################################### # 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 17904 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D DQF-COSY' . . . 17904 1 2 '2D 1H-1H NOESY' . . . 17904 1 3 '2D 1H-1H TOCSY' . . . 17904 1 4 '2D DQF-COSY' . . . 17904 1 5 '2D 1H-1H NOESY' . . . 17904 1 6 '2D 1H-1H TOCSY' . . . 17904 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 PHE H H 1 8.881 0.001 . . . . . A -3 PHE H . 17904 1 2 . 1 1 3 3 PHE HA H 1 4.481 0.002 . . . . . A -3 PHE HA . 17904 1 3 . 1 1 3 3 PHE HB2 H 1 2.720 0.000 . . . . . A -3 PHE HB2 . 17904 1 4 . 1 1 3 3 PHE HB3 H 1 3.008 0.000 . . . . . A -3 PHE HB3 . 17904 1 5 . 1 1 3 3 PHE HD1 H 1 7.148 0.014 . . . . . A -3 PHE HD1 . 17904 1 6 . 1 1 3 3 PHE HE1 H 1 7.416 0.002 . . . . . A -3 PHE HE1 . 17904 1 7 . 1 1 3 3 PHE HZ H 1 7.285 0.003 . . . . . A -3 PHE HZ . 17904 1 8 . 1 1 4 4 LYS H H 1 6.768 0.001 . . . . . A -2 LYS H . 17904 1 9 . 1 1 4 4 LYS HA H 1 3.873 0.002 . . . . . A -2 LYS HA . 17904 1 10 . 1 1 4 4 LYS HB2 H 1 1.227 0.001 . . . . . A -2 LYS HB2 . 17904 1 11 . 1 1 4 4 LYS HB3 H 1 1.499 0.012 . . . . . A -2 LYS HB3 . 17904 1 12 . 1 1 4 4 LYS HG2 H 1 1.023 0.001 . . . . . A -2 LYS HG2 . 17904 1 13 . 1 1 4 4 LYS HG3 H 1 1.092 0.001 . . . . . A -2 LYS HG3 . 17904 1 14 . 1 1 4 4 LYS HE3 H 1 2.661 0.001 . . . . . A -2 LYS HE3 . 17904 1 15 . 1 1 5 5 ALA H H 1 7.413 0.002 . . . . . A -1 ALA H . 17904 1 16 . 1 1 5 5 ALA HA H 1 3.713 0.006 . . . . . A -1 ALA HA . 17904 1 17 . 1 1 5 5 ALA HB1 H 1 1.352 0.002 . . . . . A -1 ALA HB1 . 17904 1 18 . 1 1 5 5 ALA HB2 H 1 1.352 0.002 . . . . . A -1 ALA HB2 . 17904 1 19 . 1 1 5 5 ALA HB3 H 1 1.352 0.002 . . . . . A -1 ALA HB3 . 17904 1 20 . 1 1 6 6 GLY H H 1 8.336 0.004 . . . . . A 1 GLY H . 17904 1 21 . 1 1 6 6 GLY HA2 H 1 3.701 0.005 . . . . . A 1 GLY HA2 . 17904 1 22 . 1 1 6 6 GLY HA3 H 1 4.284 0.002 . . . . . A 1 GLY HA3 . 17904 1 23 . 1 1 7 7 SER H H 1 9.588 0.000 . . . . . A 2 SER H . 17904 1 24 . 1 1 7 7 SER HA H 1 4.840 0.000 . . . . . A 2 SER HA . 17904 1 25 . 1 1 7 7 SER HB2 H 1 3.892 0.000 . . . . . A 2 SER HB2 . 17904 1 26 . 1 1 8 8 ALA H H 1 7.706 0.005 . . . . . A 3 ALA H . 17904 1 27 . 