################################### # 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 17882 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 DQFCOSY . . . 17882 1 2 TOCSY . . . 17882 1 3 NOESY . . . 17882 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 LYS HA H 1 4.082 0.000 . 1 . . . A 1 LYS HA . 17882 1 2 . 1 1 1 1 LYS HB2 H 1 1.166 0.000 . 2 . . . A 1 LYS HB2 . 17882 1 3 . 1 1 1 1 LYS HB3 H 1 1.730 0.000 . 2 . . . A 1 LYS HB3 . 17882 1 4 . 1 1 1 1 LYS HG2 H 1 0.978 0.000 . 2 . . . A 1 LYS QG . 17882 1 5 . 1 1 1 1 LYS HG3 H 1 0.978 0.000 . 2 . . . A 1 LYS QG . 17882 1 6 . 1 1 1 1 LYS HD2 H 1 1.559 0.000 . 2 . . . A 1 LYS QD . 17882 1 7 . 1 1 1 1 LYS HD3 H 1 1.559 0.000 . 2 . . . A 1 LYS QD . 17882 1 8 . 1 1 2 2 GLU H H 1 7.952 0.002 . 1 . . . A 2 GLU H . 17882 1 9 . 1 1 2 2 GLU HA H 1 4.584 0.008 . 1 . . . A 2 GLU HA . 17882 1 10 . 1 1 2 2 GLU HB2 H 1 2.129 0.004 . 2 . . . A 2 GLU HB2 . 17882 1 11 . 1 1 2 2 GLU HB3 H 1 1.852 0.007 . 2 . . . A 2 GLU HB3 . 17882 1 12 . 1 1 2 2 GLU HG2 H 1 2.213 0.004 . 2 . . . A 2 GLU HG2 . 17882 1 13 . 1 1 2 2 GLU HG3 H 1 2.325 0.001 . 2 . . . A 2 GLU HG3 . 17882 1 14 . 1 1 3 3 GLY H H 1 7.196 0.004 . 1 . . . A 3 GLY H . 17882 1 15 . 1 1 3 3 GLY HA2 H 1 1.779 0.001 . 2 . . . A 3 GLY HA2 . 17882 1 16 . 1 1 3 3 GLY HA3 H 1 3.354 0.007 . 2 . . . A 3 GLY HA3 . 17882 1 17 . 1 1 4 4 TYR H H 1 9.143 0.005 . 1 . . . A 4 TYR H . 17882 1 18 . 1 1 4 4 TYR HA H 1 4.936 0.010 . 1 . . . A 4 TYR HA . 17882 1 19 . 1 1 4 4 TYR HB2 H 1 3.161 0.000 . 2 . . . A 4 TYR HB2 . 17882 1 20 . 1 1 4 4 TYR HB3 H 1 3.038 0.008 . 2 . . . A 4 TYR HB3 . 17882 1 21 . 1 1 4 4 TYR HD1 H 1 7.586 0.008 . 3 . . . A 4 TYR HD1 . 17882 1 22 . 1 1 4 4 TYR HD2 H 1 7.586 0.008 . 3 . . . A 4 TYR HD2 . 17882 1 23 . 1 1 4 4 TYR HE1 H 1 7.338 0.007 . 3 . . . A 4 TYR HE1 . 17882 1 24 . 1 1 4 4 TYR HE2 H 1 7.338 0.007 . 3 . . . A 4 TYR HE2 . 17882 1 25 . 1 1 5 5 LEU H H 1 7.686 0.002 . 1 . . . A 5 LEU H . 17882 1 26 . 1 1 5 5 LEU HA H 1 4.602 0.008 . 1 . . . A 5 LEU HA . 17882 1 27 . 1 1 5 5 LEU HB2 H 1 1.837 0.004 . 2 . . . A 5 LEU HB2 . 17882 1 28 . 1 1 5 5 LEU HB3 H 1 1.683 0.005 . 2 . . . A 5 LEU HB3 . 17882 1 29 . 1 1 5 5 LEU HG H 1 1.373 0.003 . 1 . . . A 5 LEU HG . 17882 1 30 . 1 1 5 5 LEU HD11 H 1 0.077 0.003 . . . . . A 5 LEU QD1 . 17882 1 31 . 1 1 5 5 LEU HD12 H 1 0.077 0.003 . . . . . A 5 LEU QD1 . 17882 1 32 . 1 1 5 5 LEU HD13 H 1 0.077 0.003 . . . . . A 5 LEU QD1 . 17882 1 33 . 1 1 5 5 LEU HD21 H 1 0.609 0.002 . . . . . A 5 LEU QD2 . 17882 1 34 . 1 1 5 5 LEU HD22 H 1 0.609 0.002 . . . . . A 5 LEU QD2 . 17882 1 35 . 1 1 5 5 LEU HD23 H 1 0.609 0.002 . . . . . A 5 LEU QD2 . 17882 1 36 . 1 1 6 6 VAL H H 1 7.065 0.010 . 1 . . . A 6 VAL H . 17882 1 37 . 1 1 6 6 VAL HA H 1 5.219 0.004 . 1 . . . A 6 VAL HA . 17882 1 38 . 1 1 6 6 VAL HB H 1 2.053 0.003 . 1 . . . A 6 VAL HB . 17882 1 39 . 1 1 6 6 VAL HG11 H 1 0.773 0.001 . . . . . A 6 VAL QG1 . 17882 1 40 . 1 1 6 6 VAL HG12 H 1 0.773 0.001 . . . . . A 6 VAL QG1 . 17882 1 41 . 1 1 6 6 VAL HG13 H 1 0.773 0.001 . . . . . A 6 VAL QG1 . 17882 1 42 . 1 1 6 6 VAL HG21 H 1 1.100 0.004 . . . . . A 6 VAL QG2 . 17882 1 43 . 1 1 6 6 VAL HG22 H 1 1.100 0.004 . . . . . A 6 VAL QG2 . 17882 1 44 . 1 1 6 6 VAL HG23 H 1 1.100 0.004 . . . . . A 6 VAL QG2 . 17882 1 45 . 1 1 7 7 SER H H 1 8.326 0.003 . 1 . . . A 7 SER H . 17882 1 46 . 1 1 7 7 SER HA H 1 4.877 0.003 . 1 . . . A 7 SER HA . 17882 1 47 . 1 1 7 7 SER HB2 H 1 3.991 0.003 . 2 . . . A 7 SER HB2 . 17882 1 48 . 1 1 7 7 SER HB3 H 1 4.045 0.001 . 2 . . . A 7 SER HB3 . 