . 16307 1 327 . 1 1 28 28 GLU HG3 H 1 2.3 0.01 . 2 . . . . 29 GLU HG3 . 16307 1 328 . 1 1 28 28 GLU C C 13 177.5 0.3 . 1 . . . . 29 GLU C . 16307 1 329 . 1 1 28 28 GLU CA C 13 58.1 0.3 . 1 . . . . 29 GLU CA . 16307 1 330 . 1 1 28 28 GLU CB C 13 29.5 0.3 . 1 . . . . 29 GLU CB . 16307 1 331 . 1 1 28 28 GLU CG C 13 36.4 0.3 . 1 . . . . 29 GLU CG . 16307 1 332 . 1 1 28 28 GLU N N 15 128.3 0.1 . 1 . . . . 29 GLU N . 16307 1 333 . 1 1 29 29 ARG H H 1 8.68 0.01 . 1 . . . . 30 ARG H . 16307 1 334 . 1 1 29 29 ARG HA H 1 4.04 0.01 . 1 . . . . 30 ARG HA . 16307 1 335 . 1 1 29 29 ARG HB2 H 1 1.69 0.01 . 2 . . . . 30 ARG HB2 . 16307 1 336 . 1 1 29 29 ARG HB3 H 1 1.46 0.01 . 2 . . . . 30 ARG HB3 . 16307 1 337 . 1 1 29 29 ARG HD2 H 1 3.26 0.01 . 2 . . . . 30 ARG HD2 . 16307 1 338 . 1 1 29 29 ARG HD3 H 1 2.77 0.01 . 2 . . . . 30 ARG HD3 . 16307 1 339 . 1 1 29 29 ARG HE H 1 8.26 0.01 . 1 . . . . 30 ARG HE . 16307 1 340 . 1 1 29 29 ARG HG2 H 1 1.69 0.01 . 2 . . . . 30 ARG HG2 . 16307 1 341 . 1 1 29 29 ARG HG3 H 1 1.69 0.01 . 2 . . . . 30 ARG HG3 . 16307 1 342 . 1 1 29 29 ARG C C 13 178.3 0.3 . 1 . . . . 30 ARG C . 16307 1 343 . 1 1 29 29 ARG CA C 13 58.7 0.3 . 1 . . . . 30 ARG CA . 16307 1 344 . 1 1 29 29 ARG CB C 13 31.4 0.3 . 1 . . . . 30 ARG CB . 16307 1 345 . 1 1 29 29 ARG CD C 13 43.4 0.3 . 1 . . . . 30 ARG CD . 16307 1 346 . 1 1 29 29 ARG CG C 13 25.6 0.3 . 1 . . . . 30 ARG CG . 16307 1 347 . 1 1 29 29 ARG N N 15 117.5 0.1 . 1 . . . . 30 ARG N . 16307 1 348 . 1 1 29 29 ARG NE N 15 82.6 0.1 . 1 . . . . 30 ARG NE . 16307 1 349 . 1 1 30 30 VAL H H 1 7.11 0.01 . 1 . . . . 31 VAL H . 16307 1 350 . 1 1 30 30 VAL HA H 1 4.49 0.01 . 1 . . . . 31 VAL HA . 16307 1 351 . 1 1 30 30 VAL HB H 1 1.74 0.01 . 1 . . . . 31 VAL HB . 16307 1 352 . 1 1 30 30 VAL HG11 H 1 0.51 0.01 . 2 . . . . 31 VAL HG1 . 16307 1 353 . 1 1 30 30 VAL HG12 H 1 0.51 0.01 . 2 . . . . 31 VAL HG1 . 16307 1 354 . 1 1 30 30 VAL HG13 H 1 0.51 0.01 . 2 . . . . 31 VAL HG1 . 16307 1 355 . 1 1 30 30 VAL HG21 H 1 0.57 0.01 . 2 . . . . 31 VAL HG2 . 16307 1 356 . 1 1 30 30 VAL HG22 H 1 0.57 0.01 . 2 . . . . 31 VAL HG2 . 16307 1 357 . 1 1 30 30 VAL HG23 H 1 0.57 0.01 . 2 . . . . 31 VAL HG2 . 16307 1 358 . 1 1 30 30 VAL C C 13 175.5 0.3 . 1 . . . . 31 VAL C . 16307 1 359 . 1 1 30 30 VAL CA C 13 60.0 0.3 . 1 . . . . 31 VAL CA . 16307 1 360 . 1 1 30 30 VAL CB C 13 35.7 0.3 . 1 . . . . 31 VAL CB . 16307 1 361 . 1 1 30 30 VAL CG1 C 13 23.6 0.3 . 2 . . . . 31 VAL CG1 . 16307 1 362 . 1 1 30 30 VAL CG2 C 13 19.6 0.3 . 2 . . . . 31 VAL CG2 . 16307 1 363 . 1 1 30 30 VAL N N 15 104.0 0.1 . 1 . . . . 31 VAL N . 16307 1 364 . 1 1 31 31 ASN H H 1 8.77 0.01 . 1 . . . . 32 ASN H . 16307 1 365 . 1 1 31 31 ASN HA H 1 4.1 0.01 . 1 . . . . 32 ASN HA . 16307 1 366 . 1 1 31 31 ASN HB2 H 1 3.28 0.01 . 2 . . . . 32 ASN HB2 . 16307 1 367 . 1 1 31 31 ASN HB3 H 1 2.99 0.01 . 2 . . . . 32 ASN HB3 . 16307 1 368 . 1 1 31 31 ASN HD21 H 1 7.17 0.01 . 2 . . . . 32 ASN HD21 . 16307 1 369 . 1 1 31 31 ASN HD22 H 1 6.68 0.01 . 2 . . . . 32 ASN HD22 . 16307 1 370 . 1 1 31 31 ASN C C 13 178.9 0.3 . 1 . . . . 32 ASN C . 16307 1 371 . 1 1 31 31 ASN CA C 13 56.8 0.3 . 1 . . . . 32 ASN CA . 16307 1 372 . 1 1 31 31 ASN CB C 13 36.4 0.3 . 1 . . . . 32 ASN CB . 16307 1 373 . 1 1 31 31 ASN N N 15 122.9 0.1 . 1 . . . . 32 ASN N . 16307 1 374 . 1 1 31 31 ASN ND2 N 15 107.2 0.1 . 1 . . . . 32 ASN ND2 . 16307 1 375 . 1 1 32 32 ARG H H 1 8.12 0.01 . 1 . . . . 33 ARG H . 16307 1 376 . 1 1 32 32 ARG HA H 1 3.96 0.01 . 1 . . . . 33 ARG HA . 16307 1 377 . 1 1 32 32 ARG HB2 H 1 1.44 0.01 . 2 . . . . 33 ARG HB2 . 16307 1 378 . 1 1 32 32 ARG HB3 H 1 1.38 0.01 . 2 . . . . 33 ARG HB3 . 16307 1 379 . 1 1 32 32 ARG HD2 H 1 2.67 0.01 . 2 . . . . 33 ARG HD2 . 16307 1 380 . 1 1 32 32 ARG HD3 H 1 2.55 0.01 . 2 . . . . 33 ARG HD3 . 16307 1 381 . 1 1 32 32 ARG HE H 1 6.93 0.01 . 1 . . . . 33 ARG HE . 16307 1 382 . 1 1 32 32 ARG HG2 H 1 0.68 0.01 . 2 . . . . 33 ARG HG2 . 16307 1 383 . 1 1 32 32 ARG HG3 H 1 0.15 0.01 . 2 . . . . 33 ARG HG3 . 16307 1 384 . 1 1 32 32 ARG C C 13 177.4 0.3 . 1 . . . . 33 ARG C . 16307 1 385 . 1 1 32 32 ARG CA C 13 58.0 0.3 . 1 . . . . 33 ARG CA . 16307 1 386 . 1 1 32 32 ARG CB C 13 28.2 0.3 . 1 . . . . 33 ARG CB . 16307 1 387 . 1 1 32 32 ARG CD C 13 42.8 0.3 . 1 . . . . 33 ARG CD . 16307 1 388 . 1 1 32 32 ARG CG C 13 25.7 0.3 . 1 . . . . 33 ARG CG . 16307 1 389 . 1 1 32 32 ARG N N 15 120.4 0.1 . 1 . . . . 33 ARG N . 16307 1 390 . 1 1 32 32 ARG NE N 15 84.8 0.1 . 1 . . . . 33 ARG NE . 16307 1 391 . 1 1 33 33 PHE H H 1 7.13 0.01 . 1 . . . . 34 PHE H . 16307 1 392 . 1 1 33 33 PHE HA H 1 3.5 0.01 . 1 . . . . 34 PHE HA . 16307 1 393 . 1 1 33 33 PHE HB2 H 1 1.42 0.01 . 2 . . . . 34 PHE HB2 . 16307 1 394 . 1 1 33 33 PHE HB3 H 1 1.3 0.01 . 2 . . . . 34 PHE HB3 . 16307 1 395 . 1 1 33 33 PHE HD1 H 1 6.35 0.01 . 3 . . . . 34 PHE HD1 . 16307 1 396 . 1 1 33 33 PHE HD2 H 1 6.35 0.01 . 3 . . . . 34 PHE HD2 . 16307 1 397 . 1 1 33 33 PHE HE1 H 1 6.11 0.01 . 3 . . . . 34 PHE HE1 . 16307 1 398 . 1 1 33 33 PHE HE2 H 1 6.11 0.01 . 3 . . . . 34 PHE HE2 . 16307 1 399 . 1 1 33 33 PHE HZ H 1 5.74 0.01 . 1 . . . . 34 PHE HZ . 16307 1 400 . 1 1 33 33 PHE C C 13 174.9 0.3 . 1 . . . . 34 PHE C . 16307 1 401 . 1 1 33 33 PHE CA C 13 60.1 0.3 . 1 . . . . 34 PHE CA . 16307 1 402 . 1 1 33 33 PHE CB C 13 37.8 0.3 . 1 . . . . 34 PHE CB . 16307 1 403 . 1 1 33 33 PHE CD1 C 13 130.0 0.3 . 3 . . . . 34 PHE CD1 . 16307 1 404 . 1 1 33 33 PHE CD2 C 13 130.0 0.3 . 3 . . . . 34 PHE CD2 . 16307 1 405 . 1 1 33 33 PHE CE1 C 13 130.6 0.3 . 3 . . . . 34 PHE CE1 . 16307 1 406 . 1 1 33 33 PHE CE2 C 13 130.6 0.3 . 3 . . . . 34 PHE CE2 . 16307 1 407 . 1 1 33 33 PHE CZ C 13 129.2 0.3 . 1 . . . . 34 PHE CZ . 16307 1 408 . 1 1 33 33 PHE N N 15 116.2 0.1 . 1 . . . . 34 PHE N . 16307 1 409 . 1 1 34 34 PHE H H 1 7.42 0.01 . 1 . . . . 35 PHE H . 16307 1 410 . 1 1 34 34 PHE HA H 1 4.89 0.01 . 1 . . . . 35 PHE HA . 16307 1 411 . 1 1 34 34 PHE HB2 H 1 2.72 0.01 . 1 . . . . 35 PHE HB2 . 16307 1 412 . 1 1 34 34 PHE HB3 H 1 3.92 0.01 . 1 . . . . 35 PHE HB3 . 16307 1 413 . 1 1 34 34 PHE HD1 H 1 7.84 0.01 . 3 . . . . 35 PHE HD1 . 16307 1 414 . 1 1 34 34 PHE HD2 H 1 7.84 0.01 . 3 . . . . 35 PHE HD2 . 16307 1 415 . 1 1 34 34 PHE HE1 H 1 8.76 0.01 . 3 . . . . 35 PHE HE1 . 16307 1 416 . 1 1 34 34 PHE HE2 H 1 8.76 0.01 . 3 . . . . 35 PHE HE2 . 16307 1 417 . 1 1 34 34 PHE HZ H 1 6.97 0.01 . 1 . . . . 35 PHE HZ . 16307 1 418 . 1 1 34 34 PHE C C 13 176.4 0.3 . 1 . . . . 35 PHE C . 16307 1 419 . 1 1 34 34 PHE CA C 13 58.7 0.3 . 1 . . . . 35 PHE CA . 16307 1 420 . 1 1 34 34 PHE CB C 13 41.9 0.3 . 1 . . . . 35 PHE CB . 16307 1 421 . 1 1 34 34 PHE CD1 C 13 133.5 0.3 . 3 . . . . 35 PHE CD1 . 16307 1 422 . 1 1 34 34 PHE CD2 C 13 133.5 0.3 . 3 . . . . 35 PHE CD2 . 16307 1 423 . 1 1 34 34 PHE CE1 C 13 132.0 0.3 . 3 . . . . 35 PHE CE1 . 16307 1 424 . 1 1 34 34 PHE CE2 C 13 132.0 0.3 . 3 . . . . 35 PHE CE2 . 16307 1 425 . 1 1 34 34 PHE CZ C 13 130.0 0.3 . 1 . . . . 35 PHE CZ . 16307 1 426 . 1 1 34 34 PHE N N 15 113.4 0.1 . 1 . . . . 35 PHE N . 16307 1 427 . 1 1 35 35 VAL H H 1 7.28 0.01 . 1 . . . . 36 VAL H . 16307 1 428 . 1 1 35 35 VAL HA H 1 4 0.01 . 1 . . . . 36 VAL HA . 16307 1 429 . 1 1 35 35 VAL HB H 1 2.09 0.01 . 1 . . . . 36 VAL HB . 16307 1 430 . 1 1 35 35 VAL HG11 H 1 0.95 0.01 . 2 . . . . 36 VAL HG1 . 16307 1 431 . 1 1 35 35 VAL HG12 H 1 0.95 0.01 . 2 . . . . 36 VAL HG1 . 16307 1 432 . 1 1 35 35 VAL HG13 H 1 0.95 0.01 . 2 . . . . 36 VAL HG1 . 16307 1 433 . 1 1 35 35 VAL HG21 H 1 0.9 0.01 . 2 . . . . 36 VAL HG2 . 16307 1 434 . 1 1 35 35 VAL HG22 H 1 0.9 0.01 . 2 . . . . 36 VAL HG2 . 16307 1 435 . 1 1 35 35 VAL HG23 H 1 0.9 0.01 . 2 . . . . 36 VAL HG2 . 16307 1 436 . 1 1 35 35 VAL C C 13 175.7 0.3 . 1 . . . . 36 VAL C . 16307 1 437 . 1 1 35 35 VAL CA C 13 65.1 0.3 . 1 . . . . 36 VAL CA . 16307 1 438 . 1 1 35 35 VAL CB C 13 31.9 0.3 . 1 . . . . 36 VAL CB . 16307 1 439 . 1 1 35 35 VAL CG1 C 13 20.4 0.3 . 2 . . . . 36 VAL CG1 . 16307 1 440 . 1 1 35 35 VAL CG2 C 13 20.4 0.3 . 2 . . . . 36 VAL CG2 . 16307 1 441 . 1 1 35 35 VAL N N 15 117.5 0.1 . 1 . . . . 36 VAL N . 16307 1 442 . 1 1 36 36 ASN H H 1 8.43 0.01 . 1 . . . . 37 ASN H . 16307 1 443 . 1 1 36 36 ASN HA H 1 5.02 0.01 . 1 . . . . 37 ASN HA . 16307 1 444 . 1 1 36 36 ASN HB2 H 1 2.64 0.01 . 1 . . . . 37 ASN HB2 . 16307 1 445 . 1 1 36 36 ASN HB3 H 1 3.02 0.01 . 1 . . . . 37 ASN HB3 . 16307 1 446 . 1 1 36 36 ASN HD21 H 1 7.56 0.01 . 1 . . . . 37 ASN HD21 . 16307 1 447 . 1 1 36 36 ASN HD22 H 1 6.83 0.01 . 1 . . . . 37 ASN HD22 . 16307 1 448 . 1 1 36 36 ASN C C 13 174.6 0.3 . 1 . . . . 37 ASN C . 16307 1 449 . 1 1 36 36 ASN CA C 13 53.3 0.3 . 1 . . . . 37 ASN CA . 16307 1 450 . 1 1 36 36 ASN CB C 13 38.9 0.3 . 1 . . . . 37 ASN CB . 16307 1 451 . 1 1 36 36 ASN N N 15 117.8 0.1 . 1 . . . . 37 ASN N . 16307 1 452 . 1 1 36 36 ASN ND2 N 15 114.1 0.1 . 1 . . . . 37 ASN ND2 . 16307 1 453 . 1 1 37 37 THR H H 1 8 0.01 . 1 . . . . 38 THR H . 16307 1 454 . 1 1 37 37 THR HA H 1 4.65 0.01 . 1 . . . . 38 THR HA . 16307 1 455 . 1 1 37 37 THR HB H 1 4.71 0.01 . 1 . . . . 38 THR HB . 16307 1 456 . 1 1 37 37 THR HG21 H 1 2 0.01 . 1 . . . . 38 THR HG2 . 16307 1 457 . 1 1 37 37 THR HG22 H 1 2 0.01 . 1 . . . . 38 THR HG2 . 16307 1 458 . 1 1 37 37 THR HG23 H 1 2 0.01 . 1 . . . . 38 THR HG2 . 16307 1 459 . 1 1 37 37 THR C C 13 174.4 0.3 . 1 . . . . 38 THR C . 16307 1 460 . 1 1 37 37 THR CA C 13 62.4 0.3 . 1 . . . . 38 THR CA . 16307 1 461 . 1 1 37 37 THR CB C 13 70.8 0.3 . 1 . . . . 38 THR CB . 16307 1 462 . 1 1 37 37 THR CG2 C 13 23.1 0.3 . 1 . . . . 38 THR CG2 . 16307 1 463 . 1 1 37 37 THR N N 15 117.5 0.1 . 1 . . . . 38 THR N . 16307 1 464 . 1 1 38 38 ASP H H 1 9.06 0.01 . 1 . . . . 39 ASP H . 16307 1 465 . 1 1 38 38 ASP HA H 1 4.7 0.01 . 1 . . . . 39 ASP HA . 16307 1 466 . 1 1 38 38 ASP HB2 H 1 2.87 0.01 . 2 . . . . 39 ASP HB2 . 16307 1 467 . 1 1 38 38 ASP HB3 H 1 3.09 0.01 . 2 . . . . 39 ASP HB3 . 16307 1 468 . 1 1 38 38 ASP C C 13 176.8 0.3 . 1 . . . . 39 ASP C . 16307 1 469 . 1 1 38 38 ASP CA C 13 54.9 0.3 . 1 . . . . 39 ASP CA . 16307 1 470 . 1 1 38 38 ASP CB C 13 42.2 0.3 . 1 . . . . 39 ASP CB . 16307 1 471 . 1 1 38 38 ASP N N 15 127.1 0.1 . 1 . . . . 39 ASP N . 16307 1 472 . 1 1 39 39 MET H H 1 9.02 0.01 . 1 . . . . 40 MET H . 16307 1 473 . 1 1 39 39 MET HA H 1 4.4 0.01 . 1 . . . . 40 MET HA . 16307 1 474 . 1 1 39 39 MET HB2 H 1 2.47 0.01 . 2 . . . . 40 MET HB2 . 16307 1 475 . 1 1 39 39 MET HB3 H 1 2.32 0.01 . 2 . . . . 40 MET HB3 . 16307 1 476 . 1 1 39 39 MET HG2 H 1 2.63 0.01 . 2 . . . . 40 MET HG2 . 16307 1 477 . 1 1 39 39 MET HG3 H 1 2.82 0.01 . 2 . . . . 40 MET HG3 . 16307 1 478 . 1 1 39 39 MET C C 13 178.0 0.3 . 1 . . . . 40 MET C . 16307 1 479 . 1 1 39 39 MET CA C 13 60.5 0.3 . 1 . . . . 40 MET CA . 16307 1 480 . 1 1 39 39 MET CB C 13 33.2 0.3 . 1 . . . . 40 MET CB . 16307 1 481 . 1 1 39 39 MET CG C 13 31.6 0.3 . 1 . . . . 40 MET CG . 16307 1 482 . 1 1 39 39 MET N N 15 122.7 0.1 . 1 . . . . 40 MET N . 16307 1 483 . 1 1 40 40 ALA H H 1 8.73 0.01 . 1 . . . . 41 ALA H . 16307 1 484 . 1 1 40 40 ALA HA H 1 4.32 0.01 . 1 . . . . 41 ALA HA . 16307 1 485 . 1 1 40 40 ALA HB1 H 1 1.66 0.01 . 1 . . . . 41 ALA HB . 16307 1 486 . 1 1 40 40 ALA HB2 H 1 1.66 0.01 . 1 . . . . 41 ALA HB . 16307 1 487 . 1 1 40 40 ALA HB3 H 1 1.66 0.01 . 1 . . . . 41 ALA HB . 16307 1 488 . 1 1 40 40 ALA C C 13 181.7 0.3 . 1 . . . . 41 ALA C . 16307 1 489 . 1 1 40 40 ALA CA C 13 56.1 0.3 . 1 . . . . 41 ALA CA . 16307 1 490 . 1 1 40 40 ALA CB C 13 18.0 0.3 . 1 . . . . 41 ALA CB . 16307 1 491 . 1 1 40 40 ALA N N 15 121.1 0.1 . 1 . . . . 41 ALA N . 16307 1 492 . 1 1 41 41 LYS H H 1 8.35 0.01 . 1 . . . . 42 LYS H . 16307 1 493 . 1 1 41 41 LYS HA H 1 4.71 0.01 . 1 . . . . 42 LYS HA . 16307 1 494 . 1 1 41 41 LYS HB2 H 1 2.35 0.01 . 2 . . . . 42 LYS HB2 . 16307 1 495 . 1 1 41 41 LYS HB3 H 1 2.4 0.01 . 2 . . . . 42 LYS HB3 . 16307 1 496 . 1 1 41 41 LYS HE2 H 1 2.88 0.01 . 2 . . . . 42 LYS HE2 . 16307 1 497 . 1 1 41 41 LYS HE3 H 1 2.88 0.01 . 2 . . . . 42 LYS HE3 . 16307 1 498 . 1 1 41 41 LYS HG2 H 1 1.81 0.01 . 4 . . . . 42 LYS HG2 . 16307 1 499 . 1 1 41 41 LYS HG3 H 1 1.92 0.01 . 4 . . . . 42 LYS HG3 . 16307 1 500 . 1 1 41 41 LYS C C 13 181.0 0.3 . 1 . . . . 42 LYS C . 16307 1 501 . 1 1 41 41 LYS CA C 13 59.8 0.3 . 1 . . . . 42 LYS CA . 16307 1 502 . 1 1 41 41 LYS CB C 13 33.1 0.3 . 1 . . . . 42 LYS CB . 16307 1 503 . 1 1 41 41 LYS CD C 13 29.4 0.3 . 1 . . . . 42 LYS CD . 16307 1 504 . 1 1 41 41 LYS CE C 13 42.2 0.3 . 1 . . . . 42 LYS CE . 16307 1 505 . 1 1 41 41 LYS CG C 13 26.2 0.3 . 1 . . . . 42 LYS CG . 16307 1 506 . 1 1 41 41 LYS N N 15 120.8 0.1 . 1 . . . . 42 LYS N . 16307 1 507 . 1 1 42 42 GLN H H 1 9.31 0.01 . 1 . . . . 43 GLN H . 16307 1 508 . 1 1 42 42 GLN HA H 1 5.87 0.01 . 1 . . . . 43 GLN HA . 16307 1 509 . 1 1 42 42 GLN HB2 H 1 3.17 0.01 . 1 . . . . 43 GLN HB2 . 16307 1 510 . 1 1 42 42 GLN HB3 H 1 3.31 0.01 . 1 . . . . 43 GLN HB3 . 16307 1 511 . 1 1 42 42 GLN HE21 H 1 7.7 0.01 . 2 . . . . 43 GLN HE21 . 16307 1 512 . 1 1 42 42 GLN HE22 H 1 6.72 0.01 . 2 . . . . 43 GLN HE22 . 16307 1 513 . 1 1 42 42 GLN HG2 H 1 3.02 0.01 . 2 . . . . 43 GLN HG2 . 16307 1 514 . 1 1 42 42 GLN HG3 H 1 3.39 0.01 . 2 . . . . 