1 1 8 8 ALA HA H 1 4.033 0.012 . . . . . A 3 ALA HA . 17904 1 28 . 1 1 8 8 ALA HB1 H 1 1.555 0.015 . . . . . A 3 ALA HB1 . 17904 1 29 . 1 1 8 8 ALA HB2 H 1 1.555 0.015 . . . . . A 3 ALA HB2 . 17904 1 30 . 1 1 8 8 ALA HB3 H 1 1.555 0.015 . . . . . A 3 ALA HB3 . 17904 1 31 . 1 1 9 9 LYS H H 1 8.465 0.001 . . . . . A 4 LYS H . 17904 1 32 . 1 1 9 9 LYS HA H 1 4.329 0.001 . . . . . A 4 LYS HA . 17904 1 33 . 1 1 9 9 LYS HB2 H 1 1.861 0.002 . . . . . A 4 LYS HB2 . 17904 1 34 . 1 1 9 9 LYS HB3 H 1 1.922 0.001 . . . . . A 4 LYS HB3 . 17904 1 35 . 1 1 9 9 LYS HG2 H 1 1.333 0.002 . . . . . A 4 LYS HG2 . 17904 1 36 . 1 1 9 9 LYS HG3 H 1 1.414 0.001 . . . . . A 4 LYS HG3 . 17904 1 37 . 1 1 10 10 LYS H H 1 7.893 0.004 . . . . . A 5 LYS H . 17904 1 38 . 1 1 10 10 LYS HA H 1 4.155 0.004 . . . . . A 5 LYS HA . 17904 1 39 . 1 1 10 10 LYS HB2 H 1 1.861 0.001 . . . . . A 5 LYS HB2 . 17904 1 40 . 1 1 10 10 LYS HG2 H 1 1.355 0.000 . . . . . A 5 LYS HG2 . 17904 1 41 . 1 1 10 10 LYS HD2 H 1 1.506 0.001 . . . . . A 5 LYS HD2 . 17904 1 42 . 1 1 10 10 LYS HD3 H 1 1.593 0.000 . . . . . A 5 LYS HD3 . 17904 1 43 . 1 1 10 10 LYS HE2 H 1 2.872 0.000 . . . . . A 5 LYS HE2 . 17904 1 44 . 1 1 11 11 GLY H H 1 8.906 0.002 . . . . . A 6 GLY H . 17904 1 45 . 1 1 11 11 GLY HA2 H 1 4.337 0.010 . . . . . A 6 GLY HA2 . 17904 1 46 . 1 1 11 11 GLY HA3 H 1 3.600 0.016 . . . . . A 6 GLY HA3 . 17904 1 47 . 1 1 12 12 ALA H H 1 8.157 0.008 . . . . . A 7 ALA H . 17904 1 48 . 1 1 12 12 ALA HA H 1 2.418 0.012 . . . . . A 7 ALA HA . 17904 1 49 . 1 1 12 12 ALA HB1 H 1 1.212 0.018 . . . . . A 7 ALA HB1 . 17904 1 50 . 1 1 12 12 ALA HB2 H 1 1.212 0.018 . . . . . A 7 ALA HB2 . 17904 1 51 . 1 1 12 12 ALA HB3 H 1 1.212 0.018 . . . . . A 7 ALA HB3 . 17904 1 52 . 1 1 13 13 THR H H 1 7.325 0.024 . . . . . A 8 THR H . 17904 1 53 . 1 1 13 13 THR HA H 1 3.940 0.031 . . . . . A 8 THR HA . 17904 1 54 . 1 1 13 13 THR HB H 1 4.255 0.039 . . . . . A 8 THR HB . 17904 1 55 . 1 1 13 13 THR HG21 H 1 1.295 0.001 . . . . . A 8 THR HG21 . 17904 1 56 . 1 1 13 13 THR HG22 H 1 1.295 0.001 . . . . . A 8 THR HG22 . 17904 1 57 . 1 1 13 13 THR HG23 H 1 1.295 0.001 . . . . . A 8 THR HG23 . 17904 1 58 . 1 1 14 14 LEU H H 1 8.044 0.010 . . . . . A 9 LEU H . 