17882 1 49 . 1 1 8 8 LYS H H 1 9.237 0.003 . 1 . . . A 8 LYS H . 17882 1 50 . 1 1 8 8 LYS HA H 1 4.077 0.006 . 1 . . . A 8 LYS HA . 17882 1 51 . 1 1 8 8 LYS HB2 H 1 1.852 0.007 . 2 . . . A 8 LYS HB2 . 17882 1 52 . 1 1 8 8 LYS HB3 H 1 1.940 0.004 . 2 . . . A 8 LYS HB3 . 17882 1 53 . 1 1 8 8 LYS HG2 H 1 1.463 0.010 . 2 . . . A 8 LYS HG2 . 17882 1 54 . 1 1 8 8 LYS HG3 H 1 1.669 0.001 . 2 . . . A 8 LYS HG3 . 17882 1 55 . 1 1 8 8 LYS HD2 H 1 1.769 0.003 . 2 . . . A 8 LYS QD . 17882 1 56 . 1 1 8 8 LYS HD3 H 1 1.769 0.003 . 2 . . . A 8 LYS QD . 17882 1 57 . 1 1 9 9 SER H H 1 8.019 0.001 . 1 . . . A 9 SER H . 17882 1 58 . 1 1 9 9 SER HA H 1 4.442 0.001 . 1 . . . A 9 SER HA . 17882 1 59 . 1 1 9 9 SER HB2 H 1 3.860 0.001 . 2 . . . A 9 SER QB . 17882 1 60 . 1 1 9 9 SER HB3 H 1 3.860 0.001 . 2 . . . A 9 SER QB . 17882 1 61 . 1 1 10 10 THR H H 1 7.628 0.005 . 1 . . . A 10 THR H . 17882 1 62 . 1 1 10 10 THR HA H 1 4.529 0.000 . 1 . . . A 10 THR HA . 17882 1 63 . 1 1 10 10 THR HB H 1 4.112 0.009 . 1 . . . A 10 THR HB . 17882 1 64 . 1 1 10 10 THR HG21 H 1 1.183 0.002 . . . . . A 10 THR QG2 . 17882 1 65 . 1 1 10 10 THR HG22 H 1 1.183 0.002 . . . . . A 10 THR QG2 . 17882 1 66 . 1 1 10 10 THR HG23 H 1 1.183 0.002 . . . . . A 10 THR QG2 . 17882 1 67 . 1 1 11 11 GLY H H 1 8.414 0.004 . 1 . . . A 11 GLY H . 17882 1 68 . 1 1 11 11 GLY HA2 H 1 3.691 0.004 . 2 . . . A 11 GLY HA2 . 17882 1 69 . 1 1 11 11 GLY HA3 H 1 4.196 0.010 . 2 . . . A 11 GLY HA3 . 17882 1 70 . 1 1 12 12 CYS H H 1 8.094 0.004 . 1 . . . A 12 CYS H . 17882 1 71 . 1 1 12 12 CYS HA H 1 4.979 0.008 . 1 . . . A 12 CYS HA . 17882 1 72 . 1 1 12 12 CYS HB2 H 1 2.833 0.013 . 2 . . . A 12 CYS HB2 . 17882 1 73 . 1 1 12 12 CYS HB3 H 1 3.547 0.005 . 2 . . . A 12 CYS HB3 . 17882 1 74 . 1 1 13 13 LYS H H 1 8.301 0.005 . 1 . . . A 13 LYS H . 17882 1 75 . 1 1 13 13 LYS HA H 1 4.583 0.010 . 1 . . . A 13 LYS HA . 17882 1 76 . 1 1 13 13 LYS HB2 H 1 1.769 0.008 . 2 . . . A 13 LYS HB2 . 17882 1 77 . 1 1 13 13 LYS HB3 H 1 1.835 0.005 . 2 . . . A 13 LYS HB3 . 17882 1 78 . 1 1 13 13 LYS HG2 H 1 1.569 0.009 . 2 . . . A 13 LYS QG . 17882 1 79 . 1 1 13 13 LYS HG3 H 1 1.569 0.009 . 2 . . . A 13 LYS QG . 17882 1 80 . 1 1 13 13 LYS HD2 H 1 1.684 0.004 . 2 . . . A 13 LYS QD . 17882 1 81 . 1 1 13 13 LYS HD3 H 1 1.684 0.004 . 2 . . . A 13 LYS QD . 17882 1 82 . 1 1 13 13 LYS HE2 H 1 2.864 0.002 . 2 . . . A 13 LYS QE . 17882 1 83 . 1 1 13 13 LYS HE3 H 1 2.864 0.002 . 2 . . . A 13 LYS QE . 17882 1 84 . 1 1 14 14 TYR H H 1 9.277 0.000 . 1 . . . A 14 TYR H . 17882 1 85 . 1 1 14 14 TYR HA H 1 4.701 0.001 . 1 . . . A 14 TYR HA . 17882 1 86 . 1 1 14 14 TYR HB2 H 1 2.864 0.000 . 2 . . . A 14 TYR QB . 17882 1 87 . 1 1 14 14 TYR HB3 H 1 2.864 0.000 . 2 . . . A 14 TYR QB . 17882 1 88 . 1 1 14 14 TYR HD1 H 1 7.052 0.000 . 3 . . . A 14 TYR HD1 . 17882 1 89 . 1 1 14 14 TYR HD2 H 1 7.052 0.000 . 3 . . . A 14 TYR HD2 . 17882 1 90 . 1 1 15 15 GLU H H 1 8.299 0.002 . 1 . . . A 15 GLU H . 17882 1 91 . 1 1 15 15 GLU HA H 1 4.658 0.001 . 1 . . . A 15 GLU HA . 17882 1 92 . 1 1 15 15 GLU HB2 H 1 2.017 0.005 . 2 . . . A 15 GLU HB2 . 17882 1 93 . 1 1 15 15 GLU HG2 H 1 2.286 0.007 . 2 . . . A 15 GLU HG2 . 17882 1 94 . 1 1 15 15 GLU HG3 H 1 2.389 0.005 . 2 . . . A 15 GLU HG3 . 17882 1 95 . 1 1 16 16 CYS H H 1 8.164 0.003 . 1 . . . A 16 CYS H . 17882 1 96 . 1 1 16 16 CYS HA H 1 4.827 0.001 . 1 . . . A 16 CYS HA . 17882 1 97 . 1 1 16 16 CYS HB2 H 1 3.179 0.010 . 2 . . . A 16 CYS HB2 . 17882 1 98 . 1 1 16 16 CYS HB3 H 1 3.301 0.002 . 2 . . . A 16 CYS HB3 . 17882 1 99 . 