43 GLN HG3 . 16307 1 515 . 1 1 42 42 GLN C C 13 179.8 0.3 . 1 . . . . 43 GLN C . 16307 1 516 . 1 1 42 42 GLN CA C 13 62.2 0.3 . 1 . . . . 43 GLN CA . 16307 1 517 . 1 1 42 42 GLN CB C 13 30.7 0.3 . 1 . . . . 43 GLN CB . 16307 1 518 . 1 1 42 42 GLN CG C 13 37.0 0.3 . 1 . . . . 43 GLN CG . 16307 1 519 . 1 1 42 42 GLN N N 15 122.9 0.1 . 1 . . . . 43 GLN N . 16307 1 520 . 1 1 42 42 GLN NE2 N 15 111.3 0.1 . 1 . . . . 43 GLN NE2 . 16307 1 521 . 1 1 43 43 LYS H H 1 9.02 0.01 . 1 . . . . 44 LYS H . 16307 1 522 . 1 1 43 43 LYS HA H 1 4.5 0.01 . 1 . . . . 44 LYS HA . 16307 1 523 . 1 1 43 43 LYS HB2 H 1 2.05 0.01 . 2 . . . . 44 LYS HB2 . 16307 1 524 . 1 1 43 43 LYS HB3 H 1 2.11 0.01 . 2 . . . . 44 LYS HB3 . 16307 1 525 . 1 1 43 43 LYS HD2 H 1 1.65 0.01 . 2 . . . . 44 LYS HD2 . 16307 1 526 . 1 1 43 43 LYS HD3 H 1 1.6 0.01 . 2 . . . . 44 LYS HD3 . 16307 1 527 . 1 1 43 43 LYS HE2 H 1 2.56 0.01 . 2 . . . . 44 LYS HE2 . 16307 1 528 . 1 1 43 43 LYS HE3 H 1 2.46 0.01 . 2 . . . . 44 LYS HE3 . 16307 1 529 . 1 1 43 43 LYS HG2 H 1 1.43 0.01 . 2 . . . . 44 LYS HG2 . 16307 1 530 . 1 1 43 43 LYS HG3 H 1 1.1 0.01 . 2 . . . . 44 LYS HG3 . 16307 1 531 . 1 1 43 43 LYS C C 13 179.3 0.3 . 1 . . . . 44 LYS C . 16307 1 532 . 1 1 43 43 LYS CA C 13 62.3 0.3 . 1 . . . . 44 LYS CA . 16307 1 533 . 1 1 43 43 LYS CB C 13 32.6 0.3 . 1 . . . . 44 LYS CB . 16307 1 534 . 1 1 43 43 LYS CD C 13 30.0 0.3 . 1 . . . . 44 LYS CD . 16307 1 535 . 1 1 43 43 LYS CE C 13 42.1 0.3 . 1 . . . . 44 LYS CE . 16307 1 536 . 1 1 43 43 LYS CG C 13 27.5 0.3 . 1 . . . . 44 LYS CG . 16307 1 537 . 1 1 43 43 LYS N N 15 119.9 0.1 . 1 . . . . 44 LYS N . 16307 1 538 . 1 1 44 44 GLN H H 1 8.84 0.01 . 1 . . . . 45 GLN H . 16307 1 539 . 1 1 44 44 GLN HA H 1 4.55 0.01 . 1 . . . . 45 GLN HA . 16307 1 540 . 1 1 44 44 GLN HB2 H 1 2.72 0.05 . 2 . . . . 45 GLN HB2 . 16307 1 541 . 1 1 44 44 GLN HB3 H 1 2.72 0.05 . 2 . . . . 45 GLN HB3 . 16307 1 542 . 1 1 44 44 GLN HE21 H 1 7.99 0.01 . 2 . . . . 45 GLN HE21 . 16307 1 543 . 1 1 44 44 GLN HE22 H 1 6.93 0.01 . 2 . . . . 45 GLN HE22 . 16307 1 544 . 1 1 44 44 GLN HG2 H 1 2.64 0.01 . 2 . . . . 45 GLN HG2 . 16307 1 545 . 1 1 44 44 GLN HG3 H 1 2.64 0.01 . 2 . . . . 45 GLN HG3 . 16307 1 546 . 1 1 44 44 GLN C C 13 179.0 0.3 . 1 . . . . 45 GLN C . 16307 1 547 . 1 1 44 44 GLN CA C 13 59.3 0.3 . 1 . . . . 45 GLN CA . 16307 1 548 . 1 1 44 44 GLN CB C 13 28.8 0.3 . 1 . . . . 45 GLN CB . 16307 1 549 . 1 1 44 44 GLN CG C 13 33.8 0.3 . 1 . . . . 45 GLN CG . 16307 1 550 . 1 1 44 44 GLN N N 15 119.3 0.1 . 1 . . . . 45 GLN N . 16307 1 551 . 1 1 44 44 GLN NE2 N 15 116.8 0.1 . 1 . . . . 45 GLN NE2 . 16307 1 552 . 1 1 45 45 HIS H H 1 10.67 0.01 . 1 . . . . 46 HIS H . 16307 1 553 . 1 1 45 45 HIS HA H 1 7.99 0.01 . 1 . . . . 46 HIS HA . 16307 1 554 . 1 1 45 45 HIS HB2 H 1 10.81 0.01 . 1 . . . . 46 HIS HB2 . 16307 1 555 . 1 1 45 45 HIS HB3 H 1 9.23 0.01 . 1 . . . . 46 HIS HB3 . 16307 1 556 . 1 1 45 45 HIS HD1 H 1 12.93 0.01 . 1 . . . . 46 HIS HD1 . 16307 1 557 . 1 1 45 45 HIS C C 13 180.8 0.3 . 1 . . . . 46 HIS C . 16307 1 558 . 1 1 45 45 HIS CA C 13 82.1 0.3 . 1 . . . . 46 HIS CA . 16307 1 559 . 1 1 45 45 HIS CB C 13 25.3 0.3 . 1 . . . . 46 HIS CB . 16307 1 560 . 1 1 45 45 HIS N N 15 122.1 0.1 . 1 . . . . 46 HIS N . 16307 1 561 . 1 1 45 45 HIS ND1 N 15 142.6 0.1 . 1 . . . . 46 HIS ND1 . 16307 1 562 . 1 1 46 46 GLN H H 1 10.55 0.01 . 1 . . . . 47 GLN H . 16307 1 563 . 1 1 46 46 GLN HA H 1 6.99 0.01 . 1 . . . . 47 GLN HA . 16307 1 564 . 1 1 46 46 GLN HB2 H 1 3.35 0.01 . 2 . . . . 47 GLN HB2 . 16307 1 565 . 1 1 46 46 GLN HB3 H 1 2.85 0.01 . 2 . . . . 47 GLN HB3 . 16307 1 566 . 1 1 46 46 GLN HE21 H 1 8.8 0.01 . 2 . . . . 47 GLN HE21 . 16307 1 567 . 1 1 46 46 GLN HE22 H 1 6.25 0.01 . 2 . . . . 47 GLN HE22 . 16307 1 568 . 1 1 46 46 GLN HG2 H 1 2.68 0.01 . 2 . . . . 47 GLN HG2 . 16307 1 569 . 1 1 46 46 GLN HG3 H 1 1.81 0.01 . 2 . . . . 47 GLN HG3 . 16307 1 570 . 1 1 46 46 GLN C C 13 180.0 0.3 . 1 . . . . 47 GLN C . 16307 1 571 . 1 1 46 46 GLN CA C 13 58.7 0.3 . 1 . . . . 47 GLN CA . 16307 1 572 . 1 1 46 46 GLN CB C 13 29.5 0.3 . 1 . . . . 47 GLN CB . 16307 1 573 . 1 1 46 46 GLN CG C 13 34.5 0.3 . 1 . . . . 47 GLN CG . 16307 1 574 . 1 1 46 46 GLN N N 15 124.6 0.1 . 1 . . . . 47 GLN N . 16307 1 575 . 1 1 46 46 GLN NE2 N 15 112.2 0.1 . 1 . . . . 47 GLN NE2 . 16307 1 576 . 1 1 47 47 LYS H H 1 9.72 0.01 . 1 . . . . 48 LYS H . 16307 1 577 . 1 1 47 47 LYS HA H 1 4.49 0.01 . 1 . . . . 48 LYS HA . 16307 1 578 . 1 1 47 47 LYS HB2 H 1 2.34 0.01 . 1 . . . . 48 LYS HB2 . 16307 1 579 . 1 1 47 47 LYS HB3 H 1 2.65 0.01 . 1 . . . . 48 LYS HB3 . 16307 1 580 . 1 1 47 47 LYS HD2 H 1 1.94 0.05 . 2 . . . . 48 LYS HD2 . 16307 1 581 . 1 1 47 47 LYS HD3 H 1 1.89 0.05 . 2 . . . . 48 LYS HD3 . 16307 1 582 . 1 1 47 47 LYS HE2 H 1 3.11 0.01 . 2 . . . . 48 LYS HE2 . 16307 1 583 . 1 1 47 47 LYS HE3 H 1 2.96 0.01 . 2 . . . . 48 LYS HE3 . 16307 1 584 . 1 1 47 47 LYS HG2 H 1 1.7 0.01 . 2 . . . . 48 LYS HG2 . 16307 1 585 . 1 1 47 47 LYS HG3 H 1 1.37 0.01 . 2 . . . . 48 LYS HG3 . 16307 1 586 . 1 1 47 47 LYS C C 13 179.9 0.3 . 1 . . . . 48 LYS C . 16307 1 587 . 1 1 47 47 LYS CA C 13 61.3 0.3 . 1 . . . . 48 LYS CA . 16307 1 588 . 1 1 47 47 LYS CB C 13 33.1 0.3 . 1 . . . . 48 LYS CB . 16307 1 589 . 1 1 47 47 LYS CD C 13 30.2 0.3 . 1 . . . . 48 LYS CD . 16307 1 590 . 1 1 47 47 LYS CE C 13 42.6 0.3 . 1 . . . . 48 LYS CE . 16307 1 591 . 1 1 47 47 LYS CG C 13 25.8 0.3 . 1 . . . . 48 LYS CG . 16307 1 592 . 1 1 47 47 LYS N N 15 124.2 0.1 . 1 . . . . 48 LYS N . 16307 1 593 . 1 1 48 48 ASP H H 1 10.07 0.01 . 1 . . . . 49 ASP H . 16307 1 594 . 1 1 48 48 ASP HA H 1 4.36 0.01 . 1 . . . . 49 ASP HA . 16307 1 595 . 1 1 48 48 ASP HB2 H 1 3.04 0.01 . 2 . . . . 49 ASP HB2 . 16307 1 596 . 1 1 48 48 ASP HB3 H 1 1.13 0.01 . 2 . . . . 49 ASP HB3 . 16307 1 597 . 1 1 48 48 ASP C C 13 177.7 0.3 . 1 . . . . 49 ASP C . 16307 1 598 . 1 1 48 48 ASP CA C 13 58.7 0.3 . 1 . . . . 49 ASP CA . 16307 1 599 . 1 1 48 48 ASP CB C 13 39.6 0.3 . 1 . . . . 49 ASP CB . 16307 1 600 . 1 1 48 48 ASP N N 15 125.8 0.1 . 1 . . . . 49 ASP N . 16307 1 601 . 1 1 49 49 PHE H H 1 10.23 0.01 . 1 . . . . 50 PHE H . 16307 1 602 . 1 1 49 49 PHE HA H 1 3.2 0.01 . 1 . . . . 50 PHE HA . 16307 1 603 . 1 1 49 49 PHE HB2 H 1 3.73 0.01 . 2 . . . . 50 PHE HB2 . 16307 1 604 . 1 1 49 49 PHE HB3 H 1 4.26 0.01 . 2 . . . . 50 PHE HB3 . 16307 1 605 . 1 1 49 49 PHE HD1 H 1 5.29 0.01 . 3 . . . . 50 PHE HD1 . 16307 1 606 . 1 1 49 49 PHE HD2 H 1 5.29 0.01 . 3 . . . . 50 PHE HD2 . 16307 1 607 . 1 1 49 49 PHE HE1 H 1 5.54 0.01 . 3 . . . . 50 PHE HE1 . 16307 1 608 . 1 1 49 49 PHE HE2 H 1 5.54 0.01 . 3 . . . . 50 PHE HE2 . 16307 1 609 . 1 1 49 49 PHE HZ H 1 5.91 0.01 . 1 . . . . 50 PHE HZ . 16307 1 610 . 1 1 49 49 PHE C C 13 177.1 0.3 . 1 . . . . 50 PHE C . 16307 1 611 . 1 1 49 49 PHE CA C 13 62.5 0.3 . 1 . . . . 50 PHE CA . 16307 1 612 . 1 1 49 49 PHE CB C 13 40.1 0.3 . 1 . . . . 50 PHE CB . 16307 1 613 . 1 1 49 49 PHE CD1 C 13 131.4 0.3 . 3 . . . . 50 PHE CD1 . 16307 1 614 . 1 1 49 49 PHE CD2 C 13 131.4 0.3 . 3 . . . . 50 PHE CD2 . 16307 1 615 . 1 1 49 49 PHE CE1 C 13 129.9 0.3 . 3 . . . . 50 PHE CE1 . 16307 1 616 . 1 1 49 49 PHE CE2 C 13 129.9 0.3 . 3 . . . . 50 PHE CE2 . 16307 1 617 . 1 1 49 49 PHE CZ C 13 128.2 0.3 . 1 . . . . 50 PHE CZ . 16307 1 618 . 1 1 49 49 PHE N N 15 121.9 0.1 . 1 . . . . 50 PHE N . 16307 1 619 . 1 1 50 50 MET H H 1 8.95 0.01 . 1 . . . . 51 MET H . 16307 1 620 . 1 1 50 50 MET HA H 1 3.87 0.01 . 1 . . . . 51 MET HA . 16307 1 621 . 1 1 50 50 MET HB2 H 1 2.67 0.01 . 2 . . . . 51 MET HB2 . 16307 1 622 . 1 1 50 50 MET HB3 H 1 2.5 0.01 . 2 . . . . 51 MET HB3 . 16307 1 623 . 1 1 50 50 MET HE1 H 1 2.07 0.01 . 1 . . . . 51 MET HE . 16307 1 624 . 1 1 50 50 MET HE2 H 1 2.07 0.01 . 1 . . . . 51 MET HE . 16307 1 625 . 1 1 50 50 MET HE3 H 1 2.07 0.01 . 1 . . . . 51 MET HE . 16307 1 626 . 1 1 50 50 MET HG2 H 1 2.85 0.01 . 2 . . . . 51 MET HG2 . 16307 1 627 . 1 1 50 50 MET HG3 H 1 2.5 0.01 . 2 . . . . 51 MET HG3 . 16307 1 628 . 1 1 50 50 MET C C 13 176.8 0.3 . 1 . . . . 51 MET C . 16307 1 629 . 1 1 50 50 MET CA C 13 60.6 0.3 . 1 . . . . 51 MET CA . 16307 1 630 . 1 1 50 50 MET CB C 13 34.4 0.3 . 1 . . . . 51 MET CB . 16307 1 631 . 1 1 50 50 MET CE C 13 16.7 0.3 . 1 . . . . 51 MET CE . 16307 1 632 . 1 1 50 50 MET CG C 13 32.1 0.3 . 1 . . . . 51 MET CG . 16307 1 633 . 1 1 50 50 MET N N 15 118.4 0.1 . 1 . . . . 51 MET N . 16307 1 634 . 1 1 51 51 THR H H 1 8.92 0.01 . 1 . . . . 52 THR H . 16307 1 635 . 1 1 51 51 THR HA H 1 3.78 0.01 . 1 . . . . 52 THR HA . 16307 1 636 . 1 1 51 51 THR HB H 1 4.63 0.01 . 1 . . . . 52 THR HB . 16307 1 637 . 1 1 51 51 THR HG21 H 1 1.34 0.01 . 1 . . . . 52 THR HG2 . 16307 1 638 . 1 1 51 51 THR HG22 H 1 1.34 0.01 . 1 . . . . 52 THR HG2 . 16307 1 639 . 1 1 51 51 THR HG23 H 1 1.34 0.01 . 1 . . . . 52 THR HG2 . 16307 1 640 . 1 1 51 51 THR C C 13 177.0 0.3 . 1 . . . . 52 THR C . 16307 1 641 . 1 1 51 51 THR CA C 13 67.7 0.3 . 1 . . . . 52 THR CA . 16307 1 642 . 1 1 51 51 THR CB C 13 68.7 0.3 . 1 . . . . 52 THR CB . 16307 1 643 . 1 1 51 51 THR CG2 C 13 21.2 0.3 . 1 . . . . 52 THR CG2 . 16307 1 644 . 1 1 51 51 THR N N 15 116.7 0.1 . 1 . . . . 52 THR N . 16307 1 645 . 1 1 52 52 TYR H H 1 8.13 0.01 . 1 . . . . 53 TYR H . 16307 1 646 . 1 1 52 52 TYR HA H 1 3.37 0.01 . 1 . . . . 53 TYR HA . 16307 1 647 . 1 1 52 52 TYR HB2 H 1 2.07 0.01 . 1 . . . . 53 TYR HB2 . 16307 1 648 . 1 1 52 52 TYR HB3 H 1 2.64 0.01 . 1 . . . . 53 TYR HB3 . 16307 1 649 . 1 1 52 52 TYR HD1 H 1 6.33 0.01 . 3 . . . . 53 TYR HD1 . 16307 1 650 . 1 1 52 52 TYR HD2 H 1 6.33 0.01 . 3 . . . . 53 TYR HD2 . 16307 1 651 . 1 1 52 52 TYR HE1 H 1 6.57 0.01 . 3 . . . . 53 TYR HE1 . 16307 1 652 . 1 1 52 52 TYR HE2 H 1 6.57 0.01 . 3 . . . . 53 TYR HE2 . 16307 1 653 . 1 1 52 52 TYR C C 13 176.8 0.3 . 1 . . . . 53 TYR C . 16307 1 654 . 1 1 52 52 TYR CA C 13 61.9 0.3 . 1 . . . . 53 TYR CA . 16307 1 655 . 1 1 52 52 TYR CB C 13 38.9 0.3 . 1 . . . . 53 TYR CB . 16307 1 656 . 1 1 52 52 TYR CD1 C 13 133.2 0.3 . 3 . . . . 53 TYR CD1 . 16307 1 657 . 1 1 52 52 TYR CD2 C 13 133.2 0.3 . 3 . . . . 53 TYR CD2 . 16307 1 658 . 1 1 52 52 TYR CE1 C 13 118.1 0.3 . 3 . . . . 53 TYR CE1 . 16307 1 659 . 1 1 52 52 TYR CE2 C 13 118.1 0.3 . 3 . . . . 53 TYR CE2 . 16307 1 660 . 1 1 52 52 TYR N N 15 124.3 0.1 . 1 . . . . 53 TYR N . 16307 1 661 . 1 1 53 53 ALA H H 1 8.29 0.01 . 1 . . . . 54 ALA H . 16307 1 662 . 1 1 53 53 ALA HA H 1 3.48 0.01 . 1 . . . . 54 ALA HA . 16307 1 663 . 1 1 53 53 ALA HB1 H 1 1 0.01 . 1 . . . . 54 ALA HB . 16307 1 664 . 1 1 53 53 ALA HB2 H 1 1 0.01 . 1 . . . . 54 ALA HB . 16307 1 665 . 1 1 53 53 ALA HB3 H 1 1 0.01 . 1 . . . . 54 ALA HB . 16307 1 666 . 1 1 53 53 ALA C C 13 175.6 0.3 . 1 . . . . 54 ALA C . 16307 1 667 . 1 1 53 53 ALA CA C 13 54.6 0.3 . 1 . . . . 54 ALA CA . 16307 1 668 . 1 1 53 53 ALA CB C 13 19.1 0.3 . 1 . . . . 54 ALA CB . 16307 1 669 . 1 1 53 53 ALA N N 15 120.1 0.1 . 1 . . . . 54 ALA N . 16307 1 670 . 1 1 54 54 PHE H H 1 7.53 0.01 . 1 . . . . 55 PHE H . 16307 1 671 . 1 1 54 54 PHE HA H 1 4.35 0.01 . 1 . . . . 55 PHE HA . 16307 1 672 . 1 1 54 54 PHE HB2 H 1 2.88 0.01 . 1 . . . . 55 PHE HB2 . 16307 1 673 . 1 1 54 54 PHE HB3 H 1 3.27 0.01 . 1 . . . . 55 PHE HB3 . 16307 1 674 . 1 1 54 54 PHE HD1 H 1 7.32 0.01 . 3 . . . . 55 PHE HD1 . 16307 1 675 . 1 1 54 54 PHE HD2 H 1 7.32 0.01 . 3 . . . . 55 PHE HD2 . 16307 1 676 . 1 1 54 54 PHE HE1 H 1 7 0.01 . 3 . . . . 55 PHE HE1 . 16307 1 677 . 1 1 54 54 PHE HE2 H 1 7 0.01 . 3 . . . . 55 PHE HE2 . 16307 1 678 . 1 1 54 54 PHE HZ H 1 6.95 0.01 . 1 . . . . 55 PHE HZ . 16307 1 679 . 1 1 54 54 PHE C C 13 176.3 0.3 . 1 . . . . 55 PHE C . 16307 1 680 . 1 1 54 54 PHE CA C 13 58.4 0.3 . 1 . . . . 55 PHE CA . 16307 1 681 . 1 1 54 54 PHE CB C 13 38.5 0.3 . 1 . . . . 55 PHE CB . 16307 1 682 . 1 1 54 54 PHE CD1 C 13 131.9 0.3 . 3 . . . . 55 PHE CD1 . 16307 1 683 . 1 1 54 54 PHE CD2 C 13 131.9 0.3 . 3 . . . . 55 PHE CD2 . 16307 1 684 . 1 1 54 54 PHE CE1 C 13 130.0 0.3 . 3 . . . . 55 PHE CE1 . 16307 1 685 . 1 1 54 54 PHE CE2 C 13 130.0 0.3 . 3 . . . . 55 PHE CE2 . 16307 1 686 . 1 1 54 54 PHE CZ C 13 128.5 0.3 . 1 . . . . 55 PHE CZ . 16307 1 687 . 1 1 54 54 PHE N N 15 110.9 0.1 . 1 . . . . 55 PHE N . 16307 1 688 . 1 1 55 55 GLY H H 1 7.99 0.01 . 1 . . . . 56 GLY H . 16307 1 689 . 1 1 55 55 GLY HA2 H 1 3.47 0.01 . 1 . . . . 56 GLY HA2 . 16307 1 690 . 1 1 55 55 GLY HA3 H 1 4.35 0.01 . 1 . . . . 56 GLY HA3 . 16307 1 691 . 1 1 55 55 GLY C C 13 175.5 0.3 . 1 . . . . 56 GLY C . 16307 1 692 . 1 1 55 55 GLY CA C 13 45.4 0.3 . 1 . . . . 56 GLY CA . 16307 1 693 . 1 1 55 55 GLY N N 15 106.9 0.1 . 1 . . . . 56 GLY N . 16307 1 694 . 1 1 56 56 GLY H H 1 8.38 0.01 . 1 . . . . 57 GLY H . 16307 1 695 . 1 1 56 56 GLY HA2 H 1 4.47 0.01 . 2 . . . . 57 GLY HA2 . 16307 1 696 . 1 1 56 56 GLY HA3 H 1 3.28 0.01 . 2 . . . . 57 GLY HA3 . 16307 1 697 . 1 1 56 56 GLY C C 13 175.7 0.3 . 1 . . . . 57 GLY C . 16307 1 698 . 1 1 56 56 GLY CA C 13 47.1 0.3 . 1 . . . . 57 GLY CA . 16307 1 699 . 1 1 56 56 GLY N N 15 113.2 0.1 . 1 . . . . 57 GLY N . 16307 1 700 . 1 1 57 57 THR H H 1 7.58 0.01 . 1 . . . . 58 THR H . 16307 1 701 . 1 1 57 57 THR HA H 1 3.68 0.01 . 1 . . . . 58 THR HA . 16307 1 702 . 1 1 57 57 THR HB H 1 4.04 0.01 . 1 . . . . 