17904 1 59 . 1 1 14 14 LEU HA H 1 4.109 0.004 . . . . . A 9 LEU HA . 17904 1 60 . 1 1 14 14 LEU HB2 H 1 1.509 0.000 . . . . . A 9 LEU HB2 . 17904 1 61 . 1 1 14 14 LEU HB3 H 1 2.274 0.001 . . . . . A 9 LEU HB3 . 17904 1 62 . 1 1 14 14 LEU HG H 1 1.828 0.000 . . . . . A 9 LEU HG . 17904 1 63 . 1 1 14 14 LEU HD11 H 1 1.013 0.010 . . . . . A 9 LEU HD11 . 17904 1 64 . 1 1 14 14 LEU HD12 H 1 1.013 0.010 . . . . . A 9 LEU HD12 . 17904 1 65 . 1 1 14 14 LEU HD13 H 1 1.013 0.010 . . . . . A 9 LEU HD13 . 17904 1 66 . 1 1 14 14 LEU HD21 H 1 1.231 0.021 . . . . . A 9 LEU HD21 . 17904 1 67 . 1 1 14 14 LEU HD22 H 1 1.231 0.021 . . . . . A 9 LEU HD22 . 17904 1 68 . 1 1 14 14 LEU HD23 H 1 1.231 0.021 . . . . . A 9 LEU HD23 . 17904 1 69 . 1 1 15 15 PHE H H 1 8.956 0.004 . . . . . A 10 PHE H . 17904 1 70 . 1 1 15 15 PHE HA H 1 4.048 0.000 . . . . . A 10 PHE HA . 17904 1 71 . 1 1 15 15 PHE HB2 H 1 2.939 0.004 . . . . . A 10 PHE HB2 . 17904 1 72 . 1 1 15 15 PHE HB3 H 1 3.028 0.017 . . . . . A 10 PHE HB3 . 17904 1 73 . 1 1 15 15 PHE HD2 H 1 7.208 0.001 . . . . . A 10 PHE HD2 . 17904 1 74 . 1 1 15 15 PHE HE1 H 1 6.618 0.001 . . . . . A 10 PHE HE1 . 17904 1 75 . 1 1 15 15 PHE HE2 H 1 6.236 0.001 . . . . . A 10 PHE HE2 . 17904 1 76 . 1 1 15 15 PHE HZ H 1 6.236 0.000 . . . . . A 10 PHE HZ . 17904 1 77 . 1 1 16 16 LYS H H 1 8.433 0.003 . . . . . A 11 LYS H . 17904 1 78 . 1 1 16 16 LYS HA H 1 4.018 0.004 . . . . . A 11 LYS HA . 17904 1 79 . 1 1 16 16 LYS HB2 H 1 1.678 0.002 . . . . . A 11 LYS HB2 . 17904 1 80 . 1 1 16 16 LYS HB3 H 1 2.063 0.002 . . . . . A 11 LYS HB3 . 17904 1 81 . 1 1 16 16 LYS HG2 H 1 1.331 0.001 . . . . . A 11 LYS HG2 . 17904 1 82 . 1 1 16 16 LYS HG3 H 1 1.412 0.003 . . . . . A 11 LYS HG3 . 17904 1 83 . 1 1 17 17 THR H H 1 8.023 0.003 . . . . . A 12 THR H . 17904 1 84 . 1 1 17 17 THR HA H 1 4.305 0.000 . . . . . A 12 THR HA . 17904 1 85 . 1 1 17 17 THR HG21 H 1 1.410 0.004 . . . . . A 12 THR HG21 . 17904 1 86 . 1 1 17 17 THR HG22 H 1 1.410 0.004 . . . . . A 12 THR HG22 . 17904 1 87 . 1 1 17 17 THR HG23 H 1 1.410 0.004 . . . . . A 12 THR HG23 . 17904 1 88 . 1 1 18 18 ARG H H 1 8.745 0.012 . . . . . A 13 ARG H . 17904 1 89 . 