1 1 17 17 LEU H H 1 8.495 0.007 . 1 . . . A 17 LEU H . 17882 1 100 . 1 1 17 17 LEU HB2 H 1 1.662 0.011 . 2 . . . A 17 LEU QB . 17882 1 101 . 1 1 17 17 LEU HB3 H 1 1.662 0.011 . 2 . . . A 17 LEU QB . 17882 1 102 . 1 1 17 17 LEU HG H 1 1.558 0.006 . 1 . . . A 17 LEU HG . 17882 1 103 . 1 1 17 17 LEU HD11 H 1 0.815 0.007 . . . . . A 17 LEU QD1 . 17882 1 104 . 1 1 17 17 LEU HD12 H 1 0.815 0.007 . . . . . A 17 LEU QD1 . 17882 1 105 . 1 1 17 17 LEU HD13 H 1 0.815 0.007 . . . . . A 17 LEU QD1 . 17882 1 106 . 1 1 17 17 LEU HD21 H 1 0.854 0.005 . . . . . A 17 LEU QD2 . 17882 1 107 . 1 1 17 17 LEU HD22 H 1 0.854 0.005 . . . . . A 17 LEU QD2 . 17882 1 108 . 1 1 17 17 LEU HD23 H 1 0.854 0.005 . . . . . A 17 LEU QD2 . 17882 1 109 . 1 1 18 18 LYS H H 1 8.450 0.011 . 1 . . . A 18 LYS H . 17882 1 110 . 1 1 18 18 LYS HB2 H 1 1.766 0.010 . 2 . . . A 18 LYS HB2 . 17882 1 111 . 1 1 18 18 LYS HB3 H 1 1.847 0.006 . 2 . . . A 18 LYS HB3 . 17882 1 112 . 1 1 18 18 LYS HG2 H 1 1.538 0.013 . 2 . . . A 18 LYS QG . 17882 1 113 . 1 1 18 18 LYS HG3 H 1 1.538 0.013 . 2 . . . A 18 LYS QG . 17882 1 114 . 1 1 19 19 LEU H H 1 8.235 0.002 . 1 . . . A 19 LEU H . 17882 1 115 . 1 1 19 19 LEU HA H 1 3.637 0.008 . 1 . . . A 19 LEU HA . 17882 1 116 . 1 1 19 19 LEU HB2 H 1 1.465 0.003 . 2 . . . A 19 LEU HB2 . 17882 1 117 . 1 1 19 19 LEU HB3 H 1 1.707 0.008 . 2 . . . A 19 LEU HB3 . 17882 1 118 . 1 1 19 19 LEU HG H 1 1.369 0.004 . 1 . . . A 19 LEU HG . 17882 1 119 . 1 1 19 19 LEU HD11 H 1 0.082 0.005 . . . . . A 19 LEU QD1 . 17882 1 120 . 1 1 19 19 LEU HD12 H 1 0.082 0.005 . . . . . A 19 LEU QD1 . 17882 1 121 . 1 1 19 19 LEU HD13 H 1 0.082 0.005 . . . . . A 19 LEU QD1 . 17882 1 122 . 1 1 19 19 LEU HD21 H 1 0.705 0.003 . . . . . A 19 LEU QD2 . 17882 1 123 . 1 1 19 19 LEU HD22 H 1 0.705 0.003 . . . . . A 19 LEU QD2 . 17882 1 124 . 1 1 19 19 LEU HD23 H 1 0.705 0.003 . . . . . A 19 LEU QD2 . 17882 1 125 . 1 1 20 20 GLY H H 1 9.046 0.006 . 1 . . . A 20 GLY H . 17882 1 126 . 1 1 20 20 GLY HA2 H 1 3.611 0.002 . 2 . . . A 20 GLY HA2 . 17882 1 127 . 1 1 20 20 GLY HA3 H 1 4.324 0.006 . 2 . . . A 20 GLY HA3 . 17882 1 128 . 1 1 21 21 ASP H H 1 8.512 0.002 . 1 . . . A 21 ASP H . 17882 1 129 . 1 1 21 21 ASP HA H 1 4.625 0.008 . 1 . . . A 21 ASP HA . 17882 1 130 . 1 1 21 21 ASP HB2 H 1 2.645 0.006 . 2 . . . A 21 ASP HB2 . 17882 1 131 . 1 1 21 21 ASP HB3 H 1 2.743 0.005 . 2 . . . A 21 ASP HB3 . 17882 1 132 . 1 1 22 22 ASN H H 1 9.113 0.004 . 1 . . . A 22 ASN H . 17882 1 133 . 1 1 22 22 ASN HA H 1 4.840 0.005 . 1 . . . A 22 ASN HA . 17882 1 134 . 1 1 22 22 ASN HB2 H 1 2.626 0.001 . 2 . . . A 22 ASN HB2 . 17882 1 135 . 1 1 22 22 ASN HB3 H 1 2.995 0.000 . 2 . . . A 22 ASN HB3 . 17882 1 136 . 1 1 23 23 ASP H H 1 9.011 0.002 . 1 . . . A 23 ASP H . 17882 1 137 . 1 1 23 23 ASP HA H 1 4.522 0.003 . 1 . . . A 23 ASP HA . 17882 1 138 . 1 1 23 23 ASP HB2 H 1 2.758 0.003 . 2 . . . A 23 ASP QB . 17882 1 139 . 1 1 23 23 ASP HB3 H 1 2.758 0.003 . 2 . . . A 23 ASP QB . 17882 1 140 . 1 1 24 24 TYR H H 1 8.046 0.002 . 1 . . . A 24 TYR H . 17882 1 141 . 1 1 24 24 TYR HA H 1 4.330 0.007 . 1 . . . A 24 TYR HA . 17882 1 142 . 1 1 24 24 TYR HB2 H 1 3.253 0.003 . 2 . . . A 24 TYR HB2 . 17882 1 143 . 1 1 24 24 TYR HB3 H 1 3.431 0.002 . 2 . . . A 24 TYR HB3 . 17882 1 144 . 1 1 24 24 TYR HD1 H 1 7.103 0.005 . 3 . . . A 24 TYR HD1 . 17882 1 145 . 1 1 24 24 TYR HD2 H 1 7.098 0.004 . 3 . . . A 24 TYR HD2 . 17882 1 146 . 1 1 24 24 TYR HE2 H 1 6.865 0.004 . 3 . . . A 24 TYR HE2 . 17882 1 147 . 1 1 25 25 CYS H H 1 8.202 0.004 . 1 . . . A 25 CYS H . 