58 THR HB . 16307 1 703 . 1 1 57 57 THR HG21 H 1 0.3 0.01 . 1 . . . . 58 THR HG2 . 16307 1 704 . 1 1 57 57 THR HG22 H 1 0.3 0.01 . 1 . . . . 58 THR HG2 . 16307 1 705 . 1 1 57 57 THR HG23 H 1 0.3 0.01 . 1 . . . . 58 THR HG2 . 16307 1 706 . 1 1 57 57 THR C C 13 176.3 0.3 . 1 . . . . 58 THR C . 16307 1 707 . 1 1 57 57 THR CA C 13 63.2 0.3 . 1 . . . . 58 THR CA . 16307 1 708 . 1 1 57 57 THR CB C 13 68.4 0.3 . 1 . . . . 58 THR CB . 16307 1 709 . 1 1 57 57 THR CG2 C 13 21.1 0.3 . 1 . . . . 58 THR CG2 . 16307 1 710 . 1 1 57 57 THR N N 15 111.0 0.1 . 1 . . . . 58 THR N . 16307 1 711 . 1 1 58 58 ASP H H 1 8.57 0.01 . 1 . . . . 59 ASP H . 16307 1 712 . 1 1 58 58 ASP HA H 1 4.24 0.01 . 1 . . . . 59 ASP HA . 16307 1 713 . 1 1 58 58 ASP HB2 H 1 2.55 0.01 . 2 . . . . 59 ASP HB2 . 16307 1 714 . 1 1 58 58 ASP HB3 H 1 2.55 0.01 . 2 . . . . 59 ASP HB3 . 16307 1 715 . 1 1 58 58 ASP C C 13 176.8 0.3 . 1 . . . . 59 ASP C . 16307 1 716 . 1 1 58 58 ASP CA C 13 55.6 0.3 . 1 . . . . 59 ASP CA . 16307 1 717 . 1 1 58 58 ASP CB C 13 40.2 0.3 . 1 . . . . 59 ASP CB . 16307 1 718 . 1 1 58 58 ASP N N 15 121.5 0.1 . 1 . . . . 59 ASP N . 16307 1 719 . 1 1 59 59 ARG H H 1 7.16 0.01 . 1 . . . . 60 ARG H . 16307 1 720 . 1 1 59 59 ARG HA H 1 3.75 0.01 . 1 . . . . 60 ARG HA . 16307 1 721 . 1 1 59 59 ARG HB2 H 1 1.03 0.01 . 2 . . . . 60 ARG HB2 . 16307 1 722 . 1 1 59 59 ARG HB3 H 1 1.03 0.01 . 2 . . . . 60 ARG HB3 . 16307 1 723 . 1 1 59 59 ARG HD2 H 1 2.84 0.01 . 2 . . . . 60 ARG HD2 . 16307 1 724 . 1 1 59 59 ARG HD3 H 1 2.78 0.01 . 2 . . . . 60 ARG HD3 . 16307 1 725 . 1 1 59 59 ARG HG2 H 1 1.08 0.01 . 2 . . . . 60 ARG HG2 . 16307 1 726 . 1 1 59 59 ARG HG3 H 1 1.08 0.01 . 2 . . . . 60 ARG HG3 . 16307 1 727 . 1 1 59 59 ARG C C 13 174.4 0.3 . 1 . . . . 60 ARG C . 16307 1 728 . 1 1 59 59 ARG CA C 13 55.9 0.3 . 1 . . . . 60 ARG CA . 16307 1 729 . 1 1 59 59 ARG CB C 13 29.7 0.3 . 1 . . . . 60 ARG CB . 16307 1 730 . 1 1 59 59 ARG CD C 13 42.9 0.3 . 1 . . . . 60 ARG CD . 16307 1 731 . 1 1 59 59 ARG CG C 13 26.9 0.3 . 1 . . . . 60 ARG CG . 16307 1 732 . 1 1 59 59 ARG N N 15 116.6 0.1 . 1 . . . . 60 ARG N . 16307 1 733 . 1 1 60 60 PHE H H 1 7.36 0.01 . 1 . . . . 61 PHE H . 16307 1 734 . 1 1 60 60 PHE HA H 1 4.45 0.01 . 1 . . . . 61 PHE HA . 16307 1 735 . 1 1 60 60 PHE HB2 H 1 2.65 0.01 . 2 . . . . 61 PHE HB2 . 16307 1 736 . 1 1 60 60 PHE HB3 H 1 2.69 0.01 . 2 . . . . 61 PHE HB3 . 16307 1 737 . 1 1 60 60 PHE HD1 H 1 6.45 0.01 . 3 . . . . 61 PHE HD1 . 16307 1 738 . 1 1 60 60 PHE HD2 H 1 6.45 0.01 . 3 . . . . 61 PHE HD2 . 16307 1 739 . 1 1 60 60 PHE HE1 H 1 6.35 0.01 . 3 . . . . 61 PHE HE1 . 16307 1 740 . 1 1 60 60 PHE HE2 H 1 6.35 0.01 . 3 . . . . 61 PHE HE2 . 16307 1 741 . 1 1 60 60 PHE HZ H 1 6.69 0.01 . 1 . . . . 61 PHE HZ . 16307 1 742 . 1 1 60 60 PHE C C 13 182.1 0.3 . 1 . . . . 61 PHE C . 16307 1 743 . 1 1 60 60 PHE CA C 13 54.1 0.3 . 1 . . . . 61 PHE CA . 16307 1 744 . 1 1 60 60 PHE CB C 13 39.3 0.3 . 1 . . . . 61 PHE CB . 16307 1 745 . 1 1 60 60 PHE CD1 C 13 132.2 0.3 . 3 . . . . 61 PHE CD1 . 16307 1 746 . 1 1 60 60 PHE CD2 C 13 132.2 0.3 . 3 . . . . 61 PHE CD2 . 16307 1 747 . 1 1 60 60 PHE CE1 C 13 130.0 0.3 . 3 . . . . 61 PHE CE1 . 16307 1 748 . 1 1 60 60 PHE CE2 C 13 130.0 0.3 . 3 . . . . 61 PHE CE2 . 16307 1 749 . 1 1 60 60 PHE CZ C 13 129.1 0.3 . 1 . . . . 61 PHE CZ . 16307 1 750 . 1 1 60 60 PHE N N 15 118.0 0.1 . 1 . . . . 61 PHE N . 16307 1 751 . 1 1 61 61 PRO HA H 1 4.53 0.01 . 1 . . . . 62 PRO HA . 16307 1 752 . 1 1 61 61 PRO HB2 H 1 2.4 0.01 . 2 . . . . 62 PRO HB2 . 16307 1 753 . 1 1 61 61 PRO HB3 H 1 1.98 0.01 . 2 . . . . 62 PRO HB3 . 16307 1 754 . 1 1 61 61 PRO HD2 H 1 3.26 0.01 . 2 . . . . 62 PRO HD2 . 16307 1 755 . 1 1 61 61 PRO HD3 H 1 3.25 0.01 . 2 . . . . 62 PRO HD3 . 16307 1 756 . 1 1 61 61 PRO HG2 H 1 1.99 0.01 . 2 . . . . 62 PRO HG2 . 16307 1 757 . 1 1 61 61 PRO HG3 H 1 1.89 0.01 . 2 . . . . 62 PRO HG3 . 16307 1 758 . 1 1 61 61 PRO C C 13 178.6 0.3 . 1 . . . . 62 PRO C . 16307 1 759 . 1 1 61 61 PRO CA C 13 63.1 0.3 . 1 . . . . 62 PRO CA . 16307 1 760 . 1 1 61 61 PRO CB C 13 32.1 0.3 . 1 . . . . 62 PRO CB . 16307 1 761 . 1 1 61 61 PRO CD C 13 50.1 0.3 . 1 . . . . 62 PRO CD . 16307 1 762 . 1 1 61 61 PRO CG C 13 27.5 0.3 . 1 . . . . 62 PRO CG . 16307 1 763 . 1 1 62 62 GLY H H 1 9.07 0.01 . 1 . . . . 63 GLY H . 16307 1 764 . 1 1 62 62 GLY HA2 H 1 4.29 0.01 . 2 . . . . 63 GLY HA2 . 16307 1 765 . 1 1 62 62 GLY HA3 H 1 4.09 0.01 . 2 . . . . 63 GLY HA3 . 16307 1 766 . 1 1 62 62 GLY C C 13 176.4 0.3 . 1 . . . . 63 GLY C . 16307 1 767 . 1 1 62 62 GLY CA C 13 48.7 0.3 . 1 . . . . 63 GLY CA . 16307 1 768 . 1 1 62 62 GLY N N 15 112.8 0.1 . 1 . . . . 63 GLY N . 16307 1 769 . 1 1 63 63 ARG H H 1 9.03 0.01 . 1 . . . . 64 ARG H . 16307 1 770 . 1 1 63 63 ARG HA H 1 4.44 0.01 . 1 . . . . 64 ARG HA . 16307 1 771 . 1 1 63 63 ARG HB2 H 1 2.01 0.01 . 2 . . . . 64 ARG HB2 . 16307 1 772 . 1 1 63 63 ARG HB3 H 1 1.95 0.01 . 2 . . . . 64 ARG HB3 . 16307 1 773 . 1 1 63 63 ARG HD2 H 1 3.25 0.01 . 2 . . . . 64 ARG HD2 . 16307 1 774 . 1 1 63 63 ARG HD3 H 1 3.25 0.01 . 2 . . . . 64 ARG HD3 . 16307 1 775 . 1 1 63 63 ARG HG2 H 1 1.83 0.01 . 2 . . . . 64 ARG HG2 . 16307 1 776 . 1 1 63 63 ARG HG3 H 1 1.75 0.01 . 2 . . . . 64 ARG HG3 . 16307 1 777 . 1 1 63 63 ARG C C 13 179.3 0.3 . 1 . . . . 64 ARG C . 16307 1 778 . 1 1 63 63 ARG CA C 13 59.3 0.3 . 1 . . . . 64 ARG CA . 16307 1 779 . 1 1 63 63 ARG CB C 13 30.0 0.3 . 1 . . . . 64 ARG CB . 16307 1 780 . 1 1 63 63 ARG CD C 13 43.4 0.3 . 1 . . . . 64 ARG CD . 16307 1 781 . 1 1 63 63 ARG CG C 13 27.2 0.3 . 1 . . . . 64 ARG CG . 16307 1 782 . 1 1 63 63 ARG N N 15 119.8 0.1 . 1 . . . . 64 ARG N . 16307 1 783 . 1 1 64 64 SER H H 1 7.55 0.01 . 1 . . . . 65 SER H . 16307 1 784 . 1 1 64 64 SER HA H 1 4.51 0.01 . 1 . . . . 65 SER HA . 16307 1 785 . 1 1 64 64 SER HB2 H 1 3.84 0.01 . 2 . . . . 65 SER HB2 . 16307 1 786 . 1 1 64 64 SER HB3 H 1 3.74 0.01 . 2 . . . . 65 SER HB3 . 16307 1 787 . 1 1 64 64 SER C C 13 177.3 0.3 . 1 . . . . 65 SER C . 16307 1 788 . 1 1 64 64 SER CA C 13 60.5 0.3 . 1 . . . . 65 SER CA . 16307 1 789 . 1 1 64 64 SER CB C 13 62.5 0.3 . 1 . . . . 65 SER CB . 16307 1 790 . 1 1 64 64 SER N N 15 115.4 0.1 . 1 . . . . 65 SER N . 16307 1 791 . 1 1 65 65 MET H H 1 8.84 0.01 . 1 . . . . 66 MET H . 16307 1 792 . 1 1 65 65 MET HA H 1 6.02 0.01 . 1 . . . . 66 MET HA . 16307 1 793 . 1 1 65 65 MET HB2 H 1 3.45 0.01 . 1 . . . . 66 MET HB2 . 16307 1 794 . 1 1 65 65 MET HB3 H 1 4.12 0.01 . 1 . . . . 66 MET HB3 . 16307 1 795 . 1 1 65 65 MET HE1 H 1 0.9 0.01 . 1 . . . . 66 MET HE . 16307 1 796 . 1 1 65 65 MET HE2 H 1 0.9 0.01 . 1 . . . . 66 MET HE . 16307 1 797 . 1 1 65 65 MET HE3 H 1 0.9 0.01 . 1 . . . . 66 MET HE . 16307 1 798 . 1 1 65 65 MET HG2 H 1 2.72 0.01 . 1 . . . . 66 MET HG2 . 16307 1 799 . 1 1 65 65 MET HG3 H 1 3.25 0.01 . 1 . . . . 66 MET HG3 . 16307 1 800 . 1 1 65 65 MET C C 13 181.6 0.3 . 1 . . . . 66 MET C . 16307 1 801 . 1 1 65 65 MET CA C 13 59.4 0.3 . 1 . . . . 66 MET CA . 16307 1 802 . 1 1 65 65 MET CB C 13 36.9 0.3 . 1 . . . . 66 MET CB . 16307 1 803 . 1 1 65 65 MET CE C 13 19.2 0.3 . 1 . . . . 66 MET CE . 16307 1 804 . 1 1 65 65 MET CG C 13 34.5 0.3 . 1 . . . . 66 MET CG . 16307 1 805 . 1 1 65 65 MET N N 15 123.3 0.1 . 1 . . . . 66 MET N . 16307 1 806 . 1 1 66 66 ARG H H 1 9.73 0.01 . 1 . . . . 67 ARG H . 16307 1 807 . 1 1 66 66 ARG HA H 1 6.32 0.01 . 1 . . . . 67 ARG HA . 16307 1 808 . 1 1 66 66 ARG HB2 H 1 2.72 0.01 . 2 . . . . 67 ARG HB2 . 16307 1 809 . 1 1 66 66 ARG HB3 H 1 2.72 0.01 . 2 . . . . 67 ARG HB3 . 16307 1 810 . 1 1 66 66 ARG HD2 H 1 3.82 0.01 . 2 . . . . 67 ARG HD2 . 16307 1 811 . 1 1 66 66 ARG HD3 H 1 3.63 0.01 . 2 . . . . 67 ARG HD3 . 16307 1 812 . 1 1 66 66 ARG HE H 1 8.05 0.01 . 1 . . . . 67 ARG HE . 16307 1 813 . 1 1 66 66 ARG HG2 H 1 2.75 0.01 . 2 . . . . 67 ARG HG2 . 16307 1 814 . 1 1 66 66 ARG HG3 H 1 2.62 0.01 . 2 . . . . 67 ARG HG3 . 16307 1 815 . 1 1 66 66 ARG C C 13 180.6 0.3 . 1 . . . . 67 ARG C . 16307 1 816 . 1 1 66 66 ARG CA C 13 60.6 0.3 . 1 . . . . 67 ARG CA . 16307 1 817 . 1 1 66 66 ARG CB C 13 32.0 0.3 . 1 . . . . 67 ARG CB . 16307 1 818 . 1 1 66 66 ARG CD C 13 44.1 0.3 . 1 . . . . 67 ARG CD . 16307 1 819 . 1 1 66 66 ARG CG C 13 30.0 0.3 . 1 . . . . 67 ARG CG . 16307 1 820 . 1 1 66 66 ARG N N 15 124.8 0.1 . 1 . . . . 67 ARG N . 16307 1 821 . 1 1 66 66 ARG NE N 15 85.4 0.1 . 1 . . . . 67 ARG NE . 16307 1 822 . 1 1 67 67 ALA H H 1 8.42 0.01 . 1 . . . . 68 ALA H . 16307 1 823 . 1 1 67 67 ALA HA H 1 4.83 0.01 . 1 . . . . 68 ALA HA . 16307 1 824 . 1 1 67 67 ALA HB1 H 1 1.79 0.01 . 1 . . . . 68 ALA HB . 16307 1 825 . 1 1 67 67 ALA HB2 H 1 1.79 0.01 . 1 . . . . 68 ALA HB . 16307 1 826 . 1 1 67 67 ALA HB3 H 1 1.79 0.01 . 1 . . . . 68 ALA HB . 16307 1 827 . 1 1 67 67 ALA C C 13 181.2 0.3 . 1 . . . . 68 ALA C . 16307 1 828 . 1 1 67 67 ALA CA C 13 56.1 0.3 . 1 . . . . 68 ALA CA . 16307 1 829 . 1 1 67 67 ALA CB C 13 18.6 0.3 . 1 . . . . 68 ALA CB . 16307 1 830 . 1 1 67 67 ALA N N 15 121.8 0.1 . 1 . . . . 68 ALA N . 16307 1 831 . 1 1 68 68 ALA H H 1 9.21 0.01 . 1 . . . . 69 ALA H . 16307 1 832 . 1 1 68 68 ALA HA H 1 3.94 0.01 . 1 . . . . 69 ALA HA . 16307 1 833 . 1 1 68 68 ALA HB1 H 1 0.31 0.01 . 1 . . . . 69 ALA HB . 16307 1 834 . 1 1 68 68 ALA HB2 H 1 0.31 0.01 . 1 . . . . 69 ALA HB . 16307 1 835 . 1 1 68 68 ALA HB3 H 1 0.31 0.01 . 1 . . . . 69 ALA HB . 16307 1 836 . 1 1 68 68 ALA C C 13 180.0 0.3 . 1 . . . . 69 ALA C . 16307 1 837 . 1 1 68 68 ALA CA C 13 54.3 0.3 . 1 . . . . 69 ALA CA . 16307 1 838 . 1 1 68 68 ALA CB C 13 17.3 0.3 . 1 . . . . 69 ALA CB . 16307 1 839 . 1 1 68 68 ALA N N 15 117.5 0.1 . 1 . . . . 69 ALA N . 16307 1 840 . 1 1 69 69 HIS H H 1 10.46 0.01 . 1 . . . . 70 HIS H . 16307 1 841 . 1 1 69 69 HIS HA H 1 7.5 0.01 . 1 . . . . 70 HIS HA . 16307 1 842 . 1 1 69 69 HIS HB2 H 1 10.44 0.01 . 1 . . . . 70 HIS HB2 . 16307 1 843 . 1 1 69 69 HIS HB3 H 1 9.26 0.01 . 1 . . . . 70 HIS HB3 . 16307 1 844 . 1 1 69 69 HIS HD1 H 1 15.75 0.01 . 1 . . . . 70 HIS HD1 . 16307 1 845 . 1 1 69 69 HIS C C 13 175.4 0.3 . 1 . . . . 70 HIS C . 16307 1 846 . 1 1 69 69 HIS CA C 13 70.8 0.3 . 1 . . . . 70 HIS CA . 16307 1 847 . 1 1 69 69 HIS CB C 13 25.3 0.3 . 1 . . . . 70 HIS CB . 16307 1 848 . 1 1 69 69 HIS N N 15 114.4 0.1 . 1 . . . . 70 HIS N . 16307 1 849 . 1 1 69 69 HIS ND1 N 15 135.3 0.1 . 1 . . . . 70 HIS ND1 . 16307 1 850 . 1 1 70 70 GLN H H 1 9.11 0.01 . 1 . . . . 71 GLN H . 16307 1 851 . 1 1 70 70 GLN HA H 1 5.02 0.01 . 1 . . . . 71 GLN HA . 16307 1 852 . 1 1 70 70 GLN HB2 H 1 3.2 0.01 . 1 . . . . 71 GLN HB2 . 16307 1 853 . 1 1 70 70 GLN HB3 H 1 2.7 0.01 . 1 . . . . 71 GLN HB3 . 16307 1 854 . 1 1 70 70 GLN HE21 H 1 8.03 0.01 . 2 . . . . 71 GLN HE21 . 16307 1 855 . 1 1 70 70 GLN HE22 H 1 6.98 0.01 . 2 . . . . 71 GLN HE22 . 16307 1 856 . 1 1 70 70 GLN HG2 H 1 2.88 0.01 . 2 . . . . 71 GLN HG2 . 16307 1 857 . 1 1 70 70 GLN HG3 H 1 2.79 0.01 . 2 . . . . 71 GLN HG3 . 16307 1 858 . 1 1 70 70 GLN C C 13 178.2 0.3 . 1 . . . . 71 GLN C . 16307 1 859 . 1 1 70 70 GLN CA C 13 61.8 0.3 . 1 . . . . 71 GLN CA . 16307 1 860 . 1 1 70 70 GLN CB C 13 28.9 0.3 . 1 . . . . 71 GLN CB . 16307 1 861 . 1 1 70 70 GLN CG C 13 33.4 0.3 . 1 . . . . 71 GLN CG . 16307 1 862 . 1 1 70 70 GLN N N 15 125.3 0.1 . 1 . . . . 71 GLN N . 16307 1 863 . 1 1 70 70 GLN NE2 N 15 111.8 0.1 . 1 . . . . 71 GLN NE2 . 16307 1 864 . 1 1 71 71 ASP H H 1 9.24 0.01 . 1 . . . . 72 ASP H . 16307 1 865 . 1 1 71 71 ASP HA H 1 4.65 0.01 . 1 . . . . 72 ASP HA . 16307 1 866 . 1 1 71 71 ASP HB2 H 1 2.65 0.01 . 2 . . . . 72 ASP HB2 . 16307 1 867 . 1 1 71 71 ASP HB3 H 1 2.78 0.01 . 2 . . . . 72 ASP HB3 . 16307 1 868 . 1 1 71 71 ASP C C 13 178.8 0.3 . 1 . . . . 72 ASP C . 16307 1 869 . 1 1 71 71 ASP CA C 13 58.1 0.3 . 1 . . . . 72 ASP CA . 16307 1 870 . 1 1 71 71 ASP CB C 13 41.5 0.3 . 1 . . . . 72 ASP CB . 16307 1 871 . 1 1 71 71 ASP N N 15 119.5 0.1 . 1 . . . . 72 ASP N . 16307 1 872 . 1 1 72 72 LEU H H 1 7.89 0.01 . 1 . . . . 73 LEU H . 16307 1 873 . 1 1 72 72 LEU HA H 1 4.08 0.01 . 1 . . . . 73 LEU HA . 16307 1 874 . 1 1 72 72 LEU HB2 H 1 2.47 0.01 . 2 . . . . 73 LEU HB2 . 16307 1 875 . 1 1 72 72 LEU HB3 H 1 0.86 0.01 . 2 . . . . 73 LEU HB3 . 16307 1 876 . 1 1 72 72 LEU HD11 H 1 0.68 0.01 . 1 . . . . 73 LEU HD1 . 16307 1 877 . 1 1 72 72 LEU HD12 H 1 0.68 0.01 . 1 . . . . 73 LEU HD1 . 16307 1 878 . 1 1 72 72 LEU HD13 H 1 0.68 0.01 . 1 . . . . 73 LEU HD1 . 16307 1 879 . 1 1 72 72 LEU HD21 H 1 0.25 0.01 . 1 . . . . 73 LEU HD2 . 16307 1 880 . 1 1 72 72 LEU HD22 H 1 0.25 0.01 . 1 . . . . 73 LEU HD2 . 16307 1 881 . 1 1 72 72 LEU HD23 H 1 0.25 0.01 . 1 . . . . 73 LEU HD2 . 16307 1 882 . 1 1 72 72 LEU HG H 1 1.84 0.01 . 1 . . . . 73 LEU HG . 16307 1 883 . 1 1 72 72 LEU C C 13 180.5 0.3 . 1 . . . . 73 LEU C . 16307 1 884 . 1 1 72 72 LEU CA C 13 56.9 0.3 . 1 . . . . 73 LEU CA . 16307 1 885 . 1 1 72 72 LEU CB C 13 42.8 0.3 . 1 . . . . 73 LEU CB . 16307 1 886 . 1 1 72 72 LEU CD1 C 13 26.8 0.3 . 1 . . . . 73 LEU CD1 . 16307 1 887 . 1 1 72 72 LEU CD2 C 13 22.8 0.3 . 1 . . . . 73 LEU CD2 . 16307 1 888 . 1 1 72 72 LEU CG C 13 26.1 0.3 . 1 . . . . 73 LEU CG . 16307 1 889 . 1 1 72 72 LEU N N 15 118.3 0.1 . 1 . . . . 73 LEU N . 16307 1 890 . 1 1 73 73 VAL H H 1 8.52 0.01 . 1 . . . . 74 VAL H . 