1 1 18 18 ARG HA H 1 5.317 0.023 . . . . . A 13 ARG HA . 17904 1 90 . 1 1 18 18 ARG HB2 H 1 2.500 0.002 . . . . . A 13 ARG HB2 . 17904 1 91 . 1 1 18 18 ARG HB3 H 1 2.706 0.001 . . . . . A 13 ARG HB3 . 17904 1 92 . 1 1 18 18 ARG HG2 H 1 1.942 0.001 . . . . . A 13 ARG HG2 . 17904 1 93 . 1 1 18 18 ARG HG3 H 1 2.158 0.000 . . . . . A 13 ARG HG3 . 17904 1 94 . 1 1 18 18 ARG HD2 H 1 3.347 0.000 . . . . . A 13 ARG HD2 . 17904 1 95 . 1 1 18 18 ARG HD3 H 1 3.503 0.000 . . . . . A 13 ARG HD3 . 17904 1 96 . 1 1 19 19 CYS H H 1 8.022 0.002 . . . . . A 14 CYS H . 17904 1 97 . 1 1 19 19 CYS HA H 1 5.441 0.005 . . . . . A 14 CYS HA . 17904 1 98 . 1 1 19 19 CYS HB2 H 1 1.110 0.004 . . . . . A 14 CYS HB2 . 17904 1 99 . 1 1 19 19 CYS HB3 H 1 1.803 0.002 . . . . . A 14 CYS HB3 . 17904 1 100 . 1 1 20 20 LEU H H 1 7.325 0.030 . . . . . A 15 LEU H . 17904 1 101 . 1 1 20 20 LEU HA H 1 4.144 0.002 . . . . . A 15 LEU HA . 17904 1 102 . 1 1 20 20 LEU HB2 H 1 1.358 0.000 . . . . . A 15 LEU HB2 . 17904 1 103 . 1 1 20 20 LEU HB3 H 1 1.872 0.001 . . . . . A 15 LEU HB3 . 17904 1 104 . 1 1 20 20 LEU HG H 1 1.621 0.003 . . . . . A 15 LEU HG . 17904 1 105 . 1 1 20 20 LEU HD11 H 1 0.962 0.007 . . . . . A 15 LEU HD11 . 17904 1 106 . 1 1 20 20 LEU HD12 H 1 0.962 0.007 . . . . . A 15 LEU HD12 . 17904 1 107 . 1 1 20 20 LEU HD13 H 1 0.962 0.007 . . . . . A 15 LEU HD13 . 17904 1 108 . 1 1 20 20 LEU HD21 H 1 1.119 0.021 . . . . . A 15 LEU HD21 . 17904 1 109 . 1 1 20 20 LEU HD22 H 1 1.119 0.021 . . . . . A 15 LEU HD22 . 17904 1 110 . 1 1 20 20 LEU HD23 H 1 1.119 0.021 . . . . . A 15 LEU HD23 . 17904 1 111 . 1 1 21 21 GLN H H 1 9.109 0.000 . . . . . A 16 GLN H . 17904 1 112 . 1 1 21 21 GLN HA H 1 4.004 0.000 . . . . . A 16 GLN HA . 17904 1 113 . 1 1 21 21 GLN HB2 H 1 2.009 0.001 . . . . . A 16 GLN HB2 . 17904 1 114 . 1 1 21 21 GLN HB3 H 1 2.248 0.001 . . . . . A 16 GLN HB3 . 17904 1 115 . 1 1 21 21 GLN HG2 H 1 2.498 0.005 . . . . . A 16 GLN HG2 . 17904 1 116 . 1 1 21 21 GLN HG3 H 1 2.788 0.003 . . . . . A 16 GLN HG3 . 17904 1 117 . 1 1 21 21 GLN HE21 H 1 7.061 0.000 . . . . . A 16 GLN HE21 . 17904 1 118 . 1 1 21 21 GLN HE22 H 1 7.647 0.000 . . . . . A 16 GLN HE22 . 17904 1 119 . 1 1 22 22 CYS H H 1 7.154 0.001 . . . . . A 17 CYS H . 