17882 1 148 . 1 1 25 25 CYS HA H 1 4.215 0.009 . 1 . . . A 25 CYS HA . 17882 1 149 . 1 1 25 25 CYS HB2 H 1 2.459 0.003 . 2 . . . A 25 CYS HB2 . 17882 1 150 . 1 1 25 25 CYS HB3 H 1 2.713 0.007 . 2 . . . A 25 CYS HB3 . 17882 1 151 . 1 1 26 26 LEU H H 1 8.233 0.005 . 1 . . . A 26 LEU H . 17882 1 152 . 1 1 26 26 LEU HA H 1 3.715 0.009 . 1 . . . A 26 LEU HA . 17882 1 153 . 1 1 26 26 LEU HB2 H 1 1.729 0.003 . 2 . . . A 26 LEU HB2 . 17882 1 154 . 1 1 26 26 LEU HB3 H 1 2.031 0.006 . 2 . . . A 26 LEU HB3 . 17882 1 155 . 1 1 26 26 LEU HG H 1 1.546 0.003 . 1 . . . A 26 LEU HG . 17882 1 156 . 1 1 26 26 LEU HD11 H 1 1.049 0.006 . . . . . A 26 LEU QD1 . 17882 1 157 . 1 1 26 26 LEU HD12 H 1 1.049 0.006 . . . . . A 26 LEU QD1 . 17882 1 158 . 1 1 26 26 LEU HD13 H 1 1.049 0.006 . . . . . A 26 LEU QD1 . 17882 1 159 . 1 1 26 26 LEU HD21 H 1 1.165 0.009 . . . . . A 26 LEU QD2 . 17882 1 160 . 1 1 26 26 LEU HD22 H 1 1.165 0.009 . . . . . A 26 LEU QD2 . 17882 1 161 . 1 1 26 26 LEU HD23 H 1 1.165 0.009 . . . . . A 26 LEU QD2 . 17882 1 162 . 1 1 27 27 ARG H H 1 8.004 0.002 . 1 . . . A 27 ARG H . 17882 1 163 . 1 1 27 27 ARG HA H 1 3.868 0.004 . 1 . . . A 27 ARG HA . 17882 1 164 . 1 1 27 27 ARG HB2 H 1 1.851 0.003 . 2 . . . A 27 ARG HB2 . 17882 1 165 . 1 1 27 27 ARG HB3 H 1 1.971 0.002 . 2 . . . A 27 ARG HB3 . 17882 1 166 . 1 1 27 27 ARG HG2 H 1 1.560 0.001 . 2 . . . A 27 ARG HG2 . 17882 1 167 . 1 1 27 27 ARG HG3 H 1 1.793 0.011 . 2 . . . A 27 ARG HG3 . 17882 1 168 . 1 1 27 27 ARG HD2 H 1 3.216 0.006 . 2 . . . A 27 ARG QD . 17882 1 169 . 1 1 27 27 ARG HD3 H 1 3.216 0.006 . 2 . . . A 27 ARG QD . 17882 1 170 . 1 1 28 28 GLU H H 1 8.338 0.002 . 1 . . . A 28 GLU H . 17882 1 171 . 1 1 28 28 GLU HA H 1 3.866 0.011 . 1 . . . A 28 GLU HA . 17882 1 172 . 1 1 28 28 GLU HB2 H 1 1.425 0.002 . 2 . . . A 28 GLU HB2 . 17882 1 173 . 1 1 28 28 GLU HB3 H 1 1.661 0.003 . 2 . . . A 28 GLU HB3 . 17882 1 174 . 1 1 28 28 GLU HG3 H 1 1.940 0.000 . 2 . . . A 28 GLU HG3 . 17882 1 175 . 1 1 29 29 CYS H H 1 8.662 0.003 . 1 . . . A 29 CYS H . 17882 1 176 . 1 1 29 29 CYS HA H 1 4.338 0.004 . 1 . . . A 29 CYS HA . 17882 1 177 . 1 1 29 29 CYS HB2 H 1 2.926 0.006 . 2 . . . A 29 CYS HB2 . 17882 1 178 . 1 1 30 30 LYS H H 1 7.952 0.002 . 1 . . . A 30 LYS H . 17882 1 179 . 1 1 30 30 LYS HB2 H 1 1.816 0.008 . 2 . . . A 30 LYS HB2 . 17882 1 180 . 1 1 30 30 LYS HD2 H 1 1.701 0.000 . 2 . . . A 30 LYS QD . 17882 1 181 . 1 1 30 30 LYS HD3 H 1 1.701 0.000 . 2 . . . A 30 LYS QD . 17882 1 182 . 1 1 31 31 GLN H H 1 8.240 0.006 . 1 . . . A 31 GLN H . 17882 1 183 . 1 1 31 31 GLN HA H 1 3.903 0.002 . 1 . . . A 31 GLN HA . 17882 1 184 . 1 1 31 31 GLN HB2 H 1 2.342 0.012 . 2 . . . A 31 GLN HB2 . 17882 1 185 . 1 1 31 31 GLN HB3 H 1 2.392 0.002 . 2 . . . A 31 GLN HB3 . 17882 1 186 . 1 1 31 31 GLN HG2 H 1 2.078 0.004 . 2 . . . A 31 GLN HG2 . 17882 1 187 . 1 1 31 31 GLN HG3 H 1 2.109 0.012 . 2 . . . A 31 GLN HG3 . 17882 1 188 . 1 1 32 32 GLN H H 1 7.605 0.002 . 1 . . . A 32 GLN H . 17882 1 189 . 1 1 32 32 GLN HA H 1 4.109 0.000 . 1 . . . A 32 GLN HA . 17882 1 190 . 1 1 32 32 GLN HB2 H 1 1.275 0.000 . 2 . . . A 32 GLN HB2 . 17882 1 191 . 1 1 32 32 GLN HB3 H 1 1.616 0.001 . 2 . . . A 32 GLN HB3 . 17882 1 192 . 1 1 32 32 GLN HG2 H 1 1.638 0.002 . 2 . . . A 32 GLN HG2 . 17882 1 193 . 1 1 32 32 GLN HG3 H 1 1.697 0.002 . 2 . . . A 32 GLN HG3 . 17882 1 194 . 1 1 33 33 TYR H H 1 8.270 0.005 . 1 . . . A 33 TYR H . 17882 1 195 . 1 1 33 33 TYR HA H 1 4.958 0.010 . 1 . . . A 33 TYR HA . 17882 1 196 . 1 1 33 33 TYR HB2 H 1 3.018 0.002 . 2 . . . A 33 TYR HB2 . 