16307 1 891 . 1 1 73 73 VAL HA H 1 3.99 0.01 . 1 . . . . 74 VAL HA . 16307 1 892 . 1 1 73 73 VAL HB H 1 2.83 0.01 . 1 . . . . 74 VAL HB . 16307 1 893 . 1 1 73 73 VAL HG11 H 1 1.41 0.01 . 1 . . . . 74 VAL HG1 . 16307 1 894 . 1 1 73 73 VAL HG12 H 1 1.41 0.01 . 1 . . . . 74 VAL HG1 . 16307 1 895 . 1 1 73 73 VAL HG13 H 1 1.41 0.01 . 1 . . . . 74 VAL HG1 . 16307 1 896 . 1 1 73 73 VAL HG21 H 1 1.91 0.01 . 1 . . . . 74 VAL HG2 . 16307 1 897 . 1 1 73 73 VAL HG22 H 1 1.91 0.01 . 1 . . . . 74 VAL HG2 . 16307 1 898 . 1 1 73 73 VAL HG23 H 1 1.91 0.01 . 1 . . . . 74 VAL HG2 . 16307 1 899 . 1 1 73 73 VAL C C 13 178.6 0.3 . 1 . . . . 74 VAL C . 16307 1 900 . 1 1 73 73 VAL CA C 13 66.8 0.3 . 1 . . . . 74 VAL CA . 16307 1 901 . 1 1 73 73 VAL CB C 13 33.2 0.3 . 1 . . . . 74 VAL CB . 16307 1 902 . 1 1 73 73 VAL CG1 C 13 21.7 0.3 . 1 . . . . 74 VAL CG1 . 16307 1 903 . 1 1 73 73 VAL CG2 C 13 24.0 0.3 . 1 . . . . 74 VAL CG2 . 16307 1 904 . 1 1 73 73 VAL N N 15 121.2 0.1 . 1 . . . . 74 VAL N . 16307 1 905 . 1 1 74 74 GLU H H 1 8.76 0.01 . 1 . . . . 75 GLU H . 16307 1 906 . 1 1 74 74 GLU HA H 1 4.23 0.01 . 1 . . . . 75 GLU HA . 16307 1 907 . 1 1 74 74 GLU HB2 H 1 2.23 0.01 . 2 . . . . 75 GLU HB2 . 16307 1 908 . 1 1 74 74 GLU HB3 H 1 2.13 0.01 . 2 . . . . 75 GLU HB3 . 16307 1 909 . 1 1 74 74 GLU HG2 H 1 2.68 0.01 . 2 . . . . 75 GLU HG2 . 16307 1 910 . 1 1 74 74 GLU HG3 H 1 2.48 0.01 . 2 . . . . 75 GLU HG3 . 16307 1 911 . 1 1 74 74 GLU C C 13 178.6 0.3 . 1 . . . . 75 GLU C . 16307 1 912 . 1 1 74 74 GLU CA C 13 59.9 0.3 . 1 . . . . 75 GLU CA . 16307 1 913 . 1 1 74 74 GLU CB C 13 30.8 0.3 . 1 . . . . 75 GLU CB . 16307 1 914 . 1 1 74 74 GLU CG C 13 36.8 0.3 . 1 . . . . 75 GLU CG . 16307 1 915 . 1 1 74 74 GLU N N 15 117.5 0.1 . 1 . . . . 75 GLU N . 16307 1 916 . 1 1 75 75 ASN H H 1 8.62 0.01 . 1 . . . . 76 ASN H . 16307 1 917 . 1 1 75 75 ASN HA H 1 5.12 0.01 . 1 . . . . 76 ASN HA . 16307 1 918 . 1 1 75 75 ASN HB2 H 1 2.81 0.01 . 2 . . . . 76 ASN HB2 . 16307 1 919 . 1 1 75 75 ASN HB3 H 1 2.75 0.01 . 2 . . . . 76 ASN HB3 . 16307 1 920 . 1 1 75 75 ASN HD21 H 1 7.94 0.01 . 2 . . . . 76 ASN HD21 . 16307 1 921 . 1 1 75 75 ASN HD22 H 1 7.14 0.01 . 2 . . . . 76 ASN HD22 . 16307 1 922 . 1 1 75 75 ASN C C 13 175.9 0.3 . 1 . . . . 76 ASN C . 16307 1 923 . 1 1 75 75 ASN CA C 13 54.2 0.3 . 1 . . . . 76 ASN CA . 16307 1 924 . 1 1 75 75 ASN CB C 13 40.9 0.3 . 1 . . . . 76 ASN CB . 16307 1 925 . 1 1 75 75 ASN N N 15 112.0 0.1 . 1 . . . . 76 ASN N . 16307 1 926 . 1 1 75 75 ASN ND2 N 15 116.4 0.1 . 1 . . . . 76 ASN ND2 . 16307 1 927 . 1 1 76 76 ALA H H 1 7.48 0.01 . 1 . . . . 77 ALA H . 16307 1 928 . 1 1 76 76 ALA HA H 1 4.73 0.01 . 1 . . . . 77 ALA HA . 16307 1 929 . 1 1 76 76 ALA HB1 H 1 1.34 0.01 . 1 . . . . 77 ALA HB . 16307 1 930 . 1 1 76 76 ALA HB2 H 1 1.34 0.01 . 1 . . . . 77 ALA HB . 16307 1 931 . 1 1 76 76 ALA HB3 H 1 1.34 0.01 . 1 . . . . 77 ALA HB . 16307 1 932 . 1 1 76 76 ALA C C 13 177.5 0.3 . 1 . . . . 77 ALA C . 16307 1 933 . 1 1 76 76 ALA CA C 13 51.1 0.3 . 1 . . . . 77 ALA CA . 16307 1 934 . 1 1 76 76 ALA CB C 13 20.6 0.3 . 1 . . . . 77 ALA CB . 16307 1 935 . 1 1 76 76 ALA N N 15 121.4 0.1 . 1 . . . . 77 ALA N . 16307 1 936 . 1 1 77 77 GLY H H 1 7.75 0.01 . 1 . . . . 78 GLY H . 16307 1 937 . 1 1 77 77 GLY HA2 H 1 3.89 0.01 . 2 . . . . 78 GLY HA2 . 16307 1 938 . 1 1 77 77 GLY HA3 H 1 3.78 0.01 . 2 . . . . 78 GLY HA3 . 16307 1 939 . 1 1 77 77 GLY C C 13 174.5 0.3 . 1 . . . . 78 GLY C . 16307 1 940 . 1 1 77 77 GLY CA C 13 47.0 0.3 . 1 . . . . 78 GLY CA . 16307 1 941 . 1 1 77 77 GLY N N 15 107.1 0.1 . 1 . . . . 78 GLY N . 16307 1 942 . 1 1 78 78 LEU H H 1 7.35 0.01 . 1 . . . . 79 LEU H . 16307 1 943 . 1 1 78 78 LEU HA H 1 3.95 0.01 . 1 . . . . 79 LEU HA . 16307 1 944 . 1 1 78 78 LEU HB2 H 1 0.28 0.01 . 1 . . . . 79 LEU HB2 . 16307 1 945 . 1 1 78 78 LEU HB3 H 1 1.36 0.01 . 1 . . . . 79 LEU HB3 . 16307 1 946 . 1 1 78 78 LEU HD11 H 1 1.28 0.01 . 1 . . . . 79 LEU HD1 . 16307 1 947 . 1 1 78 78 LEU HD12 H 1 1.28 0.01 . 1 . . . . 79 LEU HD1 . 16307 1 948 . 1 1 78 78 LEU HD13 H 1 1.28 0.01 . 1 . . . . 79 LEU HD1 . 16307 1 949 . 1 1 78 78 LEU HD21 H 1 0.29 0.01 . 1 . . . . 79 LEU HD2 . 16307 1 950 . 1 1 78 78 LEU HD22 H 1 0.29 0.01 . 1 . . . . 79 LEU HD2 . 16307 1 951 . 1 1 78 78 LEU HD23 H 1 0.29 0.01 . 1 . . . . 79 LEU HD2 . 16307 1 952 . 1 1 78 78 LEU HG H 1 0.8 0.01 . 1 . . . . 79 LEU HG . 16307 1 953 . 1 1 78 78 LEU C C 13 176.8 0.3 . 1 . . . . 79 LEU C . 16307 1 954 . 1 1 78 78 LEU CA C 13 56.2 0.3 . 1 . . . . 79 LEU CA . 16307 1 955 . 1 1 78 78 LEU CB C 13 41.4 0.3 . 1 . . . . 79 LEU CB . 16307 1 956 . 1 1 78 78 LEU CD1 C 13 25.0 0.3 . 1 . . . . 79 LEU CD1 . 16307 1 957 . 1 1 78 78 LEU CD2 C 13 25.5 0.3 . 1 . . . . 79 LEU CD2 . 16307 1 958 . 1 1 78 78 LEU CG C 13 26.4 0.3 . 1 . . . . 79 LEU CG . 16307 1 959 . 1 1 78 78 LEU N N 15 120.5 0.1 . 1 . . . . 79 LEU N . 16307 1 960 . 1 1 79 79 THR H H 1 10.86 0.01 . 1 . . . . 80 THR H . 16307 1 961 . 1 1 79 79 THR HA H 1 4.73 0.01 . 1 . . . . 80 THR HA . 16307 1 962 . 1 1 79 79 THR HB H 1 4.27 0.01 . 1 . . . . 80 THR HB . 16307 1 963 . 1 1 79 79 THR HG21 H 1 1.29 0.01 . 1 . . . . 80 THR HG2 . 16307 1 964 . 1 1 79 79 THR HG22 H 1 1.29 0.01 . 1 . . . . 80 THR HG2 . 16307 1 965 . 1 1 79 79 THR HG23 H 1 1.29 0.01 . 1 . . . . 80 THR HG2 . 16307 1 966 . 1 1 79 79 THR C C 13 174.8 0.3 . 1 . . . . 80 THR C . 16307 1 967 . 1 1 79 79 THR CA C 13 60.6 0.3 . 1 . . . . 80 THR CA . 16307 1 968 . 1 1 79 79 THR CB C 13 70.3 0.3 . 1 . . . . 80 THR CB . 16307 1 969 . 1 1 79 79 THR CG2 C 13 20.4 0.3 . 1 . . . . 80 THR CG2 . 16307 1 970 . 1 1 79 79 THR N N 15 126.5 0.1 . 1 . . . . 80 THR N . 16307 1 971 . 1 1 80 80 ASP H H 1 8.82 0.01 . 1 . . . . 81 ASP H . 16307 1 972 . 1 1 80 80 ASP HA H 1 3.83 0.01 . 1 . . . . 81 ASP HA . 16307 1 973 . 1 1 80 80 ASP HB2 H 1 2.46 0.01 . 2 . . . . 81 ASP HB2 . 16307 1 974 . 1 1 80 80 ASP HB3 H 1 2.32 0.01 . 2 . . . . 81 ASP HB3 . 16307 1 975 . 1 1 80 80 ASP C C 13 177.3 0.3 . 1 . . . . 81 ASP C . 16307 1 976 . 1 1 80 80 ASP CA C 13 58.7 0.3 . 1 . . . . 81 ASP CA . 16307 1 977 . 1 1 80 80 ASP CB C 13 41.4 0.3 . 1 . . . . 81 ASP CB . 16307 1 978 . 1 1 80 80 ASP N N 15 120.9 0.1 . 1 . . . . 81 ASP N . 16307 1 979 . 1 1 81 81 VAL H H 1 7.7 0.01 . 1 . . . . 82 VAL H . 16307 1 980 . 1 1 81 81 VAL HA H 1 3.72 0.01 . 1 . . . . 82 VAL HA . 16307 1 981 . 1 1 81 81 VAL HB H 1 1.63 0.01 . 1 . . . . 82 VAL HB . 16307 1 982 . 1 1 81 81 VAL HG11 H 1 0.3 0.01 . 1 . . . . 82 VAL HG1 . 16307 1 983 . 1 1 81 81 VAL HG12 H 1 0.3 0.01 . 1 . . . . 82 VAL HG1 . 16307 1 984 . 1 1 81 81 VAL HG13 H 1 0.3 0.01 . 1 . . . . 82 VAL HG1 . 16307 1 985 . 1 1 81 81 VAL HG21 H 1 0.53 0.01 . 1 . . . . 82 VAL HG2 . 16307 1 986 . 1 1 81 81 VAL HG22 H 1 0.53 0.01 . 1 . . . . 82 VAL HG2 . 16307 1 987 . 1 1 81 81 VAL HG23 H 1 0.53 0.01 . 1 . . . . 82 VAL HG2 . 16307 1 988 . 1 1 81 81 VAL C C 13 176.8 0.3 . 1 . . . . 82 VAL C . 16307 1 989 . 1 1 81 81 VAL CA C 13 64.4 0.3 . 1 . . . . 82 VAL CA . 16307 1 990 . 1 1 81 81 VAL CB C 13 30.7 0.3 . 1 . . . . 82 VAL CB . 16307 1 991 . 1 1 81 81 VAL CG1 C 13 19.2 0.3 . 1 . . . . 82 VAL CG1 . 16307 1 992 . 1 1 81 81 VAL CG2 C 13 20.4 0.3 . 1 . . . . 82 VAL CG2 . 16307 1 993 . 1 1 81 81 VAL N N 15 114.5 0.1 . 1 . . . . 82 VAL N . 16307 1 994 . 1 1 82 82 HIS H H 1 6.6 0.01 . 1 . . . . 83 HIS H . 16307 1 995 . 1 1 82 82 HIS HA H 1 3.43 0.01 . 1 . . . . 83 HIS HA . 16307 1 996 . 1 1 82 82 HIS HB2 H 1 2.36 0.01 . 2 . . . . 83 HIS HB2 . 16307 1 997 . 1 1 82 82 HIS HB3 H 1 1.84 0.01 . 2 . . . . 83 HIS HB3 . 16307 1 998 . 1 1 82 82 HIS HD2 H 1 6.95 0.01 . 1 . . . . 83 HIS HD2 . 16307 1 999 . 1 1 82 82 HIS HE1 H 1 7.67 0.01 . 1 . . . . 83 HIS HE1 . 16307 1 1000 . 1 1 82 82 HIS HE2 H 1 11.25 0.01 . 1 . . . . 83 HIS HE2 . 16307 1 1001 . 1 1 82 82 HIS C C 13 176.5 0.3 . 1 . . . . 83 HIS C . 16307 1 1002 . 1 1 82 82 HIS CA C 13 59.8 0.3 . 1 . . . . 83 HIS CA . 16307 1 1003 . 1 1 82 82 HIS CB C 13 32.0 0.3 . 1 . . . . 83 HIS CB . 16307 1 1004 . 1 1 82 82 HIS CD2 C 13 115.9 0.3 . 1 . . . . 83 HIS CD2 . 16307 1 1005 . 1 1 82 82 HIS CE1 C 13 139 0.3 . 1 . . . . 83 HIS CE1 . 16307 1 1006 . 1 1 82 82 HIS N N 15 121.0 0.1 . 1 . . . . 83 HIS N . 16307 1 1007 . 1 1 82 82 HIS NE2 N 15 167.1 0.1 . 1 . . . . 83 HIS NE2 . 16307 1 1008 . 1 1 83 83 PHE H H 1 6.69 0.01 . 1 . . . . 84 PHE H . 16307 1 1009 . 1 1 83 83 PHE HA H 1 2.39 0.01 . 1 . . . . 84 PHE HA . 16307 1 1010 . 1 1 83 83 PHE HB2 H 1 1.84 0.01 . 1 . . . . 84 PHE HB2 . 16307 1 1011 . 1 1 83 83 PHE HB3 H 1 3.1 0.01 . 1 . . . . 84 PHE HB3 . 16307 1 1012 . 1 1 83 83 PHE HD1 H 1 6.52 0.01 . 3 . . . . 84 PHE HD1 . 16307 1 1013 . 1 1 83 83 PHE HD2 H 1 6.52 0.01 . 3 . . . . 84 PHE HD2 . 16307 1 1014 . 1 1 83 83 PHE HE1 H 1 7.06 0.01 . 3 . . . . 84 PHE HE1 . 16307 1 1015 . 1 1 83 83 PHE HE2 H 1 7.06 0.01 . 3 . . . . 84 PHE HE2 . 16307 1 1016 . 1 1 83 83 PHE HZ H 1 6.94 0.01 . 1 . . . . 84 PHE HZ . 16307 1 1017 . 1 1 83 83 PHE C C 13 177.0 0.3 . 1 . . . . 84 PHE C . 16307 1 1018 . 1 1 83 83 PHE CA C 13 60.1 0.3 . 1 . . . . 84 PHE CA . 16307 1 1019 . 1 1 83 83 PHE CB C 13 39.6 0.3 . 1 . . . . 84 PHE CB . 16307 1 1020 . 1 1 83 83 PHE CD1 C 13 131.0 0.3 . 3 . . . . 84 PHE CD1 . 16307 1 1021 . 1 1 83 83 PHE CD2 C 13 131.0 0.3 . 3 . . . . 84 PHE CD2 . 16307 1 1022 . 1 1 83 83 PHE CE1 C 13 130.8 0.3 . 3 . . . . 84 PHE CE1 . 16307 1 1023 . 1 1 83 83 PHE CE2 C 13 130.8 0.3 . 3 . . . . 84 PHE CE2 . 16307 1 1024 . 1 1 83 83 PHE CZ C 13 129.4 0.3 . 1 . . . . 84 PHE CZ . 16307 1 1025 . 1 1 83 83 PHE N N 15 120.2 0.1 . 1 . . . . 84 PHE N . 16307 1 1026 . 1 1 84 84 ASP H H 1 8.5 0.01 . 1 . . . . 85 ASP H . 16307 1 1027 . 1 1 84 84 ASP HA H 1 4.07 0.01 . 1 . . . . 85 ASP HA . 16307 1 1028 . 1 1 84 84 ASP HB2 H 1 2.47 0.01 . 2 . . . . 85 ASP HB2 . 16307 1 1029 . 1 1 84 84 ASP HB3 H 1 2.47 0.01 . 2 . . . . 85 ASP HB3 . 16307 1 1030 . 1 1 84 84 ASP C C 13 178.2 0.3 . 1 . . . . 85 ASP C . 16307 1 1031 . 1 1 84 84 ASP CA C 13 57.4 0.3 . 1 . . . . 85 ASP CA . 16307 1 1032 . 1 1 84 84 ASP CB C 13 39.6 0.3 . 1 . . . . 85 ASP CB . 16307 1 1033 . 1 1 84 84 ASP N N 15 117.3 0.1 . 1 . . . . 85 ASP N . 16307 1 1034 . 1 1 85 85 ALA H H 1 7.4 0.01 . 1 . . . . 86 ALA H . 16307 1 1035 . 1 1 85 85 ALA HA H 1 3.79 0.01 . 1 . . . . 86 ALA HA . 16307 1 1036 . 1 1 85 85 ALA HB1 H 1 1.06 0.01 . 1 . . . . 86 ALA HB . 16307 1 1037 . 1 1 85 85 ALA HB2 H 1 1.06 0.01 . 1 . . . . 86 ALA HB . 16307 1 1038 . 1 1 85 85 ALA HB3 H 1 1.06 0.01 . 1 . . . . 86 ALA HB . 16307 1 1039 . 1 1 85 85 ALA C C 13 179.6 0.3 . 1 . . . . 86 ALA C . 16307 1 1040 . 1 1 85 85 ALA CA C 13 55.4 0.3 . 1 . . . . 86 ALA CA . 16307 1 1041 . 1 1 85 85 ALA CB C 13 17.9 0.3 . 1 . . . . 86 ALA CB . 16307 1 1042 . 1 1 85 85 ALA N N 15 121.3 0.1 . 1 . . . . 86 ALA N . 16307 1 1043 . 1 1 86 86 ILE H H 1 6.97 0.01 . 1 . . . . 87 ILE H . 16307 1 1044 . 1 1 86 86 ILE HA H 1 3.16 0.01 . 1 . . . . 87 ILE HA . 16307 1 1045 . 1 1 86 86 ILE HB H 1 0.22 0.01 . 1 . . . . 87 ILE HB . 16307 1 1046 . 1 1 86 86 ILE HD11 H 1 0.97 0.01 . 1 . . . . 87 ILE HD1 . 16307 1 1047 . 1 1 86 86 ILE HD12 H 1 0.97 0.01 . 1 . . . . 87 ILE HD1 . 16307 1 1048 . 1 1 86 86 ILE HD13 H 1 0.97 0.01 . 1 . . . . 87 ILE HD1 . 16307 1 1049 . 1 1 86 86 ILE HG12 H 1 0.03 0.01 . 2 . . . . 87 ILE HG12 . 16307 1 1050 . 1 1 86 86 ILE HG13 H 1 0.01 0.01 . 2 . . . . 87 ILE HG13 . 16307 1 1051 . 1 1 86 86 ILE HG21 H 1 0.97 0.01 . 1 . . . . 87 ILE HG2 . 16307 1 1052 . 1 1 86 86 ILE HG22 H 1 0.97 0.01 . 1 . . . . 87 ILE HG2 . 16307 1 1053 . 1 1 86 86 ILE HG23 H 1 0.97 0.01 . 1 . . . . 87 ILE HG2 . 16307 1 1054 . 1 1 86 86 ILE C C 13 176.6 0.3 . 1 . . . . 87 ILE C . 16307 1 1055 . 1 1 86 86 ILE CA C 13 65.7 0.3 . 1 . . . . 87 ILE CA . 16307 1 1056 . 1 1 86 86 ILE CB C 13 35.7 0.3 . 1 . . . . 87 ILE CB . 16307 1 1057 . 1 1 86 86 ILE CD1 C 13 10.9 0.3 . 1 . . . . 87 ILE CD1 . 16307 1 1058 . 1 1 86 86 ILE CG1 C 13 28.3 0.3 . 1 . . . . 87 ILE CG1 . 16307 1 1059 . 1 1 86 86 ILE CG2 C 13 15.7 0.3 . 1 . . . . 87 ILE CG2 . 16307 1 1060 . 1 1 86 86 ILE N N 15 117.1 0.1 . 1 . . . . 87 ILE N . 16307 1 1061 . 1 1 87 87 ALA H H 1 7.43 0.01 . 1 . . . . 88 ALA H . 16307 1 1062 . 1 1 87 87 ALA HA H 1 3.6 0.01 . 1 . . . . 88 ALA HA . 16307 1 1063 . 1 1 87 87 ALA HB1 H 1 1.26 0.01 . 1 . . . . 88 ALA HB . 16307 1 1064 . 1 1 87 87 ALA HB2 H 1 1.26 0.01 . 1 . . . . 88 ALA HB . 16307 1 1065 . 1 1 87 87 ALA HB3 H 1 1.26 0.01 . 1 . . . . 88 ALA HB . 16307 1 1066 . 1 1 87 87 ALA C C 13 178.6 0.3 . 1 . . . . 88 ALA C . 16307 1 1067 . 1 1 87 87 ALA CA C 13 56.0 0.3 . 1 . . . . 88 ALA CA . 16307 1 1068 . 1 1 87 87 ALA CB C 13 18.1 0.3 . 1 . . . . 88 ALA CB . 16307 1 1069 . 1 1 87 87 ALA N N 15 122.1 0.1 . 1 . . . . 88 ALA N . 16307 1 1070 . 1 1 88 88 GLU H H 1 8.46 0.01 . 1 . . . . 89 GLU H . 16307 1 1071 . 1 1 88 88 GLU HA H 1 3.75 0.01 . 1 . . . . 89 GLU HA . 16307 1 1072 . 1 1 88 88 GLU HB2 H 1 1.98 0.01 . 2 . . . . 89 GLU HB2 . 16307 1 1073 . 1 1 88 88 GLU HG2 H 1 2.24 0.01 . 2 . . . . 89 GLU HG2 . 16307 1 1074 . 1 1 88 88 GLU HG3 H 1 1.98 0.01 . 2 . . . . 89 GLU HG3 . 16307 1 1075 . 1 1 88 88 GLU C C 13 178.8 0.3 . 1 . . . . 89 GLU C . 16307 1 1076 . 1 1 88 88 GLU CA C 13 59.3 0.3 . 1 . . . . 89 GLU CA . 16307 1 1077 . 1 1 88 88 GLU CB C 13 30.0 0.3 . 