17904 1 120 . 1 1 22 22 CYS HA H 1 4.341 0.009 . . . . . A 17 CYS HA . 17904 1 121 . 1 1 22 22 CYS HB2 H 1 1.099 0.003 . . . . . A 17 CYS HB2 . 17904 1 122 . 1 1 22 22 CYS HB3 H 1 1.517 0.003 . . . . . A 17 CYS HB3 . 17904 1 123 . 1 1 23 23 HIS H H 1 6.626 0.006 . . . . . A 18 HIS H . 17904 1 124 . 1 1 23 23 HIS HA H 1 3.530 0.001 . . . . . A 18 HIS HA . 17904 1 125 . 1 1 23 23 HIS HB2 H 1 0.765 0.002 . . . . . A 18 HIS HB2 . 17904 1 126 . 1 1 23 23 HIS HB3 H 1 1.032 0.007 . . . . . A 18 HIS HB3 . 17904 1 127 . 1 1 23 23 HIS HD1 H 1 9.676 0.002 . . . . . A 18 HIS HD1 . 17904 1 128 . 1 1 23 23 HIS HD2 H 1 -0.058 0.008 . . . . . A 18 HIS HD2 . 17904 1 129 . 1 1 24 24 THR H H 1 7.223 0.003 . . . . . A 19 THR H . 17904 1 130 . 1 1 24 24 THR HA H 1 4.514 0.000 . . . . . A 19 THR HA . 17904 1 131 . 1 1 24 24 THR HB H 1 4.316 0.009 . . . . . A 19 THR HB . 17904 1 132 . 1 1 24 24 THR HG21 H 1 0.939 0.001 . . . . . A 19 THR HG21 . 17904 1 133 . 1 1 24 24 THR HG22 H 1 0.939 0.001 . . . . . A 19 THR HG22 . 17904 1 134 . 1 1 24 24 THR HG23 H 1 0.939 0.001 . . . . . A 19 THR HG23 . 17904 1 135 . 1 1 25 25 VAL H H 1 8.015 0.003 . . . . . A 20 VAL H . 17904 1 136 . 1 1 25 25 VAL HA H 1 4.085 0.000 . . . . . A 20 VAL HA . 17904 1 137 . 1 1 25 25 VAL HB H 1 1.290 0.002 . . . . . A 20 VAL HB . 17904 1 138 . 1 1 25 25 VAL HG11 H 1 0.233 0.011 . . . . . A 20 VAL HG11 . 17904 1 139 . 1 1 25 25 VAL HG12 H 1 0.233 0.011 . . . . . A 20 VAL HG12 . 17904 1 140 . 1 1 25 25 VAL HG13 H 1 0.233 0.011 . . . . . A 20 VAL HG13 . 17904 1 141 . 1 1 25 25 VAL HG21 H 1 0.461 0.021 . . . . . A 20 VAL HG21 . 17904 1 142 . 1 1 25 25 VAL HG22 H 1 0.461 0.021 . . . . . A 20 VAL HG22 . 17904 1 143 . 1 1 25 25 VAL HG23 H 1 0.461 0.021 . . . . . A 20 VAL HG23 . 17904 1 144 . 1 1 26 26 GLU H H 1 8.343 0.003 . . . . . A 21 GLU H . 17904 1 145 . 1 1 26 26 GLU HA H 1 4.158 0.001 . . . . . A 21 GLU HA . 17904 1 146 . 1 1 26 26 GLU HB2 H 1 1.884 0.001 . . . . . A 21 GLU HB2 . 17904 1 147 . 1 1 27 27 LYS H H 1 8.673 0.003 . . . . . A 22 LYS H . 17904 1 148 . 1 1 27 27 LYS HA H 1 3.149 0.019 . . . . . A 22 LYS HA . 17904 1 149 . 1 1 27 27 LYS HB2 H 1 0.422 0.011 . . . . . A 22 LYS HB2 . 