17882 1 197 . 1 1 33 33 TYR HB3 H 1 3.294 0.010 . 2 . . . A 33 TYR HB3 . 17882 1 198 . 1 1 33 33 TYR HD1 H 1 7.232 0.006 . 3 . . . A 33 TYR HD1 . 17882 1 199 . 1 1 33 33 TYR HD2 H 1 7.232 0.006 . 3 . . . A 33 TYR HD2 . 17882 1 200 . 1 1 34 34 GLY H H 1 7.731 0.001 . 1 . . . A 34 GLY H . 17882 1 201 . 1 1 34 34 GLY HA2 H 1 3.925 0.001 . 2 . . . A 34 GLY HA2 . 17882 1 202 . 1 1 34 34 GLY HA3 H 1 4.936 0.000 . 2 . . . A 34 GLY HA3 . 17882 1 203 . 1 1 35 35 LYS H H 1 8.607 0.002 . 1 . . . A 35 LYS H . 17882 1 204 . 1 1 35 35 LYS HA H 1 3.890 0.005 . 1 . . . A 35 LYS HA . 17882 1 205 . 1 1 35 35 LYS HB2 H 1 1.953 0.003 . 2 . . . A 35 LYS QB . 17882 1 206 . 1 1 35 35 LYS HB3 H 1 1.953 0.003 . 2 . . . A 35 LYS QB . 17882 1 207 . 1 1 35 35 LYS HG2 H 1 1.538 0.007 . 2 . . . A 35 LYS QG . 17882 1 208 . 1 1 35 35 LYS HG3 H 1 1.538 0.007 . 2 . . . A 35 LYS QG . 17882 1 209 . 1 1 35 35 LYS HD2 H 1 1.708 0.011 . 2 . . . A 35 LYS QD . 17882 1 210 . 1 1 35 35 LYS HD3 H 1 1.708 0.011 . 2 . . . A 35 LYS QD . 17882 1 211 . 1 1 35 35 LYS HE2 H 1 3.011 0.009 . 2 . . . A 35 LYS QE . 17882 1 212 . 1 1 35 35 LYS HE3 H 1 3.011 0.009 . 2 . . . A 35 LYS QE . 17882 1 213 . 1 1 36 36 SER H H 1 8.437 0.004 . 1 . . . A 36 SER H . 17882 1 214 . 1 1 36 36 SER HA H 1 4.490 0.002 . 1 . . . A 36 SER HA . 17882 1 215 . 1 1 36 36 SER HB2 H 1 3.935 0.001 . 2 . . . A 36 SER HB2 . 17882 1 216 . 1 1 36 36 SER HB3 H 1 4.024 0.005 . 2 . . . A 36 SER HB3 . 17882 1 217 . 1 1 37 37 SER H H 1 7.873 0.002 . 1 . . . A 37 SER H . 17882 1 218 . 1 1 37 37 SER HA H 1 4.637 0.008 . 1 . . . A 37 SER HA . 17882 1 219 . 1 1 37 37 SER HB2 H 1 3.614 0.003 . 2 . . . A 37 SER HB2 . 17882 1 220 . 1 1 37 37 SER HB3 H 1 3.947 0.008 . 2 . . . A 37 SER HB3 . 17882 1 221 . 1 1 38 38 GLY H H 1 7.872 0.004 . 1 . . . A 38 GLY H . 17882 1 222 . 1 1 38 38 GLY HA2 H 1 3.556 0.010 . 2 . . . A 38 GLY HA2 . 17882 1 223 . 1 1 38 38 GLY HA3 H 1 4.549 0.005 . 2 . . . A 38 GLY HA3 . 17882 1 224 . 1 1 39 39 GLY H H 1 7.917 0.004 . 1 . . . A 39 GLY H . 17882 1 225 . 1 1 39 39 GLY HA2 H 1 4.891 0.011 . 2 . . . A 39 GLY HA2 . 17882 1 226 . 1 1 40 40 TYR H H 1 8.940 0.003 . 1 . . . A 40 TYR H . 17882 1 227 . 1 1 40 40 TYR HA H 1 4.828 0.007 . 1 . . . A 40 TYR HA . 17882 1 228 . 1 1 40 40 TYR HB2 H 1 3.269 0.007 . 2 . . . A 40 TYR HB2 . 17882 1 229 . 1 1 40 40 TYR HB3 H 1 3.072 0.009 . 2 . . . A 40 TYR HB3 . 17882 1 230 . 1 1 40 40 TYR HD1 H 1 6.855 0.008 . 3 . . . A 40 TYR HD1 . 17882 1 231 . 1 1 40 40 TYR HD2 H 1 6.855 0.008 . 3 . . . A 40 TYR HD2 . 17882 1 232 . 1 1 40 40 TYR HE1 H 1 6.545 0.002 . 3 . . . A 40 TYR HE1 . 17882 1 233 . 1 1 40 40 TYR HE2 H 1 6.545 0.002 . 3 . . . A 40 TYR HE2 . 17882 1 234 . 1 1 41 41 CYS H H 1 9.285 0.005 . 1 . . . A 41 CYS H . 17882 1 235 . 1 1 41 41 CYS HA H 1 5.205 0.002 . 1 . . . A 41 CYS HA . 17882 1 236 . 1 1 41 41 CYS HB2 H 1 2.962 0.012 . 2 . . . A 41 CYS HB2 . 17882 1 237 . 1 1 41 41 CYS HB3 H 1 3.892 0.005 . 2 . . . A 41 CYS HB3 . 17882 1 238 . 1 1 42 42 TYR H H 1 9.410 0.005 . 1 . . . A 42 TYR H . 17882 1 239 . 1 1 42 42 TYR HA H 1 4.944 0.003 . 1 . . . A 42 TYR HA . 17882 1 240 . 1 1 42 42 TYR HB2 H 1 2.722 0.007 . 2 . . . A 42 TYR HB2 . 17882 1 241 . 1 1 42 42 TYR HB3 H 1 2.923 0.011 . 2 . . . A 42 TYR HB3 . 17882 1 242 . 1 1 42 42 TYR HD1 H 1 6.542 0.005 . 3 . . . A 42 TYR HD1 . 17882 1 243 . 1 1 42 42 TYR HD2 H 1 6.542 0.005 . 3 . . . A 42 TYR HD2 . 17882 1 244 . 1 1 42 42 TYR HE1 H 1 6.161 0.001 . 3 . . . A 42 TYR HE1 . 17882 1 245 . 1 1 42 42 TYR HE2 H 1 6.161 0.001 . 3 . . . A 42 TYR HE2 . 