1 . . . . 89 GLU CB . 16307 1 1078 . 1 1 88 88 GLU CG C 13 36.3 0.3 . 1 . . . . 89 GLU CG . 16307 1 1079 . 1 1 88 88 GLU N N 15 119.1 0.1 . 1 . . . . 89 GLU N . 16307 1 1080 . 1 1 89 89 ASN H H 1 7.65 0.01 . 1 . . . . 90 ASN H . 16307 1 1081 . 1 1 89 89 ASN HA H 1 4.5 0.01 . 1 . . . . 90 ASN HA . 16307 1 1082 . 1 1 89 89 ASN HB2 H 1 2.81 0.01 . 2 . . . . 90 ASN HB2 . 16307 1 1083 . 1 1 89 89 ASN HB3 H 1 2.49 0.01 . 2 . . . . 90 ASN HB3 . 16307 1 1084 . 1 1 89 89 ASN HD21 H 1 5.65 0.01 . 2 . . . . 90 ASN HD21 . 16307 1 1085 . 1 1 89 89 ASN HD22 H 1 9.06 0.01 . 2 . . . . 90 ASN HD22 . 16307 1 1086 . 1 1 89 89 ASN C C 13 178.0 0.3 . 1 . . . . 90 ASN C . 16307 1 1087 . 1 1 89 89 ASN CA C 13 56.8 0.3 . 1 . . . . 90 ASN CA . 16307 1 1088 . 1 1 89 89 ASN CB C 13 39.5 0.3 . 1 . . . . 90 ASN CB . 16307 1 1089 . 1 1 89 89 ASN N N 15 115.4 0.1 . 1 . . . . 90 ASN N . 16307 1 1090 . 1 1 89 89 ASN ND2 N 15 114.6 0.1 . 1 . . . . 90 ASN ND2 . 16307 1 1091 . 1 1 90 90 LEU H H 1 7.92 0.01 . 1 . . . . 91 LEU H . 16307 1 1092 . 1 1 90 90 LEU HA H 1 3.4 0.01 . 1 . . . . 91 LEU HA . 16307 1 1093 . 1 1 90 90 LEU HB2 H 1 0.78 0.01 . 2 . . . . 91 LEU HB2 . 16307 1 1094 . 1 1 90 90 LEU HB3 H 1 1.93 0.01 . 2 . . . . 91 LEU HB3 . 16307 1 1095 . 1 1 90 90 LEU HD11 H 1 0.44 0.01 . 1 . . . . 91 LEU HD1 . 16307 1 1096 . 1 1 90 90 LEU HD12 H 1 0.44 0.01 . 1 . . . . 91 LEU HD1 . 16307 1 1097 . 1 1 90 90 LEU HD13 H 1 0.44 0.01 . 1 . . . . 91 LEU HD1 . 16307 1 1098 . 1 1 90 90 LEU HD21 H 1 0.69 0.01 . 1 . . . . 91 LEU HD2 . 16307 1 1099 . 1 1 90 90 LEU HD22 H 1 0.69 0.01 . 1 . . . . 91 LEU HD2 . 16307 1 1100 . 1 1 90 90 LEU HD23 H 1 0.69 0.01 . 1 . . . . 91 LEU HD2 . 16307 1 1101 . 1 1 90 90 LEU HG H 1 1.17 0.01 . 1 . . . . 91 LEU HG . 16307 1 1102 . 1 1 90 90 LEU C C 13 177.1 0.3 . 1 . . . . 91 LEU C . 16307 1 1103 . 1 1 90 90 LEU CA C 13 58.0 0.3 . 1 . . . . 91 LEU CA . 16307 1 1104 . 1 1 90 90 LEU CB C 13 39.1 0.3 . 1 . . . . 91 LEU CB . 16307 1 1105 . 1 1 90 90 LEU CD1 C 13 22.9 0.3 . 1 . . . . 91 LEU CD1 . 16307 1 1106 . 1 1 90 90 LEU CD2 C 13 27.5 0.3 . 1 . . . . 91 LEU CD2 . 16307 1 1107 . 1 1 90 90 LEU CG C 13 27.2 0.3 . 1 . . . . 91 LEU CG . 16307 1 1108 . 1 1 90 90 LEU N N 15 125.1 0.1 . 1 . . . . 91 LEU N . 16307 1 1109 . 1 1 91 91 VAL H H 1 8.15 0.01 . 1 . . . . 92 VAL H . 16307 1 1110 . 1 1 91 91 VAL HA H 1 3.17 0.01 . 1 . . . . 92 VAL HA . 16307 1 1111 . 1 1 91 91 VAL HB H 1 2.04 0.01 . 1 . . . . 92 VAL HB . 16307 1 1112 . 1 1 91 91 VAL HG11 H 1 0.76 0.01 . 1 . . . . 92 VAL HG1 . 16307 1 1113 . 1 1 91 91 VAL HG12 H 1 0.76 0.01 . 1 . . . . 92 VAL HG1 . 16307 1 1114 . 1 1 91 91 VAL HG13 H 1 0.76 0.01 . 1 . . . . 92 VAL HG1 . 16307 1 1115 . 1 1 91 91 VAL HG21 H 1 0.79 0.01 . 1 . . . . 92 VAL HG2 . 16307 1 1116 . 1 1 91 91 VAL HG22 H 1 0.79 0.01 . 1 . . . . 92 VAL HG2 . 16307 1 1117 . 1 1 91 91 VAL HG23 H 1 0.79 0.01 . 1 . . . . 92 VAL HG2 . 16307 1 1118 . 1 1 91 91 VAL C C 13 177.9 0.3 . 1 . . . . 92 VAL C . 16307 1 1119 . 1 1 91 91 VAL CA C 13 68.9 0.3 . 1 . . . . 92 VAL CA . 16307 1 1120 . 1 1 91 91 VAL CB C 13 31.4 0.3 . 1 . . . . 92 VAL CB . 16307 1 1121 . 1 1 91 91 VAL CG1 C 13 21.1 0.3 . 1 . . . . 92 VAL CG1 . 16307 1 1122 . 1 1 91 91 VAL CG2 C 13 23.1 0.3 . 1 . . . . 92 VAL CG2 . 16307 1 1123 . 1 1 91 91 VAL N N 15 121.8 0.1 . 1 . . . . 92 VAL N . 16307 1 1124 . 1 1 92 92 LEU H H 1 8.53 0.01 . 1 . . . . 93 LEU H . 16307 1 1125 . 1 1 92 92 LEU HA H 1 4.14 0.01 . 1 . . . . 93 LEU HA . 16307 1 1126 . 1 1 92 92 LEU HB2 H 1 1.75 0.01 . 1 . . . . 93 LEU HB2 . 16307 1 1127 . 1 1 92 92 LEU HB3 H 1 1.49 0.01 . 1 . . . . 93 LEU HB3 . 16307 1 1128 . 1 1 92 92 LEU HD11 H 1 0.89 0.01 . 2 . . . . 93 LEU HD1 . 16307 1 1129 . 1 1 92 92 LEU HD12 H 1 0.89 0.01 . 2 . . . . 93 LEU HD1 . 16307 1 1130 . 1 1 92 92 LEU HD13 H 1 0.89 0.01 . 2 . . . . 93 LEU HD1 . 16307 1 1131 . 1 1 92 92 LEU HD21 H 1 0.89 0.01 . 2 . . . . 93 LEU HD2 . 16307 1 1132 . 1 1 92 92 LEU HD22 H 1 0.89 0.01 . 2 . . . . 93 LEU HD2 . 16307 1 1133 . 1 1 92 92 LEU HD23 H 1 0.89 0.01 . 2 . . . . 93 LEU HD2 . 16307 1 1134 . 1 1 92 92 LEU HG H 1 1.75 0.01 . 1 . . . . 93 LEU HG . 16307 1 1135 . 1 1 92 92 LEU C C 13 179.8 0.3 . 1 . . . . 93 LEU C . 16307 1 1136 . 1 1 92 92 LEU CA C 13 58.0 0.3 . 1 . . . . 93 LEU CA . 16307 1 1137 . 1 1 92 92 LEU CB C 13 42.3 0.3 . 1 . . . . 93 LEU CB . 16307 1 1138 . 1 1 92 92 LEU CD1 C 13 23.1 0.3 . 2 . . . . 93 LEU CD1 . 16307 1 1139 . 1 1 92 92 LEU CD2 C 13 25.0 0.3 . 2 . . . . 93 LEU CD2 . 16307 1 1140 . 1 1 92 92 LEU CG C 13 26.9 0.3 . 1 . . . . 93 LEU CG . 16307 1 1141 . 1 1 92 92 LEU N N 15 117.7 0.1 . 1 . . . . 93 LEU N . 16307 1 1142 . 1 1 93 93 THR H H 1 7.5 0.01 . 1 . . . . 94 THR H . 16307 1 1143 . 1 1 93 93 THR HA H 1 3.6 0.01 . 1 . . . . 94 THR HA . 16307 1 1144 . 1 1 93 93 THR HB H 1 4.63 0.01 . 1 . . . . 94 THR HB . 16307 1 1145 . 1 1 93 93 THR HG21 H 1 1.31 0.01 . 1 . . . . 94 THR HG2 . 16307 1 1146 . 1 1 93 93 THR HG22 H 1 1.31 0.01 . 1 . . . . 94 THR HG2 . 16307 1 1147 . 1 1 93 93 THR HG23 H 1 1.31 0.01 . 1 . . . . 94 THR HG2 . 16307 1 1148 . 1 1 93 93 THR C C 13 175.3 0.3 . 1 . . . . 94 THR C . 16307 1 1149 . 1 1 93 93 THR CA C 13 68.7 0.3 . 1 . . . . 94 THR CA . 16307 1 1150 . 1 1 93 93 THR CB C 13 68.4 0.3 . 1 . . . . 94 THR CB . 16307 1 1151 . 1 1 93 93 THR CG2 C 13 21.5 0.3 . 1 . . . . 94 THR CG2 . 16307 1 1152 . 1 1 93 93 THR N N 15 116.3 0.1 . 1 . . . . 94 THR N . 16307 1 1153 . 1 1 94 94 LEU H H 1 8.03 0.01 . 1 . . . . 95 LEU H . 16307 1 1154 . 1 1 94 94 LEU HA H 1 3.92 0.01 . 1 . . . . 95 LEU HA . 16307 1 1155 . 1 1 94 94 LEU HB2 H 1 1.96 0.01 . 2 . . . . 95 LEU HB2 . 16307 1 1156 . 1 1 94 94 LEU HB3 H 1 1.23 0.01 . 2 . . . . 95 LEU HB3 . 16307 1 1157 . 1 1 94 94 LEU HD11 H 1 0.77 0.01 . 2 . . . . 95 LEU HD1 . 16307 1 1158 . 1 1 94 94 LEU HD12 H 1 0.77 0.01 . 2 . . . . 95 LEU HD1 . 16307 1 1159 . 1 1 94 94 LEU HD13 H 1 0.77 0.01 . 2 . . . . 95 LEU HD1 . 16307 1 1160 . 1 1 94 94 LEU HD21 H 1 0.93 0.01 . 2 . . . . 95 LEU HD2 . 16307 1 1161 . 1 1 94 94 LEU HD22 H 1 0.93 0.01 . 2 . . . . 95 LEU HD2 . 16307 1 1162 . 1 1 94 94 LEU HD23 H 1 0.93 0.01 . 2 . . . . 95 LEU HD2 . 16307 1 1163 . 1 1 94 94 LEU HG H 1 2.15 0.01 . 1 . . . . 95 LEU HG . 16307 1 1164 . 1 1 94 94 LEU C C 13 179.1 0.3 . 1 . . . . 95 LEU C . 16307 1 1165 . 1 1 94 94 LEU CA C 13 58.0 0.3 . 1 . . . . 95 LEU CA . 16307 1 1166 . 1 1 94 94 LEU CB C 13 40.6 0.3 . 1 . . . . 95 LEU CB . 16307 1 1167 . 1 1 94 94 LEU CD1 C 13 27.0 0.3 . 2 . . . . 95 LEU CD1 . 16307 1 1168 . 1 1 94 94 LEU CD2 C 13 21.3 0.3 . 2 . . . . 95 LEU CD2 . 16307 1 1169 . 1 1 94 94 LEU CG C 13 26.3 0.3 . 1 . . . . 95 LEU CG . 16307 1 1170 . 1 1 94 94 LEU N N 15 118.5 0.1 . 1 . . . . 95 LEU N . 16307 1 1171 . 1 1 95 95 GLN H H 1 8.57 0.01 . 1 . . . . 96 GLN H . 16307 1 1172 . 1 1 95 95 GLN HA H 1 4.13 0.01 . 1 . . . . 96 GLN HA . 16307 1 1173 . 1 1 95 95 GLN HB2 H 1 2.32 0.01 . 1 . . . . 96 GLN HB2 . 16307 1 1174 . 1 1 95 95 GLN HB3 H 1 2.01 0.01 . 1 . . . . 96 GLN HB3 . 16307 1 1175 . 1 1 95 95 GLN HE21 H 1 7.29 0.01 . 2 . . . . 96 GLN HE21 . 16307 1 1176 . 1 1 95 95 GLN HE22 H 1 6.62 0.01 . 2 . . . . 96 GLN HE22 . 16307 1 1177 . 1 1 95 95 GLN HG2 H 1 2.61 0.01 . 2 . . . . 96 GLN HG2 . 16307 1 1178 . 1 1 95 95 GLN HG3 H 1 2.34 0.01 . 2 . . . . 96 GLN HG3 . 16307 1 1179 . 1 1 95 95 GLN C C 13 181.1 0.3 . 1 . . . . 96 GLN C . 16307 1 1180 . 1 1 95 95 GLN CA C 13 59.3 0.3 . 1 . . . . 96 GLN CA . 16307 1 1181 . 1 1 95 95 GLN CB C 13 28.4 0.3 . 1 . . . . 96 GLN CB . 16307 1 1182 . 1 1 95 95 GLN CG C 13 34.5 0.3 . 1 . . . . 96 GLN CG . 16307 1 1183 . 1 1 95 95 GLN N N 15 118.5 0.1 . 1 . . . . 96 GLN N . 16307 1 1184 . 1 1 95 95 GLN NE2 N 15 110.0 0.1 . 1 . . . . 96 GLN NE2 . 16307 1 1185 . 1 1 96 96 GLU H H 1 8.34 0.01 . 1 . . . . 97 GLU H . 16307 1 1186 . 1 1 96 96 GLU HA H 1 4.08 0.01 . 1 . . . . 97 GLU HA . 16307 1 1187 . 1 1 96 96 GLU HB2 H 1 2.27 0.01 . 1 . . . . 97 GLU HB2 . 16307 1 1188 . 1 1 96 96 GLU HB3 H 1 2.07 0.01 . 1 . . . . 97 GLU HB3 . 16307 1 1189 . 1 1 96 96 GLU HG2 H 1 2.29 0.01 . 2 . . . . 97 GLU HG2 . 16307 1 1190 . 1 1 96 96 GLU HG3 H 1 2.67 0.01 . 2 . . . . 97 GLU HG3 . 16307 1 1191 . 1 1 96 96 GLU C C 13 178.4 0.3 . 1 . . . . 97 GLU C . 16307 1 1192 . 1 1 96 96 GLU CA C 13 59.3 0.3 . 1 . . . . 97 GLU CA . 16307 1 1193 . 1 1 96 96 GLU CB C 13 29.5 0.3 . 1 . . . . 97 GLU CB . 16307 1 1194 . 1 1 96 96 GLU CG C 13 36.9 0.3 . 1 . . . . 97 GLU CG . 16307 1 1195 . 1 1 96 96 GLU N N 15 121.5 0.1 . 1 . . . . 97 GLU N . 16307 1 1196 . 1 1 97 97 LEU H H 1 7.54 0.01 . 1 . . . . 98 LEU H . 16307 1 1197 . 1 1 97 97 LEU HA H 1 4.37 0.01 . 1 . . . . 98 LEU HA . 16307 1 1198 . 1 1 97 97 LEU HB2 H 1 1.84 0.01 . 2 . . . . 98 LEU HB2 . 16307 1 1199 . 1 1 97 97 LEU HB3 H 1 1.8 0.01 . 2 . . . . 98 LEU HB3 . 16307 1 1200 . 1 1 97 97 LEU HD11 H 1 0.9 0.01 . 1 . . . . 98 LEU HD1 . 16307 1 1201 . 1 1 97 97 LEU HD12 H 1 0.9 0.01 . 1 . . . . 98 LEU HD1 . 16307 1 1202 . 1 1 97 97 LEU HD13 H 1 0.9 0.01 . 1 . . . . 98 LEU HD1 . 16307 1 1203 . 1 1 97 97 LEU HD21 H 1 0.93 0.01 . 1 . . . . 98 LEU HD2 . 16307 1 1204 . 1 1 97 97 LEU HD22 H 1 0.93 0.01 . 1 . . . . 98 LEU HD2 . 16307 1 1205 . 1 1 97 97 LEU HD23 H 1 0.93 0.01 . 1 . . . . 98 LEU HD2 . 16307 1 1206 . 1 1 97 97 LEU HG H 1 1.85 0.01 . 1 . . . . 98 LEU HG . 16307 1 1207 . 1 1 97 97 LEU C C 13 176.1 0.3 . 1 . . . . 98 LEU C . 16307 1 1208 . 1 1 97 97 LEU CA C 13 54.9 0.3 . 1 . . . . 98 LEU CA . 16307 1 1209 . 1 1 97 97 LEU CB C 13 42.3 0.3 . 1 . . . . 98 LEU CB . 16307 1 1210 . 1 1 97 97 LEU CD1 C 13 25.6 0.3 . 1 . . . . 98 LEU CD1 . 16307 1 1211 . 1 1 97 97 LEU CD2 C 13 22.8 0.3 . 1 . . . . 98 LEU CD2 . 16307 1 1212 . 1 1 97 97 LEU CG C 13 26.8 0.3 . 1 . . . . 98 LEU CG . 16307 1 1213 . 1 1 97 97 LEU N N 15 118.0 0.1 . 1 . . . . 98 LEU N . 16307 1 1214 . 1 1 98 98 ASN H H 1 8.09 0.01 . 1 . . . . 99 ASN H . 16307 1 1215 . 1 1 98 98 ASN HA H 1 4.4 0.01 . 1 . . . . 99 ASN HA . 16307 1 1216 . 1 1 98 98 ASN HB2 H 1 3.09 0.01 . 2 . . . . 99 ASN HB2 . 16307 1 1217 . 1 1 98 98 ASN HB3 H 1 2.8 0.01 . 2 . . . . 99 ASN HB3 . 16307 1 1218 . 1 1 98 98 ASN HD21 H 1 7.51 0.01 . 2 . . . . 99 ASN HD21 . 16307 1 1219 . 1 1 98 98 ASN HD22 H 1 6.78 0.01 . 2 . . . . 99 ASN HD22 . 16307 1 1220 . 1 1 98 98 ASN C C 13 174.9 0.3 . 1 . . . . 99 ASN C . 16307 1 1221 . 1 1 98 98 ASN CA C 13 54.4 0.3 . 1 . . . . 99 ASN CA . 16307 1 1222 . 1 1 98 98 ASN CB C 13 37.1 0.3 . 1 . . . . 99 ASN CB . 16307 1 1223 . 1 1 98 98 ASN N N 15 115.6 0.1 . 1 . . . . 99 ASN N . 16307 1 1224 . 1 1 98 98 ASN ND2 N 15 112.4 0.1 . 1 . . . . 99 ASN ND2 . 16307 1 1225 . 1 1 99 99 VAL H H 1 7.61 0.01 . 1 . . . . 100 VAL H . 16307 1 1226 . 1 1 99 99 VAL HA H 1 3.88 0.01 . 1 . . . . 100 VAL HA . 16307 1 1227 . 1 1 99 99 VAL HB H 1 1.88 0.01 . 1 . . . . 100 VAL HB . 16307 1 1228 . 1 1 99 99 VAL HG11 H 1 1.12 0.01 . 1 . . . . 100 VAL HG1 . 16307 1 1229 . 1 1 99 99 VAL HG12 H 1 1.12 0.01 . 1 . . . . 100 VAL HG1 . 16307 1 1230 . 1 1 99 99 VAL HG13 H 1 1.12 0.01 . 1 . . . . 100 VAL HG1 . 16307 1 1231 . 1 1 99 99 VAL HG21 H 1 1.01 0.01 . 1 . . . . 100 VAL HG2 . 16307 1 1232 . 1 1 99 99 VAL HG22 H 1 1.01 0.01 . 1 . . . . 100 VAL HG2 . 16307 1 1233 . 1 1 99 99 VAL HG23 H 1 1.01 0.01 . 1 . . . . 100 VAL HG2 . 16307 1 1234 . 1 1 99 99 VAL C C 13 175.0 0.3 . 1 . . . . 100 VAL C . 16307 1 1235 . 1 1 99 99 VAL CA C 13 63.1 0.3 . 1 . . . . 100 VAL CA . 16307 1 1236 . 1 1 99 99 VAL CB C 13 31.9 0.3 . 1 . . . . 100 VAL CB . 16307 1 1237 . 1 1 99 99 VAL CG1 C 13 22.7 0.3 . 1 . . . . 100 VAL CG1 . 16307 1 1238 . 1 1 99 99 VAL CG2 C 13 22.7 0.3 . 1 . . . . 100 VAL CG2 . 16307 1 1239 . 1 1 99 99 VAL N N 15 117.8 0.1 . 1 . . . . 100 VAL N . 16307 1 1240 . 1 1 100 100 SER H H 1 8.38 0.01 . 1 . . . . 101 SER H . 16307 1 1241 . 1 1 100 100 SER HA H 1 4.18 0.01 . 1 . . . . 101 SER HA . 16307 1 1242 . 1 1 100 100 SER HB2 H 1 4.13 0.01 . 2 . . . . 101 SER HB2 . 16307 1 1243 . 1 1 100 100 SER HB3 H 1 3.91 0.01 . 2 . . . . 101 SER HB3 . 16307 1 1244 . 1 1 100 100 SER C C 13 176.1 0.3 . 1 . . . . 101 SER C . 16307 1 1245 . 1 1 100 100 SER CA C 13 59.3 0.3 . 1 . . . . 101 SER CA . 16307 1 1246 . 1 1 100 100 SER CB C 13 64.3 0.3 . 1 . . . . 101 SER CB . 16307 1 1247 . 1 1 100 100 SER N N 15 118.9 0.1 . 1 . . . . 101 SER N . 16307 1 1248 . 1 1 101 101 GLN H H 1 8.89 0.01 . 1 . . . . 102 GLN H . 16307 1 1249 . 1 1 101 101 GLN HA H 1 3.7 0.01 . 1 . . . . 102 GLN HA . 16307 1 1250 . 1 1 101 101 GLN HB2 H 1 2.25 0.01 . 2 . . . . 102 GLN HB2 . 16307 1 1251 . 1 1 101 101 GLN HB3 H 1 1.97 0.01 . 2 . . . . 102 GLN HB3 . 16307 1 1252 . 1 1 101 101 GLN HE21 H 1 7.94 0.01 . 2 . . . . 102 GLN HE21 . 16307 1 1253 . 1 1 101 101 GLN HE22 H 1 6.62 0.01 . 2 . . . . 102 GLN HE22 . 16307 1 1254 . 1 1 101 101 GLN HG2 H 1 2.44 0.01 . 2 . . . . 102 GLN HG2 . 16307 1 1255 . 1 1 101 101 GLN HG3 H 1 2.37 0.01 . 2 . . . . 102 GLN HG3 . 16307 1 1256 . 1 1 101 101 GLN C C 13 176.7 0.3 . 1 . . . . 102 GLN C . 16307 1 1257 . 1 1 101 101 GLN CA C 13 58.2 0.3 . 1 . . . . 102 GLN CA . 16307 1 1258 . 1 1 101 101 GLN CB C 13 28.4 0.3 . 1 . . . . 102 GLN CB . 16307 1 1259 . 1 1 101 101 GLN CG C 13 33.4 0.3 . 1 . . . . 102 GLN CG . 16307 1 1260 . 1 1 101 101 GLN N N 15 125.6 0.1 . 1 . . . . 102 GLN N . 