17904 1 150 . 1 1 27 27 LYS HB3 H 1 1.250 0.017 . . . . . A 22 LYS HB3 . 17904 1 151 . 1 1 27 27 LYS HG2 H 1 0.743 0.012 . . . . . A 22 LYS HG2 . 17904 1 152 . 1 1 27 27 LYS HG3 H 1 0.932 0.014 . . . . . A 22 LYS HG3 . 17904 1 153 . 1 1 27 27 LYS HD2 H 1 1.403 0.012 . . . . . A 22 LYS HD2 . 17904 1 154 . 1 1 27 27 LYS HE2 H 1 2.803 0.018 . . . . . A 22 LYS HE2 . 17904 1 155 . 1 1 28 28 GLY H H 1 9.308 0.002 . . . . . A 23 GLY H . 17904 1 156 . 1 1 28 28 GLY HA2 H 1 3.508 0.001 . . . . . A 23 GLY HA2 . 17904 1 157 . 1 1 28 28 GLY HA3 H 1 3.893 0.003 . . . . . A 23 GLY HA3 . 17904 1 158 . 1 1 29 29 GLY H H 1 7.977 0.003 . . . . . A 24 GLY H . 17904 1 159 . 1 1 29 29 GLY HA2 H 1 3.182 0.001 . . . . . A 24 GLY HA2 . 17904 1 160 . 1 1 30 30 PRO HA H 1 4.131 0.000 . . . . . A 25 PRO HA . 17904 1 161 . 1 1 30 30 PRO HB2 H 1 2.173 0.000 . . . . . A 25 PRO HB2 . 17904 1 162 . 1 1 31 31 HIS H H 1 8.337 0.008 . . . . . A 26 HIS H . 17904 1 163 . 1 1 31 31 HIS HA H 1 4.261 0.001 . . . . . A 26 HIS HA . 17904 1 164 . 1 1 31 31 HIS HB2 H 1 2.878 0.000 . . . . . A 26 HIS HB2 . 17904 1 165 . 1 1 31 31 HIS HB3 H 1 3.052 0.003 . . . . . A 26 HIS HB3 . 17904 1 166 . 1 1 31 31 HIS HD2 H 1 7.011 0.003 . . . . . A 26 HIS HD2 . 17904 1 167 . 1 1 31 31 HIS HE1 H 1 7.532 0.001 . . . . . A 26 HIS HE1 . 17904 1 168 . 1 1 32 32 LYS H H 1 7.722 0.007 . . . . . A 27 LYS H . 17904 1 169 . 1 1 32 32 LYS HA H 1 4.197 0.001 . . . . . A 27 LYS HA . 17904 1 170 . 1 1 32 32 LYS HB2 H 1 0.950 0.009 . . . . . A 27 LYS HB2 . 17904 1 171 . 1 1 32 32 LYS HB3 H 1 1.096 0.004 . . . . . A 27 LYS HB3 . 17904 1 172 . 1 1 32 32 LYS HG2 H 1 1.588 0.000 . . . . . A 27 LYS HG2 . 17904 1 173 . 1 1 32 32 LYS HD2 H 1 1.883 0.000 . . . . . A 27 LYS HD2 . 17904 1 174 . 1 1 32 32 LYS HE2 H 1 3.410 0.003 . . . . . A 27 LYS HE2 . 17904 1 175 . 1 1 33 33 VAL H H 1 7.175 0.008 . . . . . A 28 VAL H . 17904 1 176 . 1 1 33 33 VAL HA H 1 3.969 0.002 . . . . . A 28 VAL HA . 17904 1 177 . 1 1 33 33 VAL HB H 1 2.095 0.001 . . . . . A 28 VAL HB . 17904 1 178 . 1 1 33 33 VAL HG11 H 1 1.281 0.001 . . . . . A 28 VAL HG11 . 17904 1 179 . 1 1 33 33 VAL HG12 H 1 1.281 0.001 . . . . . A 28 VAL HG12 . 