17882 1 246 . 1 1 43 43 ALA H H 1 8.999 0.002 . 1 . . . A 43 ALA H . 17882 1 247 . 1 1 43 43 ALA HA H 1 3.449 0.005 . 1 . . . A 43 ALA HA . 17882 1 248 . 1 1 43 43 ALA HB1 H 1 1.022 0.002 . . . . . A 43 ALA QB . 17882 1 249 . 1 1 43 43 ALA HB2 H 1 1.022 0.002 . . . . . A 43 ALA QB . 17882 1 250 . 1 1 43 43 ALA HB3 H 1 1.022 0.002 . . . . . A 43 ALA QB . 17882 1 251 . 1 1 44 44 PHE H H 1 6.125 0.000 . 1 . . . A 44 PHE H . 17882 1 252 . 1 1 44 44 PHE HA H 1 4.104 0.000 . 1 . . . A 44 PHE HA . 17882 1 253 . 1 1 44 44 PHE HB2 H 1 3.265 0.000 . 2 . . . A 44 PHE QB . 17882 1 254 . 1 1 44 44 PHE HB3 H 1 3.265 0.000 . 2 . . . A 44 PHE QB . 17882 1 255 . 1 1 45 45 ALA H H 1 8.097 0.005 . 1 . . . A 45 ALA H . 17882 1 256 . 1 1 45 45 ALA HA H 1 5.471 0.002 . 1 . . . A 45 ALA HA . 17882 1 257 . 1 1 45 45 ALA HB1 H 1 1.312 0.004 . . . . . A 45 ALA QB . 17882 1 258 . 1 1 45 45 ALA HB2 H 1 1.312 0.004 . . . . . A 45 ALA QB . 17882 1 259 . 1 1 45 45 ALA HB3 H 1 1.312 0.004 . . . . . A 45 ALA QB . 17882 1 260 . 1 1 46 46 CYS H H 1 8.704 0.002 . 1 . . . A 46 CYS H . 17882 1 261 . 1 1 46 46 CYS HA H 1 5.280 0.008 . 1 . . . A 46 CYS HA . 17882 1 262 . 1 1 46 46 CYS HB2 H 1 2.704 0.009 . 2 . . . A 46 CYS HB2 . 17882 1 263 . 1 1 46 46 CYS HB3 H 1 2.822 0.008 . 2 . . . A 46 CYS HB3 . 17882 1 264 . 1 1 47 47 TRP H H 1 9.740 0.003 . 1 . . . A 47 TRP H . 17882 1 265 . 1 1 47 47 TRP HA H 1 4.619 0.007 . 1 . . . A 47 TRP HA . 17882 1 266 . 1 1 47 47 TRP HB2 H 1 2.777 0.007 . 2 . . . A 47 TRP HB2 . 17882 1 267 . 1 1 47 47 TRP HB3 H 1 2.571 0.005 . 2 . . . A 47 TRP HB3 . 17882 1 268 . 1 1 47 47 TRP HD1 H 1 6.162 0.002 . 1 . . . A 47 TRP HD1 . 17882 1 269 . 1 1 47 47 TRP HE1 H 1 10.209 0.003 . 1 . . . A 47 TRP HE1 . 17882 1 270 . 1 1 47 47 TRP HE3 H 1 5.520 0.006 . 1 . . . A 47 TRP HE3 . 17882 1 271 . 1 1 47 47 TRP HZ2 H 1 7.112 0.006 . 1 . . . A 47 TRP HZ2 . 17882 1 272 . 1 1 47 47 TRP HZ3 H 1 6.623 0.002 . 1 . . . A 47 TRP HZ3 . 17882 1 273 . 1 1 47 47 TRP HH2 H 1 7.040 0.008 . 1 . . . A 47 TRP HH2 . 17882 1 274 . 1 1 48 48 CYS H H 1 8.635 0.007 . 1 . . . A 48 CYS H . 17882 1 275 . 1 1 48 48 CYS HA H 1 5.614 0.001 . 1 . . . A 48 CYS HA . 17882 1 276 . 1 1 48 48 CYS HB2 H 1 2.225 0.007 . 2 . . . A 48 CYS HB2 . 17882 1 277 . 1 1 48 48 CYS HB3 H 1 3.301 0.002 . 2 . . . A 48 CYS HB3 . 17882 1 278 . 1 1 49 49 THR H H 1 7.994 0.007 . 1 . . . A 49 THR H . 17882 1 279 . 1 1 49 49 THR HA H 1 4.556 0.007 . 1 . . . A 49 THR HA . 17882 1 280 . 1 1 49 49 THR HG21 H 1 1.179 0.005 . . . . . A 49 THR QG2 . 17882 1 281 . 1 1 49 49 THR HG22 H 1 1.179 0.005 . . . . . A 49 THR QG2 . 17882 1 282 . 1 1 49 49 THR HG23 H 1 1.179 0.005 . . . . . A 49 THR QG2 . 17882 1 283 . 1 1 50 50 HIS H H 1 8.919 0.005 . 1 . . . A 50 HIS H . 17882 1 284 . 1 1 50 50 HIS HA H 1 4.087 0.002 . 1 . . . A 50 HIS HA . 17882 1 285 . 1 1 50 50 HIS HB2 H 1 3.378 0.005 . 2 . . . A 50 HIS HB2 . 17882 1 286 . 1 1 50 50 HIS HB3 H 1 3.457 0.003 . 2 . . . A 50 HIS HB3 . 17882 1 287 . 1 1 50 50 HIS HE1 H 1 0.077 0.001 . 1 . . . A 50 HIS HE1 . 17882 1 288 . 1 1 51 51 LEU H H 1 8.174 0.004 . 1 . . . A 51 LEU H . 17882 1 289 . 1 1 51 51 LEU HA H 1 4.239 0.001 . 1 . . . A 51 LEU HA . 17882 1 290 . 1 1 51 51 LEU HB2 H 1 0.836 0.001 . 2 . . . A 51 LEU HB2 . 17882 1 291 . 1 1 51 51 LEU HG H 1 0.712 0.002 . 1 . . . A 51 LEU HG . 17882 1 292 . 1 1 51 51 LEU HD11 H 1 0.077 0.001 . . . . . A 51 LEU QD1 . 17882 1 293 . 1 1 51 51 LEU HD12 H 1 0.077 0.001 . . . . . A 51 LEU QD1 . 17882 1 294 . 1 1 51 51 LEU HD13 H 1 0.077 0.001 . . . . . A 51 LEU QD1 . 