16307 1 1261 . 1 1 101 101 GLN NE2 N 15 115.2 0.1 . 1 . . . . 102 GLN NE2 . 16307 1 1262 . 1 1 102 102 ASP H H 1 8.33 0.01 . 1 . . . . 103 ASP H . 16307 1 1263 . 1 1 102 102 ASP HA H 1 4.29 0.01 . 1 . . . . 103 ASP HA . 16307 1 1264 . 1 1 102 102 ASP HB2 H 1 2.69 0.01 . 2 . . . . 103 ASP HB2 . 16307 1 1265 . 1 1 102 102 ASP HB3 H 1 2.51 0.01 . 2 . . . . 103 ASP HB3 . 16307 1 1266 . 1 1 102 102 ASP C C 13 178.8 0.3 . 1 . . . . 103 ASP C . 16307 1 1267 . 1 1 102 102 ASP CA C 13 56.9 0.3 . 1 . . . . 103 ASP CA . 16307 1 1268 . 1 1 102 102 ASP CB C 13 39.6 0.3 . 1 . . . . 103 ASP CB . 16307 1 1269 . 1 1 102 102 ASP N N 15 115.9 0.1 . 1 . . . . 103 ASP N . 16307 1 1270 . 1 1 103 103 LEU H H 1 7.3 0.01 . 1 . . . . 104 LEU H . 16307 1 1271 . 1 1 103 103 LEU HA H 1 4.2 0.01 . 1 . . . . 104 LEU HA . 16307 1 1272 . 1 1 103 103 LEU HB2 H 1 1.94 0.01 . 2 . . . . 104 LEU HB2 . 16307 1 1273 . 1 1 103 103 LEU HB3 H 1 1.45 0.01 . 2 . . . . 104 LEU HB3 . 16307 1 1274 . 1 1 103 103 LEU HD11 H 1 0.91 0.01 . 2 . . . . 104 LEU HD1 . 16307 1 1275 . 1 1 103 103 LEU HD12 H 1 0.91 0.01 . 2 . . . . 104 LEU HD1 . 16307 1 1276 . 1 1 103 103 LEU HD13 H 1 0.91 0.01 . 2 . . . . 104 LEU HD1 . 16307 1 1277 . 1 1 103 103 LEU HD21 H 1 0.86 0.01 . 2 . . . . 104 LEU HD2 . 16307 1 1278 . 1 1 103 103 LEU HD22 H 1 0.86 0.01 . 2 . . . . 104 LEU HD2 . 16307 1 1279 . 1 1 103 103 LEU HD23 H 1 0.86 0.01 . 2 . . . . 104 LEU HD2 . 16307 1 1280 . 1 1 103 103 LEU HG H 1 1.61 0.01 . 1 . . . . 104 LEU HG . 16307 1 1281 . 1 1 103 103 LEU C C 13 178.8 0.3 . 1 . . . . 104 LEU C . 16307 1 1282 . 1 1 103 103 LEU CA C 13 57.4 0.3 . 1 . . . . 104 LEU CA . 16307 1 1283 . 1 1 103 103 LEU CB C 13 41.9 0.3 . 1 . . . . 104 LEU CB . 16307 1 1284 . 1 1 103 103 LEU CD1 C 13 25.6 0.3 . 2 . . . . 104 LEU CD1 . 16307 1 1285 . 1 1 103 103 LEU CD2 C 13 24.3 0.3 . 2 . . . . 104 LEU CD2 . 16307 1 1286 . 1 1 103 103 LEU CG C 13 27.5 0.3 . 1 . . . . 104 LEU CG . 16307 1 1287 . 1 1 103 103 LEU N N 15 120.7 0.1 . 1 . . . . 104 LEU N . 16307 1 1288 . 1 1 104 104 ILE H H 1 7.5 0.01 . 1 . . . . 105 ILE H . 16307 1 1289 . 1 1 104 104 ILE HA H 1 3.21 0.01 . 1 . . . . 105 ILE HA . 16307 1 1290 . 1 1 104 104 ILE HB H 1 1.85 0.01 . 1 . . . . 105 ILE HB . 16307 1 1291 . 1 1 104 104 ILE HD11 H 1 0.67 0.01 . 1 . . . . 105 ILE HD1 . 16307 1 1292 . 1 1 104 104 ILE HD12 H 1 0.67 0.01 . 1 . . . . 105 ILE HD1 . 16307 1 1293 . 1 1 104 104 ILE HD13 H 1 0.67 0.01 . 1 . . . . 105 ILE HD1 . 16307 1 1294 . 1 1 104 104 ILE HG12 H 1 0.67 0.01 . 1 . . . . 105 ILE HG12 . 16307 1 1295 . 1 1 104 104 ILE HG13 H 1 1.63 0.01 . 1 . . . . 105 ILE HG13 . 16307 1 1296 . 1 1 104 104 ILE HG21 H 1 0.82 0.01 . 1 . . . . 105 ILE HG2 . 16307 1 1297 . 1 1 104 104 ILE HG22 H 1 0.82 0.01 . 1 . . . . 105 ILE HG2 . 16307 1 1298 . 1 1 104 104 ILE HG23 H 1 0.82 0.01 . 1 . . . . 105 ILE HG2 . 16307 1 1299 . 1 1 104 104 ILE C C 13 177.4 0.3 . 1 . . . . 105 ILE C . 16307 1 1300 . 1 1 104 104 ILE CA C 13 66.4 0.3 . 1 . . . . 105 ILE CA . 16307 1 1301 . 1 1 104 104 ILE CB C 13 37.5 0.3 . 1 . . . . 105 ILE CB . 16307 1 1302 . 1 1 104 104 ILE CD1 C 13 13.5 0.3 . 1 . . . . 105 ILE CD1 . 16307 1 1303 . 1 1 104 104 ILE CG1 C 13 29.9 0.3 . 1 . . . . 105 ILE CG1 . 16307 1 1304 . 1 1 104 104 ILE CG2 C 13 18.1 0.3 . 1 . . . . 105 ILE CG2 . 16307 1 1305 . 1 1 104 104 ILE N N 15 120.0 0.1 . 1 . . . . 105 ILE N . 16307 1 1306 . 1 1 105 105 ASP H H 1 8.77 0.01 . 1 . . . . 106 ASP H . 16307 1 1307 . 1 1 105 105 ASP HA H 1 4.22 0.01 . 1 . . . . 106 ASP HA . 16307 1 1308 . 1 1 105 105 ASP HB2 H 1 2.71 0.01 . 2 . . . . 106 ASP HB2 . 16307 1 1309 . 1 1 105 105 ASP HB3 H 1 2.6 0.01 . 2 . . . . 106 ASP HB3 . 16307 1 1310 . 1 1 105 105 ASP C C 13 179.3 0.3 . 1 . . . . 106 ASP C . 16307 1 1311 . 1 1 105 105 ASP CA C 13 57.4 0.3 . 1 . . . . 106 ASP CA . 16307 1 1312 . 1 1 105 105 ASP CB C 13 40.1 0.3 . 1 . . . . 106 ASP CB . 16307 1 1313 . 1 1 105 105 ASP N N 15 118.4 0.1 . 1 . . . . 106 ASP N . 16307 1 1314 . 1 1 106 106 GLU H H 1 7.35 0.01 . 1 . . . . 107 GLU H . 16307 1 1315 . 1 1 106 106 GLU HA H 1 3.96 0.01 . 1 . . . . 107 GLU HA . 16307 1 1316 . 1 1 106 106 GLU HB2 H 1 2.12 0.01 . 2 . . . . 107 GLU HB2 . 16307 1 1317 . 1 1 106 106 GLU HB3 H 1 2.1 0.01 . 2 . . . . 107 GLU HB3 . 16307 1 1318 . 1 1 106 106 GLU HG2 H 1 2.47 0.01 . 2 . . . . 107 GLU HG2 . 16307 1 1319 . 1 1 106 106 GLU HG3 H 1 2.16 0.01 . 2 . . . . 107 GLU HG3 . 16307 1 1320 . 1 1 106 106 GLU C C 13 178.8 0.3 . 1 . . . . 107 GLU C . 16307 1 1321 . 1 1 106 106 GLU CA C 13 60.0 0.3 . 1 . . . . 107 GLU CA . 16307 1 1322 . 1 1 106 106 GLU CB C 13 29.4 0.3 . 1 . . . . 107 GLU CB . 16307 1 1323 . 1 1 106 106 GLU CG C 13 36.3 0.3 . 1 . . . . 107 GLU CG . 16307 1 1324 . 1 1 106 106 GLU N N 15 120.8 0.1 . 1 . . . . 107 GLU N . 16307 1 1325 . 1 1 107 107 VAL H H 1 7.53 0.01 . 1 . . . . 108 VAL H . 16307 1 1326 . 1 1 107 107 VAL HA H 1 3.7 0.01 . 1 . . . . 108 VAL HA . 16307 1 1327 . 1 1 107 107 VAL HB H 1 2.07 0.01 . 1 . . . . 108 VAL HB . 16307 1 1328 . 1 1 107 107 VAL HG11 H 1 0.45 0.01 . 1 . . . . 108 VAL HG1 . 16307 1 1329 . 1 1 107 107 VAL HG12 H 1 0.45 0.01 . 1 . . . . 108 VAL HG1 . 16307 1 1330 . 1 1 107 107 VAL HG13 H 1 0.45 0.01 . 1 . . . . 108 VAL HG1 . 16307 1 1331 . 1 1 107 107 VAL HG21 H 1 0.14 0.01 . 1 . . . . 108 VAL HG2 . 16307 1 1332 . 1 1 107 107 VAL HG22 H 1 0.14 0.01 . 1 . . . . 108 VAL HG2 . 16307 1 1333 . 1 1 107 107 VAL HG23 H 1 0.14 0.01 . 1 . . . . 108 VAL HG2 . 16307 1 1334 . 1 1 107 107 VAL C C 13 178.3 0.3 . 1 . . . . 108 VAL C . 16307 1 1335 . 1 1 107 107 VAL CA C 13 65.3 0.3 . 1 . . . . 108 VAL CA . 16307 1 1336 . 1 1 107 107 VAL CB C 13 31.4 0.3 . 1 . . . . 108 VAL CB . 16307 1 1337 . 1 1 107 107 VAL CG1 C 13 20.9 0.3 . 1 . . . . 108 VAL CG1 . 16307 1 1338 . 1 1 107 107 VAL CG2 C 13 21.7 0.3 . 1 . . . . 108 VAL CG2 . 16307 1 1339 . 1 1 107 107 VAL N N 15 121.5 0.1 . 1 . . . . 108 VAL N . 16307 1 1340 . 1 1 108 108 VAL H H 1 8.45 0.01 . 1 . . . . 109 VAL H . 16307 1 1341 . 1 1 108 108 VAL HA H 1 3.32 0.01 . 1 . . . . 109 VAL HA . 16307 1 1342 . 1 1 108 108 VAL HB H 1 2.07 0.01 . 1 . . . . 109 VAL HB . 16307 1 1343 . 1 1 108 108 VAL HG11 H 1 0.79 0.01 . 1 . . . . 109 VAL HG1 . 16307 1 1344 . 1 1 108 108 VAL HG12 H 1 0.79 0.01 . 1 . . . . 109 VAL HG1 . 16307 1 1345 . 1 1 108 108 VAL HG13 H 1 0.79 0.01 . 1 . . . . 109 VAL HG1 . 16307 1 1346 . 1 1 108 108 VAL HG21 H 1 0.91 0.01 . 1 . . . . 109 VAL HG2 . 16307 1 1347 . 1 1 108 108 VAL HG22 H 1 0.91 0.01 . 1 . . . . 109 VAL HG2 . 16307 1 1348 . 1 1 108 108 VAL HG23 H 1 0.91 0.01 . 1 . . . . 109 VAL HG2 . 16307 1 1349 . 1 1 108 108 VAL C C 13 179.3 0.3 . 1 . . . . 109 VAL C . 16307 1 1350 . 1 1 108 108 VAL CA C 13 66.9 0.3 . 1 . . . . 109 VAL CA . 16307 1 1351 . 1 1 108 108 VAL CB C 13 31.9 0.3 . 1 . . . . 109 VAL CB . 16307 1 1352 . 1 1 108 108 VAL CG1 C 13 21.1 0.3 . 1 . . . . 109 VAL CG1 . 16307 1 1353 . 1 1 108 108 VAL CG2 C 13 23.6 0.3 . 1 . . . . 109 VAL CG2 . 16307 1 1354 . 1 1 108 108 VAL N N 15 119.7 0.1 . 1 . . . . 109 VAL N . 16307 1 1355 . 1 1 109 109 THR H H 1 7.77 0.01 . 1 . . . . 110 THR H . 16307 1 1356 . 1 1 109 109 THR HA H 1 3.85 0.01 . 1 . . . . 110 THR HA . 16307 1 1357 . 1 1 109 109 THR HB H 1 4.29 0.01 . 1 . . . . 110 THR HB . 16307 1 1358 . 1 1 109 109 THR HG21 H 1 1.21 0.01 . 1 . . . . 110 THR HG2 . 16307 1 1359 . 1 1 109 109 THR HG22 H 1 1.21 0.01 . 1 . . . . 110 THR HG2 . 16307 1 1360 . 1 1 109 109 THR HG23 H 1 1.21 0.01 . 1 . . . . 110 THR HG2 . 16307 1 1361 . 1 1 109 109 THR C C 13 176.3 0.3 . 1 . . . . 110 THR C . 16307 1 1362 . 1 1 109 109 THR CA C 13 66.3 0.3 . 1 . . . . 110 THR CA . 16307 1 1363 . 1 1 109 109 THR CB C 13 68.9 0.3 . 1 . . . . 110 THR CB . 16307 1 1364 . 1 1 109 109 THR CG2 C 13 21.8 0.3 . 1 . . . . 110 THR CG2 . 16307 1 1365 . 1 1 109 109 THR N N 15 116.1 0.1 . 1 . . . . 110 THR N . 16307 1 1366 . 1 1 110 110 ILE H H 1 7.58 0.01 . 1 . . . . 111 ILE H . 16307 1 1367 . 1 1 110 110 ILE HA H 1 3.8 0.01 . 1 . . . . 111 ILE HA . 16307 1 1368 . 1 1 110 110 ILE HB H 1 2.12 0.01 . 1 . . . . 111 ILE HB . 16307 1 1369 . 1 1 110 110 ILE HD11 H 1 0.53 0.01 . 1 . . . . 111 ILE HD1 . 16307 1 1370 . 1 1 110 110 ILE HD12 H 1 0.53 0.01 . 1 . . . . 111 ILE HD1 . 16307 1 1371 . 1 1 110 110 ILE HD13 H 1 0.53 0.01 . 1 . . . . 111 ILE HD1 . 16307 1 1372 . 1 1 110 110 ILE HG12 H 1 1.06 0.01 . 2 . . . . 111 ILE HG12 . 16307 1 1373 . 1 1 110 110 ILE HG13 H 1 1.45 0.01 . 2 . . . . 111 ILE HG13 . 16307 1 1374 . 1 1 110 110 ILE HG21 H 1 0.43 0.01 . 1 . . . . 111 ILE HG2 . 16307 1 1375 . 1 1 110 110 ILE HG22 H 1 0.43 0.01 . 1 . . . . 111 ILE HG2 . 16307 1 1376 . 1 1 110 110 ILE HG23 H 1 0.43 0.01 . 1 . . . . 111 ILE HG2 . 16307 1 1377 . 1 1 110 110 ILE C C 13 179.0 0.3 . 1 . . . . 111 ILE C . 16307 1 1378 . 1 1 110 110 ILE CA C 13 64.6 0.3 . 1 . . . . 111 ILE CA . 16307 1 1379 . 1 1 110 110 ILE CB C 13 36.7 0.3 . 1 . . . . 111 ILE CB . 16307 1 1380 . 1 1 110 110 ILE CD1 C 13 11.1 0.3 . 1 . . . . 111 ILE CD1 . 16307 1 1381 . 1 1 110 110 ILE CG1 C 13 28.8 0.3 . 1 . . . . 111 ILE CG1 . 16307 1 1382 . 1 1 110 110 ILE CG2 C 13 16.9 0.3 . 1 . . . . 111 ILE CG2 . 16307 1 1383 . 1 1 110 110 ILE N N 15 122.3 0.1 . 1 . . . . 111 ILE N . 16307 1 1384 . 1 1 111 111 VAL H H 1 8.52 0.01 . 1 . . . . 112 VAL H . 16307 1 1385 . 1 1 111 111 VAL HA H 1 3.95 0.01 . 1 . . . . 112 VAL HA . 16307 1 1386 . 1 1 111 111 VAL HB H 1 2.21 0.01 . 1 . . . . 112 VAL HB . 16307 1 1387 . 1 1 111 111 VAL HG11 H 1 0.75 0.01 . 2 . . . . 112 VAL HG1 . 16307 1 1388 . 1 1 111 111 VAL HG12 H 1 0.75 0.01 . 2 . . . . 112 VAL HG1 . 16307 1 1389 . 1 1 111 111 VAL HG13 H 1 0.75 0.01 . 2 . . . . 112 VAL HG1 . 16307 1 1390 . 1 1 111 111 VAL HG21 H 1 0.87 0.01 . 2 . . . . 112 VAL HG2 . 16307 1 1391 . 1 1 111 111 VAL HG22 H 1 0.87 0.01 . 2 . . . . 112 VAL HG2 . 16307 1 1392 . 1 1 111 111 VAL HG23 H 1 0.87 0.01 . 2 . . . . 112 VAL HG2 . 16307 1 1393 . 1 1 111 111 VAL C C 13 176.6 0.3 . 1 . . . . 112 VAL C . 16307 1 1394 . 1 1 111 111 VAL CA C 13 64.6 0.3 . 1 . . . . 112 VAL CA . 16307 1 1395 . 1 1 111 111 VAL CB C 13 31.4 0.3 . 1 . . . . 112 VAL CB . 16307 1 1396 . 1 1 111 111 VAL CG1 C 13 22.4 0.3 . 2 . . . . 112 VAL CG1 . 16307 1 1397 . 1 1 111 111 VAL CG2 C 13 20.0 0.3 . 2 . . . . 112 VAL CG2 . 16307 1 1398 . 1 1 111 111 VAL N N 15 112.0 0.1 . 1 . . . . 112 VAL N . 16307 1 1399 . 1 1 112 112 GLY H H 1 7.76 0.01 . 1 . . . . 113 GLY H . 16307 1 1400 . 1 1 112 112 GLY HA2 H 1 3.68 0.01 . 1 . . . . 113 GLY HA2 . 16307 1 1401 . 1 1 112 112 GLY HA3 H 1 4.1 0.01 . 1 . . . . 113 GLY HA3 . 16307 1 1402 . 1 1 112 112 GLY C C 13 174.2 0.3 . 1 . . . . 113 GLY C . 16307 1 1403 . 1 1 112 112 GLY CA C 13 44.9 0.3 . 1 . . . . 113 GLY CA . 16307 1 1404 . 1 1 112 112 GLY N N 15 106.8 0.1 . 1 . . . . 113 GLY N . 16307 1 1405 . 1 1 113 113 SER H H 1 7.21 0.01 . 1 . . . . 114 SER H . 16307 1 1406 . 1 1 113 113 SER HA H 1 4.53 0.01 . 1 . . . . 114 SER HA . 16307 1 1407 . 1 1 113 113 SER HB2 H 1 4.18 0.01 . 2 . . . . 114 SER HB2 . 16307 1 1408 . 1 1 113 113 SER HB3 H 1 4.1 0.01 . 2 . . . . 114 SER HB3 . 16307 1 1409 . 1 1 113 113 SER C C 13 176.2 0.3 . 1 . . . . 114 SER C . 16307 1 1410 . 1 1 113 113 SER CA C 13 58.1 0.3 . 1 . . . . 114 SER CA . 16307 1 1411 . 1 1 113 113 SER CB C 13 64.0 0.3 . 1 . . . . 114 SER CB . 16307 1 1412 . 1 1 113 113 SER N N 15 115.5 0.1 . 1 . . . . 114 SER N . 16307 1 1413 . 1 1 114 114 VAL H H 1 8.75 0.01 . 1 . . . . 115 VAL H . 16307 1 1414 . 1 1 114 114 VAL HA H 1 3.57 0.01 . 1 . . . . 115 VAL HA . 16307 1 1415 . 1 1 114 114 VAL HB H 1 2.07 0.01 . 1 . . . . 115 VAL HB . 16307 1 1416 . 1 1 114 114 VAL HG11 H 1 0.97 0.01 . 1 . . . . 115 VAL HG1 . 16307 1 1417 . 1 1 114 114 VAL HG12 H 1 0.97 0.01 . 1 . . . . 115 VAL HG1 . 16307 1 1418 . 1 1 114 114 VAL HG13 H 1 0.97 0.01 . 1 . . . . 115 VAL HG1 . 16307 1 1419 . 1 1 114 114 VAL HG21 H 1 1.04 0.01 . 1 . . . . 115 VAL HG2 . 16307 1 1420 . 1 1 114 114 VAL HG22 H 1 1.04 0.01 . 1 . . . . 115 VAL HG2 . 16307 1 1421 . 1 1 114 114 VAL HG23 H 1 1.04 0.01 . 1 . . . . 115 VAL HG2 . 16307 1 1422 . 1 1 114 114 VAL C C 13 177.5 0.3 . 1 . . . . 115 VAL C . 16307 1 1423 . 1 1 114 114 VAL CA C 13 66.3 0.3 . 1 . . . . 115 VAL CA . 16307 1 1424 . 1 1 114 114 VAL CB C 13 32.0 0.3 . 1 . . . . 115 VAL CB . 16307 1 1425 . 1 1 114 114 VAL CG1 C 13 21.2 0.3 . 1 . . . . 115 VAL CG1 . 16307 1 1426 . 1 1 114 114 VAL CG2 C 13 21.7 0.3 . 1 . . . . 115 VAL CG2 . 16307 1 1427 . 1 1 114 114 VAL N N 15 128.4 0.1 . 1 . . . . 115 VAL N . 16307 1 1428 . 1 1 115 115 GLN H H 1 8.36 0.01 . 1 . . . . 116 GLN H . 16307 1 1429 . 1 1 115 115 GLN HA H 1 4.08 0.01 . 1 . . . . 116 GLN HA . 16307 1 1430 . 1 1 115 115 GLN HB2 H 1 2 0.01 . 2 . . . . 116 GLN HB2 . 16307 1 1431 . 1 1 115 115 GLN HB3 H 1 1.83 0.01 . 2 . . . . 116 GLN HB3 . 16307 1 1432 . 1 1 115 115 GLN HE21 H 1 7.6 0.01 . 2 . . . . 116 GLN HE21 . 16307 1 1433 . 1 1 115 115 GLN HE22 H 1 6.95 0.01 . 2 . . . . 116 GLN HE22 . 16307 1 1434 . 1 1 115 115 GLN HG2 H 1 2.27 0.01 . 2 . . . . 116 GLN HG2 . 16307 1 1435 . 1 1 115 115 GLN HG3 H 1 2.27 0.01 . 2 . . . . 116 GLN HG3 . 16307 1 1436 . 1 1 115 115 GLN C C 13 178.1 0.3 . 1 . . . . 116 GLN C . 16307 1 1437 . 1 1 115 115 GLN CA C 13 58.9 0.3 . 1 . . . . 116 GLN CA . 16307 1 1438 . 