17904 1 180 . 1 1 33 33 VAL HG13 H 1 1.281 0.001 . . . . . A 28 VAL HG13 . 17904 1 181 . 1 1 33 33 VAL HG21 H 1 1.750 0.017 . . . . . A 28 VAL HG21 . 17904 1 182 . 1 1 33 33 VAL HG22 H 1 1.750 0.017 . . . . . A 28 VAL HG22 . 17904 1 183 . 1 1 33 33 VAL HG23 H 1 1.750 0.017 . . . . . A 28 VAL HG23 . 17904 1 184 . 1 1 34 34 GLY H H 1 7.759 0.001 . . . . . A 29 GLY H . 17904 1 185 . 1 1 34 34 GLY HA2 H 1 -0.032 0.030 . . . . . A 29 GLY HA2 . 17904 1 186 . 1 1 34 34 GLY HA3 H 1 3.563 0.017 . . . . . A 29 GLY HA3 . 17904 1 187 . 1 1 35 35 PRO HA H 1 3.538 0.001 . . . . . A 30 PRO HA . 17904 1 188 . 1 1 35 35 PRO HB2 H 1 0.368 0.001 . . . . . A 30 PRO HB2 . 17904 1 189 . 1 1 35 35 PRO HB3 H 1 1.251 0.002 . . . . . A 30 PRO HB3 . 17904 1 190 . 1 1 35 35 PRO HG2 H 1 0.792 0.001 . . . . . A 30 PRO HG2 . 17904 1 191 . 1 1 35 35 PRO HD2 H 1 1.336 0.000 . . . . . A 30 PRO HD2 . 17904 1 192 . 1 1 35 35 PRO HD3 H 1 1.834 0.000 . . . . . A 30 PRO HD3 . 17904 1 193 . 1 1 36 36 ASN H H 1 10.796 0.003 . . . . . A 31 ASN H . 17904 1 194 . 1 1 36 36 ASN HA H 1 3.932 0.000 . . . . . A 31 ASN HA . 17904 1 195 . 1 1 36 36 ASN HB2 H 1 1.938 0.001 . . . . . A 31 ASN HB2 . 17904 1 196 . 1 1 36 36 ASN HB3 H 1 2.107 0.001 . . . . . A 31 ASN HB3 . 17904 1 197 . 1 1 36 36 ASN HD21 H 1 7.901 0.002 . . . . . A 31 ASN HD21 . 17904 1 198 . 1 1 37 37 LEU H H 1 7.881 0.005 . . . . . A 32 LEU H . 17904 1 199 . 1 1 37 37 LEU HA H 1 3.935 0.000 . . . . . A 32 LEU HA . 17904 1 200 . 1 1 37 37 LEU HB2 H 1 1.225 0.002 . . . . . A 32 LEU HB2 . 17904 1 201 . 1 1 37 37 LEU HG H 1 0.374 0.003 . . . . . A 32 LEU HG . 17904 1 202 . 1 1 37 37 LEU HD11 H 1 -0.891 0.010 . . . . . A 32 LEU HD11 . 17904 1 203 . 1 1 37 37 LEU HD12 H 1 -0.891 0.010 . . . . . A 32 LEU HD12 . 17904 1 204 . 1 1 37 37 LEU HD13 H 1 -0.891 0.010 . . . . . A 32 LEU HD13 . 17904 1 205 . 1 1 37 37 LEU HD21 H 1 -0.691 0.011 . . . . . A 32 LEU HD21 . 17904 1 206 . 1 1 37 37 LEU HD22 H 1 -0.691 0.011 . . . . . A 32 LEU HD22 . 17904 1 207 . 1 1 37 37 LEU HD23 H 1 -0.691 0.011 . . . . . A 32 LEU HD23 . 17904 1 208 . 1 1 38 38 HIS H H 1 7.395 0.006 . . . . . A 33 HIS H . 17904 1 209 . 1 1 38 38 HIS HA H 1 3.866 0.002 . . . . . A 33 HIS HA . 