17882 1 295 . 1 1 51 51 LEU HD21 H 1 -0.399 0.002 . . . . . A 51 LEU QD2 . 17882 1 296 . 1 1 51 51 LEU HD22 H 1 -0.399 0.002 . . . . . A 51 LEU QD2 . 17882 1 297 . 1 1 51 51 LEU HD23 H 1 -0.399 0.002 . . . . . A 51 LEU QD2 . 17882 1 298 . 1 1 52 52 TYR H H 1 7.970 0.002 . 1 . . . A 52 TYR H . 17882 1 299 . 1 1 52 52 TYR HA H 1 4.555 0.005 . 1 . . . A 52 TYR HA . 17882 1 300 . 1 1 52 52 TYR HB2 H 1 3.144 0.002 . 2 . . . A 52 TYR HB2 . 17882 1 301 . 1 1 52 52 TYR HB3 H 1 3.257 0.006 . 2 . . . A 52 TYR HB3 . 17882 1 302 . 1 1 53 53 GLU H H 1 8.654 0.001 . 1 . . . A 53 GLU H . 17882 1 303 . 1 1 53 53 GLU HA H 1 3.766 0.002 . 1 . . . A 53 GLU HA . 17882 1 304 . 1 1 53 53 GLU HB2 H 1 2.025 0.008 . 2 . . . A 53 GLU QB . 17882 1 305 . 1 1 53 53 GLU HB3 H 1 2.025 0.008 . 2 . . . A 53 GLU QB . 17882 1 306 . 1 1 53 53 GLU HG2 H 1 2.387 0.002 . 2 . . . A 53 GLU QG . 17882 1 307 . 1 1 53 53 GLU HG3 H 1 2.387 0.002 . 2 . . . A 53 GLU QG . 17882 1 308 . 1 1 54 54 GLN H H 1 7.763 0.004 . 1 . . . A 54 GLN H . 17882 1 309 . 1 1 54 54 GLN HA H 1 4.293 0.008 . 1 . . . A 54 GLN HA . 17882 1 310 . 1 1 54 54 GLN HB2 H 1 2.291 0.007 . 2 . . . A 54 GLN HB2 . 17882 1 311 . 1 1 54 54 GLN HB3 H 1 2.418 0.001 . 2 . . . A 54 GLN HB3 . 17882 1 312 . 1 1 54 54 GLN HG2 H 1 1.991 0.003 . 2 . . . A 54 GLN QG . 17882 1 313 . 1 1 54 54 GLN HG3 H 1 1.991 0.003 . 2 . . . A 54 GLN QG . 17882 1 314 . 1 1 54 54 GLN HE21 H 1 6.976 0.002 . 2 . . . A 54 GLN HE21 . 17882 1 315 . 1 1 54 54 GLN HE22 H 1 7.305 0.002 . 2 . . . A 54 GLN HE22 . 17882 1 316 . 1 1 55 55 ALA H H 1 7.346 0.002 . 1 . . . A 55 ALA H . 17882 1 317 . 1 1 55 55 ALA HA H 1 4.012 0.001 . 1 . . . A 55 ALA HA . 17882 1 318 . 1 1 55 55 ALA HB1 H 1 0.821 0.006 . . . . . A 55 ALA QB . 17882 1 319 . 1 1 55 55 ALA HB2 H 1 0.821 0.006 . . . . . A 55 ALA QB . 17882 1 320 . 1 1 55 55 ALA HB3 H 1 0.821 0.006 . . . . . A 55 ALA QB . 17882 1 321 . 1 1 56 56 VAL H H 1 8.561 0.005 . 1 . . . A 56 VAL H . 17882 1 322 . 1 1 56 56 VAL HA H 1 4.136 0.009 . 1 . . . A 56 VAL HA . 17882 1 323 . 1 1 56 56 VAL HB H 1 2.022 0.006 . 1 . . . A 56 VAL HB . 17882 1 324 . 1 1 56 56 VAL HG11 H 1 0.894 0.003 . . . . . A 56 VAL QG1 . 17882 1 325 . 1 1 56 56 VAL HG12 H 1 0.894 0.003 . . . . . A 56 VAL QG1 . 17882 1 326 . 1 1 56 56 VAL HG13 H 1 0.894 0.003 . . . . . A 56 VAL QG1 . 17882 1 327 . 1 1 56 56 VAL HG21 H 1 1.061 0.003 . . . . . A 56 VAL QG2 . 17882 1 328 . 1 1 56 56 VAL HG22 H 1 1.061 0.003 . . . . . A 56 VAL QG2 . 17882 1 329 . 1 1 56 56 VAL HG23 H 1 1.061 0.003 . . . . . A 56 VAL QG2 . 17882 1 330 . 1 1 57 57 VAL H H 1 8.118 0.006 . 1 . . . A 57 VAL H . 17882 1 331 . 1 1 57 57 VAL HA H 1 4.610 0.001 . 1 . . . A 57 VAL HA . 17882 1 332 . 1 1 57 57 VAL HB H 1 2.274 0.005 . 1 . . . A 57 VAL HB . 17882 1 333 . 1 1 57 57 VAL HG11 H 1 0.674 0.001 . . . . . A 57 VAL QG1 . 17882 1 334 . 1 1 57 57 VAL HG12 H 1 0.674 0.001 . . . . . A 57 VAL QG1 . 17882 1 335 . 1 1 57 57 VAL HG13 H 1 0.674 0.001 . . . . . A 57 VAL QG1 . 17882 1 336 . 1 1 57 57 VAL HG21 H 1 0.080 0.004 . . . . . A 57 VAL QG2 . 17882 1 337 . 1 1 57 57 VAL HG22 H 1 0.080 0.004 . . . . . A 57 VAL QG2 . 17882 1 338 . 1 1 57 57 VAL HG23 H 1 0.080 0.004 . . . . . A 57 VAL QG2 . 17882 1 339 . 1 1 58 58 TRP H H 1 8.512 0.002 . 1 . . . A 58 TRP H . 17882 1 340 . 1 1 58 58 TRP HA H 1 4.096 0.001 . 1 . . . A 58 TRP HA . 17882 1 341 . 1 1 58 58 TRP HB2 H 1 3.025 0.009 . 2 . . . A 58 TRP HB2 . 17882 1 342 . 1 1 58 58 TRP HB3 H 1 3.440 0.002 . 2 . . . A 58 TRP HB3 . 17882 1 343 . 1 1 58 58 TRP HD1 H 1 7.337 0.007 . 