1 1 115 115 GLN CB C 13 28.2 0.3 . 1 . . . . 116 GLN CB . 16307 1 1439 . 1 1 115 115 GLN CG C 13 33.7 0.3 . 1 . . . . 116 GLN CG . 16307 1 1440 . 1 1 115 115 GLN N N 15 118.7 0.1 . 1 . . . . 116 GLN N . 16307 1 1441 . 1 1 115 115 GLN NE2 N 15 112.8 0.1 . 1 . . . . 116 GLN NE2 . 16307 1 1442 . 1 1 116 116 HIS H H 1 7.49 0.01 . 1 . . . . 117 HIS H . 16307 1 1443 . 1 1 116 116 HIS HA H 1 4.92 0.01 . 1 . . . . 117 HIS HA . 16307 1 1444 . 1 1 116 116 HIS HB2 H 1 3.53 0.01 . 2 . . . . 117 HIS HB2 . 16307 1 1445 . 1 1 116 116 HIS HB3 H 1 3.36 0.01 . 2 . . . . 117 HIS HB3 . 16307 1 1446 . 1 1 116 116 HIS HD2 H 1 7.46 0.05 . 1 . . . . 117 HIS HD2 . 16307 1 1447 . 1 1 116 116 HIS HE1 H 1 8.17 0.05 . 1 . . . . 117 HIS HE1 . 16307 1 1448 . 1 1 116 116 HIS C C 13 176.3 0.3 . 1 . . . . 117 HIS C . 16307 1 1449 . 1 1 116 116 HIS CA C 13 58.2 0.3 . 1 . . . . 117 HIS CA . 16307 1 1450 . 1 1 116 116 HIS CB C 13 30.0 0.3 . 1 . . . . 117 HIS CB . 16307 1 1451 . 1 1 116 116 HIS N N 15 115.7 0.1 . 1 . . . . 117 HIS N . 16307 1 1452 . 1 1 117 117 ARG H H 1 7.64 0.01 . 1 . . . . 118 ARG H . 16307 1 1453 . 1 1 117 117 ARG HA H 1 3.99 0.01 . 1 . . . . 118 ARG HA . 16307 1 1454 . 1 1 117 117 ARG HB2 H 1 1.27 0.01 . 2 . . . . 118 ARG HB2 . 16307 1 1455 . 1 1 117 117 ARG HB3 H 1 1.36 0.01 . 2 . . . . 118 ARG HB3 . 16307 1 1456 . 1 1 117 117 ARG HD2 H 1 2.79 0.01 . 2 . . . . 118 ARG HD2 . 16307 1 1457 . 1 1 117 117 ARG HD3 H 1 2.47 0.01 . 2 . . . . 118 ARG HD3 . 16307 1 1458 . 1 1 117 117 ARG HE H 1 6.63 0.01 . 1 . . . . 118 ARG HE . 16307 1 1459 . 1 1 117 117 ARG HG2 H 1 0.98 0.01 . 2 . . . . 118 ARG HG2 . 16307 1 1460 . 1 1 117 117 ARG HG3 H 1 0.24 0.01 . 2 . . . . 118 ARG HG3 . 16307 1 1461 . 1 1 117 117 ARG C C 13 177.5 0.3 . 1 . . . . 118 ARG C . 16307 1 1462 . 1 1 117 117 ARG CA C 13 58.1 0.3 . 1 . . . . 118 ARG CA . 16307 1 1463 . 1 1 117 117 ARG CB C 13 31.3 0.3 . 1 . . . . 118 ARG CB . 16307 1 1464 . 1 1 117 117 ARG CD C 13 43.9 0.3 . 1 . . . . 118 ARG CD . 16307 1 1465 . 1 1 117 117 ARG CG C 13 26.6 0.3 . 1 . . . . 118 ARG CG . 16307 1 1466 . 1 1 117 117 ARG N N 15 117.8 0.1 . 1 . . . . 118 ARG N . 16307 1 1467 . 1 1 117 117 ARG NE N 15 84.15 0.1 . 1 . . . . 118 ARG NE . 16307 1 1468 . 1 1 118 118 ASN H H 1 8.05 0.01 . 1 . . . . 119 ASN H . 16307 1 1469 . 1 1 118 118 ASN HA H 1 4.51 0.01 . 1 . . . . 119 ASN HA . 16307 1 1470 . 1 1 118 118 ASN HB2 H 1 3.07 0.01 . 1 . . . . 119 ASN HB2 . 16307 1 1471 . 1 1 118 118 ASN HB3 H 1 2.99 0.01 . 1 . . . . 119 ASN HB3 . 16307 1 1472 . 1 1 118 118 ASN HD21 H 1 7.66 0.01 . 1 . . . . 119 ASN HD21 . 16307 1 1473 . 1 1 118 118 ASN HD22 H 1 6.76 0.01 . 1 . . . . 119 ASN HD22 . 16307 1 1474 . 1 1 118 118 ASN C C 13 177.3 0.3 . 1 . . . . 119 ASN C . 16307 1 1475 . 1 1 118 118 ASN CA C 13 56.3 0.3 . 1 . . . . 119 ASN CA . 16307 1 1476 . 1 1 118 118 ASN CB C 13 38.3 0.3 . 1 . . . . 119 ASN CB . 16307 1 1477 . 1 1 118 118 ASN N N 15 117.0 0.1 . 1 . . . . 119 ASN N . 16307 1 1478 . 1 1 118 118 ASN ND2 N 15 110.1 0.1 . 1 . . . . 119 ASN ND2 . 16307 1 1479 . 1 1 119 119 ASP H H 1 8.36 0.01 . 1 . . . . 120 ASP H . 16307 1 1480 . 1 1 119 119 ASP HA H 1 5.34 0.01 . 1 . . . . 120 ASP HA . 16307 1 1481 . 1 1 119 119 ASP HB2 H 1 3.48 0.01 . 1 . . . . 120 ASP HB2 . 16307 1 1482 . 1 1 119 119 ASP HB3 H 1 3.6 0.01 . 1 . . . . 120 ASP HB3 . 16307 1 1483 . 1 1 119 119 ASP C C 13 179.1 0.3 . 1 . . . . 120 ASP C . 16307 1 1484 . 1 1 119 119 ASP CA C 13 58.7 0.3 . 1 . . . . 120 ASP CA . 16307 1 1485 . 1 1 119 119 ASP CB C 13 41.8 0.3 . 1 . . . . 120 ASP CB . 16307 1 1486 . 1 1 119 119 ASP N N 15 118.6 0.1 . 1 . . . . 120 ASP N . 16307 1 1487 . 1 1 120 120 VAL H H 1 8.9 0.01 . 1 . . . . 121 VAL H . 16307 1 1488 . 1 1 120 120 VAL HA H 1 6.93 0.01 . 1 . . . . 121 VAL HA . 16307 1 1489 . 1 1 120 120 VAL HB H 1 3.14 0.01 . 1 . . . . 121 VAL HB . 16307 1 1490 . 1 1 120 120 VAL HG11 H 1 2.76 0.01 . 1 . . . . 121 VAL HG1 . 16307 1 1491 . 1 1 120 120 VAL HG12 H 1 2.76 0.01 . 1 . . . . 121 VAL HG1 . 16307 1 1492 . 1 1 120 120 VAL HG13 H 1 2.76 0.01 . 1 . . . . 121 VAL HG1 . 16307 1 1493 . 1 1 120 120 VAL HG21 H 1 3.31 0.01 . 1 . . . . 121 VAL HG2 . 16307 1 1494 . 1 1 120 120 VAL HG22 H 1 3.31 0.01 . 1 . . . . 121 VAL HG2 . 16307 1 1495 . 1 1 120 120 VAL HG23 H 1 3.31 0.01 . 1 . . . . 121 VAL HG2 . 16307 1 1496 . 1 1 120 120 VAL C C 13 177.8 0.3 . 1 . . . . 121 VAL C . 16307 1 1497 . 1 1 120 120 VAL CA C 13 69.6 0.3 . 1 . . . . 121 VAL CA . 16307 1 1498 . 1 1 120 120 VAL CB C 13 34.0 0.3 . 1 . . . . 121 VAL CB . 16307 1 1499 . 1 1 120 120 VAL CG1 C 13 23.4 0.3 . 1 . . . . 121 VAL CG1 . 16307 1 1500 . 1 1 120 120 VAL CG2 C 13 26.1 0.3 . 1 . . . . 121 VAL CG2 . 16307 1 1501 . 1 1 120 120 VAL N N 15 120.7 0.1 . 1 . . . . 121 VAL N . 16307 1 1502 . 1 1 121 121 LEU H H 1 8.59 0.01 . 1 . . . . 122 LEU H . 16307 1 1503 . 1 1 121 121 LEU HA H 1 5.07 0.01 . 1 . . . . 122 LEU HA . 16307 1 1504 . 1 1 121 121 LEU HB2 H 1 1.97 0.01 . 2 . . . . 122 LEU HB2 . 16307 1 1505 . 1 1 121 121 LEU HB3 H 1 1.95 0.01 . 2 . . . . 122 LEU HB3 . 16307 1 1506 . 1 1 121 121 LEU HD11 H 1 0.79 0.01 . 2 . . . . 122 LEU HD1 . 16307 1 1507 . 1 1 121 121 LEU HD12 H 1 0.79 0.01 . 2 . . . . 122 LEU HD1 . 16307 1 1508 . 1 1 121 121 LEU HD13 H 1 0.79 0.01 . 2 . . . . 122 LEU HD1 . 16307 1 1509 . 1 1 121 121 LEU HD21 H 1 0.72 0.01 . 2 . . . . 122 LEU HD2 . 16307 1 1510 . 1 1 121 121 LEU HD22 H 1 0.72 0.01 . 2 . . . . 122 LEU HD2 . 16307 1 1511 . 1 1 121 121 LEU HD23 H 1 0.72 0.01 . 2 . . . . 122 LEU HD2 . 16307 1 1512 . 1 1 121 121 LEU HG H 1 2.02 0.01 . 1 . . . . 122 LEU HG . 16307 1 1513 . 1 1 121 121 LEU C C 13 176.0 0.3 . 1 . . . . 122 LEU C . 16307 1 1514 . 1 1 121 121 LEU CA C 13 55.4 0.3 . 1 . . . . 122 LEU CA . 16307 1 1515 . 1 1 121 121 LEU CB C 13 40.5 0.3 . 1 . . . . 122 LEU CB . 16307 1 1516 . 1 1 121 121 LEU CD1 C 13 22.4 0.3 . 2 . . . . 122 LEU CD1 . 16307 1 1517 . 1 1 121 121 LEU CD2 C 13 25.7 0.3 . 2 . . . . 122 LEU CD2 . 16307 1 1518 . 1 1 121 121 LEU CG C 13 26.7 0.3 . 1 . . . . 122 LEU CG . 16307 1 1519 . 1 1 121 121 LEU N N 15 111.9 0.1 . 1 . . . . 122 LEU N . 16307 1 1520 . 1 1 122 122 ASN H H 1 9.02 0.01 . 1 . . . . 123 ASN H . 16307 1 1521 . 1 1 122 122 ASN HA H 1 4.85 0.01 . 1 . . . . 123 ASN HA . 16307 1 1522 . 1 1 122 122 ASN HB2 H 1 3.74 0.01 . 2 . . . . 123 ASN HB2 . 16307 1 1523 . 1 1 122 122 ASN HB3 H 1 3.74 0.01 . 2 . . . . 123 ASN HB3 . 16307 1 1524 . 1 1 122 122 ASN HD21 H 1 8.1 0.01 . 1 . . . . 123 ASN HD21 . 16307 1 1525 . 1 1 122 122 ASN HD22 H 1 8.29 0.01 . 1 . . . . 123 ASN HD22 . 16307 1 1526 . 1 1 122 122 ASN C C 13 174.3 0.3 . 1 . . . . 123 ASN C . 16307 1 1527 . 1 1 122 122 ASN CA C 13 55.0 0.3 . 1 . . . . 123 ASN CA . 16307 1 1528 . 1 1 122 122 ASN CB C 13 38.4 0.3 . 1 . . . . 123 ASN CB . 16307 1 1529 . 1 1 122 122 ASN N N 15 118.2 0.1 . 1 . . . . 123 ASN N . 16307 1 1530 . 1 1 122 122 ASN ND2 N 15 110.8 0.1 . 1 . . . . 123 ASN ND2 . 16307 1 1531 . 1 1 123 123 ARG H H 1 9 0.01 . 1 . . . . 124 ARG H . 16307 1 1532 . 1 1 123 123 ARG HA H 1 4.57 0.01 . 1 . . . . 124 ARG HA . 16307 1 1533 . 1 1 123 123 ARG HB2 H 1 1.73 0.01 . 2 . . . . 124 ARG HB2 . 16307 1 1534 . 1 1 123 123 ARG HB3 H 1 2.03 0.01 . 4 . . . . 124 ARG HB3 . 16307 1 1535 . 1 1 123 123 ARG HD2 H 1 3.29 0.01 . 2 . . . . 124 ARG HD2 . 16307 1 1536 . 1 1 123 123 ARG HD3 H 1 3.18 0.01 . 2 . . . . 124 ARG HD3 . 16307 1 1537 . 1 1 123 123 ARG HE H 1 7.26 0.01 . 1 . . . . 124 ARG HE . 16307 1 1538 . 1 1 123 123 ARG HG2 H 1 1.81 0.01 . 4 . . . . 124 ARG HG2 . 16307 1 1539 . 1 1 123 123 ARG C C 13 181.5 0.3 . 1 . . . . 124 ARG C . 16307 1 1540 . 1 1 123 123 ARG CA C 13 57.3 0.3 . 1 . . . . 124 ARG CA . 16307 1 1541 . 1 1 123 123 ARG CB C 13 32.2 0.3 . 1 . . . . 124 ARG CB . 16307 1 1542 . 1 1 123 123 ARG N N 15 123.8 0.1 . 1 . . . . 124 ARG N . 16307 1 1543 . 1 1 123 123 ARG NE N 15 85.3 0.1 . 1 . . . . 124 ARG NE . 16307 1 1544 . 2 2 1 1 HEM HHC H 1 1.61 0.02 . 1 . . . . 125 HEM HHC . 16307 1 1545 . 2 2 1 1 HEM HHD H 1 0.09 0.02 . 1 . . . . 125 HEM HHD . 16307 1 1546 . 2 2 1 1 HEM HAB H 1 16.45 0.02 . 1 . . . . 125 HEM HAB . 16307 1 1547 . 2 2 1 1 HEM HAC H 1 5.46 0.02 . 1 . . . . 125 HEM HAC . 16307 1 1548 . 2 2 1 1 HEM HAA1 H 1 2.15 0.02 . 2 . . . . 125 HEM HAA1 . 16307 1 1549 . 2 2 1 1 HEM HAA2 H 1 1.57 0.02 . 2 . . . . 125 HEM HAA2 . 16307 1 1550 . 2 2 1 1 HEM HAD1 H 1 11.22 0.02 . 2 . . . . 125 HEM HAD1 . 16307 1 1551 . 2 2 1 1 HEM HAD2 H 1 8.62 0.02 . 2 . . . . 125 HEM HAD2 . 16307 1 1552 . 2 2 1 1 HEM HBA1 H 1 -0.78 0.02 . 2 . . . . 125 HEM HBA1 . 16307 1 1553 . 2 2 1 1 HEM HBA2 H 1 -1.22 0.02 . 2 . . . . 125 HEM HBA2 . 16307 1 1554 . 2 2 1 1 HEM HBB1 H 1 -5.31 0.02 . 1 . . . . 125 HEM HBB1 . 16307 1 1555 . 2 2 1 1 HEM HBB2 H 1 -5.8 0.02 . 1 . . . . 125 HEM HBB2 . 16307 1 1556 . 2 2 1 1 HEM HBC1 H 1 -1.67 0.02 . 1 . . . . 125 HEM HBC1 . 16307 1 1557 . 2 2 1 1 HEM HBC2 H 1 -1.96 0.02 . 1 . . . . 125 HEM HBC2 . 16307 1 1558 . 2 2 1 1 HEM HMA1 H 1 9.7 0.02 . 1 . . . . 125 HEM HMA . 16307 1 1559 . 2 2 1 1 HEM HMA2 H 1 9.7 0.02 . 1 . . . . 125 HEM HMA . 16307 1 1560 . 2 2 1 1 HEM HMA3 H 1 9.7 0.02 . 1 . . . . 125 HEM HMA . 16307 1 1561 . 2 2 1 1 HEM HMB1 H 1 16.52 0.02 . 1 . . . . 125 HEM HMB . 16307 1 1562 . 2 2 1 1 HEM HMB2 H 1 16.52 0.02 . 1 . . . . 125 HEM HMB . 16307 1 1563 . 2 2 1 1 HEM HMB3 H 1 16.52 0.02 . 1 . . . . 125 HEM HMB . 16307 1 1564 . 2 2 1 1 HEM HMC1 H 1 7.51 0.02 . 1 . . . . 125 HEM HMC . 16307 1 1565 . 2 2 1 1 HEM HMC2 H 1 7.51 0.02 . 1 . . . . 125 HEM HMC . 16307 1 1566 . 2 2 1 1 HEM HMC3 H 1 7.51 0.02 . 1 . . . . 125 HEM HMC . 16307 1 1567 . 2 2 1 1 HEM HMD1 H 1 24.27 0.02 . 1 . . . . 125 HEM HMD . 16307 1 1568 . 2 2 1 1 HEM HMD2 H 1 24.27 0.02 . 1 . . . . 125 HEM HMD . 16307 1 1569 . 2 2 1 1 HEM HMD3 H 1 24.27 0.02 . 1 . . . . 125 HEM HMD . 16307 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 16307 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _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 13 '3D CBCA(CO)NH' . . . 16307 2 14 '3D HNCA' . . . 16307 2 15 '2D 1H-15N HSQC' . . . 16307 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 . 16307 2 2 . 1 1 3 3 LEU N N 15 122.6 0.2 . 1 . . . . 4 LEU N . 16307 2 3 . 1 1 4 4 TYR H H 1 7.34 0.01 . 1 . . . . 5 TYR H . 16307 2 4 . 1 1 4 4 TYR N N 15 114.6 0.1 . 1 . . . . 5 TYR N . 16307 2 5 . 1 1 5 5 GLU H H 1 7.62 0.01 . 1 . . . . 6 GLU H . 16307 2 6 . 1 1 5 5 GLU N N 15 119.3 0.1 . 1 . . . . 6 GLU N . 16307 2 7 . 1 1 6 6 LYS H H 1 8.02 0.01 . 1 . . . . 7 LYS H . 16307 2 8 . 1 1 6 6 LYS N N 15 117.7 0.1 . 1 . . . . 7 LYS N . 16307 2 9 . 1 1 7 7 LEU H H 1 7.65 0.01 . 1 . . . . 8 LEU H . 16307 2 10 . 1 1 7 7 LEU N N 15 113.7 0.1 . 1 . . . . 8 LEU N . 16307 2 11 . 1 1 8 8 GLY H H 1 7.27 0.01 . 1 . . . . 9 GLY H . 16307 2 12 . 1 1 8 8 GLY N N 15 104.8 0.1 . 1 . . . . 9 GLY N . 16307 2 13 . 1 1 9 9 GLY H H 1 8.31 0.01 . 1 . . . . 10 GLY H . 16307 2 14 . 1 1 9 9 GLY N N 15 109.0 0.1 . 1 . . . . 10 GLY N . 16307 2 15 . 1 1 10 10 ALA H H 1 8.53 0.02 . 1 . . . . 11 ALA H . 16307 2 16 . 1 1 10 10 ALA N N 15 121.2 0.2 . 1 . . . . 11 ALA N . 16307 2 17 . 1 1 11 11 ALA H H 1 8.46 0.02 . 1 . . . . 12 ALA H . 16307 2 18 . 1 1 11 11 ALA N N 15 119.7 0.2 . 1 . . . . 12 ALA N . 16307 2 19 . 1 1 12 12 ALA H H 1 7.65 0.01 . 1 . . . . 13 ALA H . 16307 2 20 . 1 1 12 12 ALA N N 15 121.7 0.1 . 1 . . . . 13 ALA N . 16307 2 21 . 1 1 13 13 VAL H H 1 7.85 0.01 . 1 . . . . 14 VAL H . 16307 2 22 . 1 1 13 13 VAL N N 15 118.9 0.1 . 1 . . . . 14 VAL N . 16307 2 23 . 1 1 14 14 ASP H H 1 8.41 0.01 . 1 . . . . 15 ASP H . 16307 2 24 . 1 1 14 14 ASP N N 15 119.3 0.1 . 1 . . . . 15 ASP N . 16307 2 25 . 1 1 15 15 LEU H H 1 7.84 0.01 . 1 . . . . 16 LEU H . 16307 2 26 . 1 1 15 15 LEU N N 15 120.6 0.1 . 1 . . . . 16 LEU N . 16307 2 27 . 1 1 16 16 ALA H H 1 8.16 0.01 . 1 . . . . 17 ALA H . 16307 2 28 . 1 1 16 16 ALA N N 15 122.2 0.1 . 1 . . . . 17 ALA N . 16307 2 29 . 1 1 17 17 VAL H H 1 9.16 0.01 . 1 . . . . 18 VAL H . 16307 2 30 . 1 1 17 17 VAL N N 15 118.6 0.1 . 1 . . . . 18 VAL N . 16307 2 31 . 1 1 18 18 GLU H H 1 8.39 0.01 . 1 . . . . 19 GLU H . 16307 2 32 . 1 1 18 18 GLU N N 15 120.0 0.1 . 1 . . . . 19 GLU N . 16307 2 33 . 1 1 19 19 LYS H H 1 8.52 0.01 . 1 . . . . 20 LYS H . 16307 2 34 . 1 1 19 19 LYS N N 15 120.2 0.1 . 1 . . . . 20 LYS N . 16307 2 35 . 1 1 20 20 PHE H H 1 9.05 0.01 . 1 . . . . 21 PHE H . 16307 2 36 . 1 1 20 20 PHE N N 15 122.4 0.1 . 1 . . . . 21 PHE N . 16307 2 37 . 1 1 21 21 TYR H H 1 9.63 0.01 . 1 . . . . 22 TYR H . 16307 2 38 . 1 1 21 21 TYR N N 15 119.8 0.1 . 1 . . . . 22 TYR N . 16307 2 39 . 1 1 22 22 GLY H H 1 8.14 0.01 . 1 . . . . 23 GLY H . 16307 2 40 . 1 1 22 22 GLY N N 15 107.4 0.1 . 1 . . . . 23 GLY N . 16307 2 41 . 1 1 23 23 LYS H H 1 8.12 0.01 . 1 . . . . 24 LYS H . 16307 2 42 . 1 1 23 23 LYS N N 15 122.3 0.1 . 1 . . . . 24 LYS N . 16307 2 43 . 1 1 24 24 VAL H H 1 8.01 0.01 . 1 . . . . 25 VAL H . 16307 2 44 . 1 1 24 24 VAL N N 15 119.2 0.1 . 1 . . . . 25 VAL N . 16307 2 45 . 1 1 25 25 LEU H H 1 7.56 0.01 . 1 . . . . 26 LEU H . 16307 2 46 . 1 1 25 25 LEU N N 15 117.2 0.1 . 1 . . . . 26 LEU N . 16307 2 47 . 1 1 26 26 ALA H H 1 7.10 0.01 . 1 . . . . 27 ALA H . 16307 2 48 . 1 1 26 26 ALA N N 15 118.5 0.1 . 1 . . . . 