1 . . . A 58 TRP HD1 . 17882 1 344 . 1 1 58 58 TRP HE1 H 1 10.118 0.001 . 1 . . . A 58 TRP HE1 . 17882 1 345 . 1 1 58 58 TRP HE3 H 1 7.637 0.008 . 1 . . . A 58 TRP HE3 . 17882 1 346 . 1 1 58 58 TRP HZ2 H 1 7.646 0.007 . 1 . . . A 58 TRP HZ2 . 17882 1 347 . 1 1 59 59 PRO HD2 H 1 3.265 0.003 . 2 . . . . 59 PRO QD . 17882 1 348 . 1 1 59 59 PRO HD3 H 1 3.265 0.003 . 2 . . . . 59 PRO QD . 17882 1 349 . 1 1 60 60 LEU HA H 1 1.828 0.003 . 1 . . . A 60 LEU HA . 17882 1 350 . 1 1 60 60 LEU HB2 H 1 0.762 0.000 . 2 . . . A 60 LEU HB2 . 17882 1 351 . 1 1 60 60 LEU HB3 H 1 1.052 0.007 . 2 . . . A 60 LEU HB3 . 17882 1 352 . 1 1 60 60 LEU HG H 1 0.590 0.002 . 1 . . . A 60 LEU HG . 17882 1 353 . 1 1 60 60 LEU HD11 H 1 0.195 0.008 . . . . . A 60 LEU QD1 . 17882 1 354 . 1 1 60 60 LEU HD12 H 1 0.195 0.008 . . . . . A 60 LEU QD1 . 17882 1 355 . 1 1 60 60 LEU HD13 H 1 0.195 0.008 . . . . . A 60 LEU QD1 . 17882 1 356 . 1 1 60 60 LEU HD21 H 1 0.387 0.005 . . . . . A 60 LEU QD2 . 17882 1 357 . 1 1 60 60 LEU HD22 H 1 0.387 0.005 . . . . . A 60 LEU QD2 . 17882 1 358 . 1 1 60 60 LEU HD23 H 1 0.387 0.005 . . . . . A 60 LEU QD2 . 17882 1 359 . 1 1 61 61 PRO HA H 1 4.193 0.003 . 1 . . . A 61 PRO HA . 17882 1 360 . 1 1 61 61 PRO HB2 H 1 1.862 0.006 . 2 . . . A 61 PRO HB2 . 17882 1 361 . 1 1 61 61 PRO HB3 H 1 2.252 0.004 . 2 . . . A 61 PRO HB3 . 17882 1 362 . 1 1 61 61 PRO HG2 H 1 2.038 0.004 . 2 . . . A 61 PRO HG2 . 17882 1 363 . 1 1 61 61 PRO HD3 H 1 3.884 0.001 . 2 . . . A 61 PRO HD3 . 17882 1 364 . 1 1 62 62 ASN H H 1 8.233 0.001 . 1 . . . A 62 ASN H . 17882 1 365 . 1 1 62 62 ASN HA H 1 4.634 0.001 . 1 . . . A 62 ASN HA . 17882 1 366 . 1 1 62 62 ASN HB2 H 1 2.835 0.001 . 2 . . . A 62 ASN HB2 . 17882 1 367 . 1 1 62 62 ASN HB3 H 1 2.893 0.000 . 2 . . . A 62 ASN HB3 . 17882 1 368 . 1 1 62 62 ASN HD21 H 1 6.891 0.000 . 2 . . . A 62 ASN HD21 . 17882 1 369 . 1 1 62 62 ASN HD22 H 1 7.573 0.001 . 2 . . . A 62 ASN HD22 . 17882 1 370 . 1 1 63 63 LYS H H 1 7.061 0.000 . 1 . . . A 63 LYS H . 17882 1 371 . 1 1 63 63 LYS HA H 1 4.573 0.001 . 1 . . . A 63 LYS HA . 17882 1 372 . 1 1 63 63 LYS HB2 H 1 1.562 0.000 . 2 . . . A 63 LYS HB2 . 17882 1 373 . 1 1 63 63 LYS HB3 H 1 1.609 0.000 . 2 . . . A 63 LYS HB3 . 17882 1 374 . 1 1 63 63 LYS HG2 H 1 1.217 0.000 . 2 . . . A 63 LYS QG . 17882 1 375 . 1 1 63 63 LYS HG3 H 1 1.217 0.000 . 2 . . . A 63 LYS QG . 17882 1 376 . 1 1 63 63 LYS HD2 H 1 2.945 0.000 . 2 . . . A 63 LYS QD . 17882 1 377 . 1 1 63 63 LYS HD3 H 1 2.945 0.000 . 2 . . . A 63 LYS QD . 17882 1 378 . 1 1 64 64 THR H H 1 8.457 0.003 . 1 . . . A 64 THR H . 17882 1 379 . 1 1 64 64 THR HA H 1 4.431 0.001 . 1 . . . A 64 THR HA . 17882 1 380 . 1 1 64 64 THR HB H 1 4.070 0.002 . 1 . . . A 64 THR HB . 17882 1 381 . 1 1 64 64 THR HG21 H 1 1.204 0.004 . . . . . A 64 THR QG2 . 17882 1 382 . 1 1 64 64 THR HG22 H 1 1.204 0.004 . . . . . A 64 THR QG2 . 17882 1 383 . 1 1 64 64 THR HG23 H 1 1.204 0.004 . . . . . A 64 THR QG2 . 17882 1 384 . 1 1 65 65 CYS H H 1 8.852 0.002 . 1 . . . A 65 CYS H . 17882 1 385 . 1 1 65 65 CYS HA H 1 4.718 0.002 . 1 . . . A 65 CYS HA . 17882 1 386 . 1 1 65 65 CYS HB2 H 1 3.138 0.004 . 2 . . . A 65 CYS HB2 . 17882 1 387 . 1 1 65 65 CYS HB3 H 1 3.284 0.008 . 2 . . . A 65 CYS HB3 . 17882 1 388 . 1 1 66 66 ASN H H 1 8.652 0.000 . 1 . . . A 66 ASN H . 17882 1 389 . 1 1 66 66 ASN HA H 1 4.566 0.000 . 1 . . . A 66 ASN HA . 17882 1 390 . 1 1 66 66 ASN HB2 H 1 2.031 0.000 . 2 . . . A 66 ASN QB . 17882 1 391 . 1 1 66 66 ASN HB3 H 1 2.031 0.000 . 2 . . . A 66 ASN QB . 17882 1 stop_ save_