27 ALA N . 16307 2 49 . 1 1 27 27 ASP H H 1 7.33 0.01 . 1 . . . . 28 ASP H . 16307 2 50 . 1 1 27 27 ASP N N 15 119.7 0.1 . 1 . . . . 28 ASP N . 16307 2 51 . 1 1 28 28 GLU H H 1 9.00 0.01 . 1 . . . . 29 GLU H . 16307 2 52 . 1 1 28 28 GLU N N 15 128.3 0.1 . 1 . . . . 29 GLU N . 16307 2 53 . 1 1 29 29 ARG H H 1 8.66 0.01 . 1 . . . . 30 ARG H . 16307 2 54 . 1 1 29 29 ARG N N 15 117.5 0.1 . 1 . . . . 30 ARG N . 16307 2 55 . 1 1 30 30 VAL H H 1 7.10 0.01 . 1 . . . . 31 VAL H . 16307 2 56 . 1 1 30 30 VAL N N 15 104.1 0.1 . 1 . . . . 31 VAL N . 16307 2 57 . 1 1 31 31 ASN H H 1 8.75 0.01 . 1 . . . . 32 ASN H . 16307 2 58 . 1 1 31 31 ASN N N 15 122.9 0.1 . 1 . . . . 32 ASN N . 16307 2 59 . 1 1 32 32 ARG H H 1 8.11 0.01 . 1 . . . . 33 ARG H . 16307 2 60 . 1 1 32 32 ARG N N 15 120.5 0.1 . 1 . . . . 33 ARG N . 16307 2 61 . 1 1 33 33 PHE H H 1 7.10 0.01 . 1 . . . . 34 PHE H . 16307 2 62 . 1 1 33 33 PHE N N 15 116.2 0.1 . 1 . . . . 34 PHE N . 16307 2 63 . 1 1 34 34 PHE H H 1 7.40 0.01 . 1 . . . . 35 PHE H . 16307 2 64 . 1 1 34 34 PHE N N 15 113.4 0.1 . 1 . . . . 35 PHE N . 16307 2 65 . 1 1 35 35 VAL H H 1 7.26 0.01 . 1 . . . . 36 VAL H . 16307 2 66 . 1 1 35 35 VAL N N 15 117.5 0.1 . 1 . . . . 36 VAL N . 16307 2 67 . 1 1 36 36 ASN H H 1 8.42 0.01 . 1 . . . . 37 ASN H . 16307 2 68 . 1 1 36 36 ASN N N 15 117.8 0.1 . 1 . . . . 37 ASN N . 16307 2 69 . 1 1 37 37 THR H H 1 8.00 0.01 . 1 . . . . 38 THR H . 16307 2 70 . 1 1 37 37 THR N N 15 117.8 0.1 . 1 . . . . 38 THR N . 16307 2 71 . 1 1 38 38 ASP H H 1 9.08 0.01 . 1 . . . . 39 ASP H . 16307 2 72 . 1 1 38 38 ASP N N 15 127.3 0.1 . 1 . . . . 39 ASP N . 16307 2 73 . 1 1 39 39 MET H H 1 9.00 0.01 . 1 . . . . 40 MET H . 16307 2 74 . 1 1 39 39 MET N N 15 122.6 0.1 . 1 . . . . 40 MET N . 16307 2 75 . 1 1 40 40 ALA H H 1 8.70 0.01 . 1 . . . . 41 ALA H . 16307 2 76 . 1 1 40 40 ALA N N 15 121.1 0.1 . 1 . . . . 41 ALA N . 16307 2 77 . 1 1 41 41 LYS H H 1 8.35 0.01 . 1 . . . . 42 LYS H . 16307 2 78 . 1 1 41 41 LYS N N 15 120.9 0.1 . 1 . . . . 42 LYS N . 16307 2 79 . 1 1 42 42 GLN H H 1 9.31 0.01 . 1 . . . . 43 GLN H . 16307 2 80 . 1 1 42 42 GLN N N 15 122.9 0.1 . 1 . . . . 43 GLN N . 16307 2 81 . 1 1 43 43 LYS H H 1 9.00 0.02 . 1 . . . . 44 LYS H . 16307 2 82 . 1 1 43 43 LYS N N 15 120.0 0.2 . 1 . . . . 44 LYS N . 16307 2 83 . 1 1 44 44 GLN H H 1 8.81 0.01 . 1 . . . . 45 GLN H . 16307 2 84 . 1 1 44 44 GLN N N 15 119.3 0.1 . 1 . . . . 45 GLN N . 16307 2 85 . 1 1 45 45 HIS H H 1 10.64 0.01 . 1 . . . . 46 HIS H . 16307 2 86 . 1 1 45 45 HIS N N 15 122.2 0.1 . 1 . . . . 46 HIS N . 16307 2 87 . 1 1 46 46 GLN H H 1 10.56 0.01 . 1 . . . . 47 GLN H . 16307 2 88 . 1 1 46 46 GLN N N 15 124.8 0.1 . 1 . . . . 47 GLN N . 16307 2 89 . 1 1 47 47 LYS H H 1 9.72 0.01 . 1 . . . . 48 LYS H . 16307 2 90 . 1 1 47 47 LYS N N 15 124.2 0.1 . 1 . . . . 48 LYS N . 16307 2 91 . 1 1 48 48 ASP H H 1 10.09 0.01 . 1 . . . . 49 ASP H . 16307 2 92 . 1 1 48 48 ASP N N 15 126.0 0.1 . 1 . . . . 49 ASP N . 16307 2 93 . 1 1 49 49 PHE H H 1 10.28 0.01 . 1 . . . . 50 PHE H . 16307 2 94 . 1 1 49 49 PHE N N 15 122.0 0.1 . 1 . . . . 50 PHE N . 16307 2 95 . 1 1 50 50 MET H H 1 8.96 0.01 . 1 . . . . 51 MET H . 16307 2 96 . 1 1 50 50 MET N N 15 118.3 0.1 . 1 . . . . 51 MET N . 16307 2 97 . 1 1 51 51 THR H H 1 8.93 0.01 . 1 . . . . 52 THR H . 16307 2 98 . 1 1 51 51 THR N N 15 116.7 0.1 . 1 . . . . 52 THR N . 16307 2 99 . 1 1 52 52 TYR H H 1 8.15 0.01 . 1 . . . . 53 TYR H . 16307 2 100 . 1 1 52 52 TYR N N 15 124.3 0.1 . 1 . . . . 53 TYR N . 16307 2 101 . 1 1 53 53 ALA H H 1 8.28 0.01 . 1 . . . . 54 ALA H . 16307 2 102 . 1 1 53 53 ALA N N 15 120.1 0.1 . 1 . . . . 54 ALA N . 16307 2 103 . 1 1 54 54 PHE H H 1 7.51 0.01 . 1 . . . . 55 PHE H . 16307 2 104 . 1 1 54 54 PHE N N 15 111.0 0.1 . 1 . . . . 55 PHE N . 16307 2 105 . 1 1 55 55 GLY H H 1 7.98 0.01 . 1 . . . . 56 GLY H . 16307 2 106 . 1 1 55 55 GLY N N 15 107.0 0.1 . 1 . . . . 56 GLY N . 16307 2 107 . 1 1 56 56 GLY H H 1 8.37 0.01 . 1 . . . . 57 GLY H . 16307 2 108 . 1 1 56 56 GLY N N 15 113.3 0.1 . 1 . . . . 57 GLY N . 16307 2 109 . 1 1 57 57 THR H H 1 7.57 0.01 . 1 . . . . 58 THR H . 16307 2 110 . 1 1 57 57 THR N N 15 111.1 0.1 . 1 . . . . 58 THR N . 16307 2 111 . 1 1 58 58 ASP H H 1 8.55 0.01 . 1 . . . . 59 ASP H . 16307 2 112 . 1 1 58 58 ASP N N 15 121.4 0.1 . 1 . . . . 59 ASP N . 16307 2 113 . 1 1 59 59 ARG H H 1 7.13 0.01 . 1 . . . . 60 ARG H . 16307 2 114 . 1 1 59 59 ARG N N 15 116.5 0.1 . 1 . . . . 60 ARG N . 16307 2 115 . 1 1 60 60 PHE H H 1 7.36 0.01 . 1 . . . . 61 PHE H . 16307 2 116 . 1 1 60 60 PHE N N 15 118.0 0.1 . 1 . . . . 61 PHE N . 16307 2 117 . 1 1 62 62 GLY H H 1 9.04 0.01 . 1 . . . . 63 GLY H . 16307 2 118 . 1 1 62 62 GLY N N 15 113.0 0.1 . 1 . . . . 63 GLY N . 16307 2 119 . 1 1 63 63 ARG H H 1 9.01 0.02 . 1 . . . . 64 ARG H . 16307 2 120 . 1 1 63 63 ARG N N 15 119.8 0.2 . 1 . . . . 64 ARG N . 16307 2 121 . 1 1 64 64 SER H H 1 7.52 0.01 . 1 . . . . 65 SER H . 16307 2 122 . 1 1 64 64 SER N N 15 115.3 0.1 . 1 . . . . 65 SER N . 16307 2 123 . 1 1 65 65 MET H H 1 8.85 0.01 . 1 . . . . 66 MET H . 16307 2 124 . 1 1 65 65 MET N N 15 123.3 0.1 . 1 . . . . 66 MET N . 16307 2 125 . 1 1 66 66 ARG H H 1 9.72 0.01 . 1 . . . . 67 ARG H . 16307 2 126 . 1 1 66 66 ARG N N 15 124.8 0.1 . 1 . . . . 67 ARG N . 16307 2 127 . 1 1 67 67 ALA H H 1 8.39 0.01 . 1 . . . . 68 ALA H . 16307 2 128 . 1 1 67 67 ALA N N 15 121.7 0.1 . 1 . . . . 68 ALA N . 16307 2 129 . 1 1 68 68 ALA H H 1 9.23 0.01 . 1 . . . . 69 ALA H . 16307 2 130 . 1 1 68 68 ALA N N 15 117.4 0.1 . 1 . . . . 69 ALA N . 16307 2 131 . 1 1 69 69 HIS H H 1 10.45 0.01 . 1 . . . . 70 HIS H . 16307 2 132 . 1 1 69 69 HIS N N 15 114.5 0.1 . 1 . . . . 70 HIS N . 16307 2 133 . 1 1 70 70 GLN H H 1 9.07 0.01 . 1 . . . . 71 GLN H . 16307 2 134 . 1 1 70 70 GLN N N 15 125.3 0.1 . 1 . . . . 71 GLN N . 16307 2 135 . 1 1 71 71 ASP H H 1 9.25 0.01 . 1 . . . . 72 ASP H . 16307 2 136 . 1 1 71 71 ASP N N 15 119.6 0.1 . 1 . . . . 72 ASP N . 16307 2 137 . 1 1 72 72 LEU H H 1 7.91 0.01 . 1 . . . . 73 LEU H . 16307 2 138 . 1 1 72 72 LEU N N 15 118.3 0.1 . 1 . . . . 73 LEU N . 16307 2 139 . 1 1 73 73 VAL H H 1 8.50 0.01 . 1 . . . . 74 VAL H . 16307 2 140 . 1 1 73 73 VAL N N 15 121.1 0.1 . 1 . . . . 74 VAL N . 16307 2 141 . 1 1 74 74 GLU H H 1 8.76 0.01 . 1 . . . . 75 GLU H . 16307 2 142 . 1 1 74 74 GLU N N 15 117.6 0.1 . 1 . . . . 75 GLU N . 16307 2 143 . 1 1 75 75 ASN H H 1 8.63 0.01 . 1 . . . . 76 ASN H . 16307 2 144 . 1 1 75 75 ASN N N 15 112.1 0.1 . 1 . . . . 76 ASN N . 16307 2 145 . 1 1 76 76 ALA H H 1 7.45 0.01 . 1 . . . . 77 ALA H . 16307 2 146 . 1 1 76 76 ALA N N 15 121.4 0.1 . 1 . . . . 77 ALA N . 16307 2 147 . 1 1 77 77 GLY H H 1 7.73 0.01 . 1 . . . . 78 GLY H . 16307 2 148 . 1 1 77 77 GLY N N 15 107.1 0.1 . 1 . . . . 78 GLY N . 16307 2 149 . 1 1 78 78 LEU H H 1 7.35 0.01 . 1 . . . . 79 LEU H . 16307 2 150 . 1 1 78 78 LEU N N 15 120.5 0.1 . 1 . . . . 79 LEU N . 16307 2 151 . 1 1 79 79 THR H H 1 10.82 0.01 . 1 . . . . 80 THR H . 16307 2 152 . 1 1 79 79 THR N N 15 126.4 0.1 . 1 . . . . 80 THR N . 16307 2 153 . 1 1 80 80 ASP H H 1 8.79 0.01 . 1 . . . . 81 ASP H . 16307 2 154 . 1 1 80 80 ASP N N 15 120.9 0.1 . 1 . . . . 81 ASP N . 16307 2 155 . 1 1 81 81 VAL H H 1 7.67 0.01 . 1 . . . . 82 VAL H . 16307 2 156 . 1 1 81 81 VAL N N 15 114.4 0.1 . 1 . . . . 82 VAL N . 16307 2 157 . 1 1 82 82 HIS H H 1 6.56 0.01 . 1 . . . . 83 HIS H . 16307 2 158 . 1 1 82 82 HIS N N 15 121.0 0.1 . 1 . . . . 83 HIS N . 16307 2 159 . 1 1 83 83 PHE H H 1 6.66 0.01 . 1 . . . . 84 PHE H . 16307 2 160 . 1 1 83 83 PHE N N 15 120.3 0.1 . 1 . . . . 84 PHE N . 16307 2 161 . 1 1 84 84 ASP H H 1 8.50 0.01 . 1 . . . . 85 ASP H . 16307 2 162 . 1 1 84 84 ASP N N 15 117.2 0.1 . 1 . . . . 85 ASP N . 16307 2 163 . 1 1 85 85 ALA H H 1 7.36 0.01 . 1 . . . . 86 ALA H . 16307 2 164 . 1 1 85 85 ALA N N 15 121.2 0.1 . 1 . . . . 86 ALA N . 16307 2 165 . 1 1 86 86 ILE H H 1 6.95 0.01 . 1 . . . . 87 ILE H . 16307 2 166 . 1 1 86 86 ILE N N 15 117.1 0.1 . 1 . . . . 87 ILE N . 16307 2 167 . 1 1 87 87 ALA H H 1 7.44 0.01 . 1 . . . . 88 ALA H . 16307 2 168 . 1 1 87 87 ALA N N 15 122.1 0.1 . 1 . . . . 88 ALA N . 16307 2 169 . 1 1 88 88 GLU H H 1 8.45 0.01 . 1 . . . . 89 GLU H . 16307 2 170 . 1 1 88 88 GLU N N 15 119.1 0.1 . 1 . . . . 89 GLU N . 16307 2 171 . 1 1 89 89 ASN H H 1 7.62 0.01 . 1 . . . . 90 ASN H . 16307 2 172 . 1 1 89 89 ASN N N 15 115.4 0.1 . 1 . . . . 90 ASN N . 16307 2 173 . 1 1 90 90 LEU H H 1 7.90 0.01 . 1 . . . . 91 LEU H . 16307 2 174 . 1 1 90 90 LEU N N 15 125.1 0.1 . 1 . . . . 91 LEU N . 16307 2 175 . 1 1 91 91 VAL H H 1 8.13 0.01 . 1 . . . . 92 VAL H . 16307 2 176 . 1 1 91 91 VAL N N 15 121.8 0.1 . 1 . . . . 92 VAL N . 16307 2 177 . 1 1 92 92 LEU H H 1 8.52 0.01 . 1 . . . . 93 LEU H . 16307 2 178 . 1 1 92 92 LEU N N 15 117.7 0.1 . 1 . . . . 93 LEU N . 16307 2 179 . 1 1 93 93 THR H H 1 7.48 0.01 . 1 . . . . 94 THR H . 16307 2 180 . 1 1 93 93 THR N N 15 116.3 0.1 . 1 . . . . 94 THR N . 16307 2 181 . 1 1 94 94 LEU H H 1 8.01 0.01 . 1 . . . . 95 LEU H . 16307 2 182 . 1 1 94 94 LEU N N 15 118.5 0.1 . 1 . . . . 95 LEU N . 16307 2 183 . 1 1 95 95 GLN H H 1 8.55 0.01 . 1 . . . . 96 GLN H . 16307 2 184 . 1 1 95 95 GLN N N 15 118.5 0.1 . 1 . . . . 96 GLN N . 16307 2 185 . 1 1 96 96 GLU H H 1 8.34 0.01 . 1 . . . . 97 GLU H . 16307 2 186 . 1 1 96 96 GLU N N 15 121.4 0.1 . 1 . . . . 97 GLU N . 16307 2 187 . 1 1 97 97 LEU H H 1 7.52 0.01 . 1 . . . . 98 LEU H . 16307 2 188 . 1 1 97 97 LEU N N 15 118.0 0.1 . 1 . . . . 98 LEU N . 16307 2 189 . 1 1 98 98 ASN H H 1 8.08 0.01 . 1 . . . . 99 ASN H . 16307 2 190 . 1 1 98 98 ASN N N 15 115.6 0.1 . 1 . . . . 99 ASN N . 16307 2 191 . 1 1 99 99 VAL H H 1 7.60 0.01 . 1 . . . . 100 VAL H . 16307 2 192 . 1 1 99 99 VAL N N 15 117.9 0.1 . 1 . . . . 100 VAL N . 16307 2 193 . 1 1 100 100 SER H H 1 8.37 0.01 . 1 . . . . 101 SER H . 16307 2 194 . 1 1 100 100 SER N N 15 119.0 0.1 . 1 . . . . 101 SER N . 16307 2 195 . 1 1 101 101 GLN H H 1 8.87 0.01 . 1 . . . . 102 GLN H . 16307 2 196 . 1 1 101 101 GLN N N 15 125.5 0.1 . 1 . . . . 102 GLN N . 16307 2 197 . 1 1 102 102 ASP H H 1 8.32 0.01 . 1 . . . . 103 ASP H . 16307 2 198 . 1 1 102 102 ASP N N 15 115.9 0.1 . 1 . . . . 103 ASP N . 16307 2 199 . 1 1 103 103 LEU H H 1 7.28 0.01 . 1 . . . . 104 LEU H . 16307 2 200 . 1 1 103 103 LEU N N 15 120.7 0.1 . 1 . . . . 104 LEU N . 16307 2 201 . 1 1 104 104 ILE H H 1 7.49 0.01 . 1 . . . . 105 ILE H . 16307 2 202 . 1 1 104 104 ILE N N 15 120.0 0.1 . 1 . . . . 105 ILE N . 16307 2 203 . 1 1 105 105 ASP H H 1 8.77 0.01 . 1 . . . . 106 ASP H . 16307 2 204 . 1 1 105 105 ASP N N 15 118.5 0.1 . 1 . . . . 106 ASP N . 16307 2 205 . 1 1 106 106 GLU H H 1 7.33 0.01 . 1 . . . . 107 GLU H . 16307 2 206 . 1 1 106 106 GLU N N 15 120.8 0.1 . 1 . . . . 107 GLU N . 16307 2 207 . 1 1 107 107 VAL H H 1 7.50 0.01 . 1 . . . . 108 VAL H . 16307 2 208 . 1 1 107 107 VAL N N 15 121.6 0.1 . 1 . . . . 108 VAL N . 16307 2 209 . 1 1 108 108 VAL H H 1 8.45 0.02 . 1 . . . . 109 VAL H . 16307 2 210 . 1 1 108 108 VAL N N 15 119.9 0.2 . 1 . . . . 109 VAL N . 16307 2 211 . 1 1 109 109 THR H H 1 7.74 0.01 . 1 . . . . 110 THR H . 16307 2 212 . 1 1 109 109 THR N N 15 116.0 0.1 . 1 . . . . 110 THR N . 16307 2 213 . 1 1 110 110 ILE H H 1 7.48 0.01 . 1 . . . . 111 ILE H . 16307 2 214 . 1 1 110 110 ILE N N 15 122.1 0.1 . 1 . . . . 111 ILE N . 16307 2 215 . 1 1 111 111 VAL H H 1 8.47 0.01 . 1 . . . . 112 VAL H . 16307 2 216 . 1 1 111 111 VAL N N 15 111.4 0.1 . 1 . . . . 112 VAL N . 16307 2 217 . 1 1 112 112 GLY H H 1 7.76 0.01 . 1 . . . . 113 GLY H . 16307 2 218 . 1 1 112 112 GLY N N 15 106.9 0.1 . 1 . . . . 113 GLY N . 16307 2 219 . 1 1 113 113 SER H H 1 7.25 0.01 . 1 . . . . 114 SER H . 16307 2 220 . 1 1 113 113 SER N N 15 115.8 0.1 . 1 . . . . 114 SER N . 16307 2 221 . 1 1 114 114 VAL H H 1 8.72 0.01 . 1 . . . . 115 VAL H . 16307 2 222 . 1 1 114 114 VAL N N 15 127.8 0.1 . 1 . . . . 115 VAL N . 16307 2 223 . 1 1 115 115 GLN H H 1 8.37 0.01 . 1 . . . . 116 GLN H . 16307 2 224 . 1 1 115 115 GLN N N 15 118.6 0.1 . 1 . . . . 116 GLN N . 16307 2 225 . 1 1 116 116 HIS H H 1 7.43 0.01 . 1 . . . . 117 HIS H . 16307 2 226 . 1 1 116 116 HIS N N 15 116.3 0.1 . 1 . . . . 117 HIS N . 16307 2 227 . 1 1 117 117 ARG H H 1 7.52 0.01 . 1 . . . . 118 ARG H . 16307 2 228 . 1 1 117 117 ARG N N 15 117.3 0.1 . 1 . . . . 118 ARG N . 16307 2 229 . 1 1 118 118 ASN H H 1 7.88 0.01 . 1 . . . . 119 ASN H . 16307 2 230 . 1 1 118 118 ASN N N 15 116.9 0.1 . 1 . . . . 119 ASN N . 16307 2 231 . 1 1 119 119 ASP H H 1 8.40 0.01 . 1 . . . . 120 ASP H . 16307 2 232 . 1 1 119 119 ASP N N 15 118.4 0.1 . 1 . . . . 120 ASP N . 16307 2 233 . 1 1 120 120 VAL H H 1 9.06 0.01 . 1 . . . . 121 VAL H . 16307 2 234 . 1 1 120 120 VAL N N 15 121.3 0.1 . 1 . . . . 121 VAL N . 16307 2 235 . 1 1 121 121 LEU H H 1 8.52 0.01 . 1 . . . . 122 LEU H . 16307 2 236 . 1 1 121 121 LEU N N 15 111.4 0.1 . 1 . . . . 122 LEU N . 16307 2 237 . 1 1 122 122 ASN H H 1 9.05 0.01 . 1 . . . . 123 ASN H . 16307 2 238 . 1 1 122 122 ASN N N 15 118.4 0.1 . 1 . . . . 123 ASN N . 16307 2 239 . 1 1 123 123 ARG H H 1 9.01 0.01 . 1 . . . . 124 ARG H . 16307 2 240 . 1 1 123 123 ARG N N 15 123.7 0.1 . 1 . . . . 124 ARG N . 16307 2 stop_ save_