17904 1 210 . 1 1 38 38 HIS HB3 H 1 2.991 0.002 . . . . . A 33 HIS HB3 . 17904 1 211 . 1 1 38 38 HIS HD2 H 1 7.063 0.003 . . . . . A 33 HIS HD2 . 17904 1 212 . 1 1 38 38 HIS HE1 H 1 7.714 0.005 . . . . . A 33 HIS HE1 . 17904 1 213 . 1 1 39 39 GLY H H 1 9.005 0.008 . . . . . A 34 GLY H . 17904 1 214 . 1 1 39 39 GLY HA2 H 1 4.208 0.002 . . . . . A 34 GLY HA2 . 17904 1 215 . 1 1 40 40 ILE H H 1 7.217 0.003 . . . . . A 35 ILE H . 17904 1 216 . 1 1 40 40 ILE HA H 1 3.968 0.001 . . . . . A 35 ILE HA . 17904 1 217 . 1 1 40 40 ILE HB H 1 1.641 0.006 . . . . . A 35 ILE HB . 17904 1 218 . 1 1 40 40 ILE HG12 H 1 0.942 0.004 . . . . . A 35 ILE HG12 . 17904 1 219 . 1 1 40 40 ILE HG13 H 1 1.276 0.005 . . . . . A 35 ILE HG13 . 17904 1 220 . 1 1 40 40 ILE HG21 H 1 0.261 0.001 . . . . . A 35 ILE HG21 . 17904 1 221 . 1 1 40 40 ILE HG22 H 1 0.261 0.001 . . . . . A 35 ILE HG22 . 17904 1 222 . 1 1 40 40 ILE HG23 H 1 0.261 0.001 . . . . . A 35 ILE HG23 . 17904 1 223 . 1 1 40 40 ILE HD11 H 1 0.627 0.008 . . . . . A 35 ILE HD11 . 17904 1 224 . 1 1 40 40 ILE HD12 H 1 0.627 0.008 . . . . . A 35 ILE HD12 . 17904 1 225 . 1 1 40 40 ILE HD13 H 1 0.627 0.008 . . . . . A 35 ILE HD13 . 17904 1 226 . 1 1 41 41 PHE H H 1 7.890 0.001 . . . . . A 36 PHE H . 17904 1 227 . 1 1 41 41 PHE HA H 1 4.306 0.000 . . . . . A 36 PHE HA . 17904 1 228 . 1 1 41 41 PHE HB2 H 1 2.979 0.001 . . . . . A 36 PHE HB2 . 17904 1 229 . 1 1 41 41 PHE HB3 H 1 3.059 0.002 . . . . . A 36 PHE HB3 . 17904 1 230 . 1 1 41 41 PHE HD2 H 1 7.211 0.003 . . . . . A 36 PHE HD2 . 17904 1 231 . 1 1 41 41 PHE HE2 H 1 6.771 0.002 . . . . . A 36 PHE HE2 . 17904 1 232 . 1 1 41 41 PHE HZ H 1 7.068 0.001 . . . . . A 36 PHE HZ . 17904 1 233 . 1 1 42 42 GLY H H 1 8.792 0.003 . . . . . A 37 GLY H . 17904 1 234 . 1 1 42 42 GLY HA2 H 1 4.229 0.014 . . . . . A 37 GLY HA2 . 17904 1 235 . 1 1 43 43 ARG H H 1 7.974 0.002 . . . . . A 38 ARG H . 17904 1 236 . 1 1 43 43 ARG HA H 1 4.851 0.003 . . . . . A 38 ARG HA . 17904 1 237 . 1 1 43 43 ARG HB2 H 1 1.957 0.009 . . . . . A 38 ARG HB2 . 17904 1 238 . 1 1 43 43 ARG HB3 H 1 2.008 0.007 . . . . . A 38 ARG HB3 . 17904 1 239 . 1 1 43 43 ARG HG2 H 1 1.835 0.013 . . . . . A 38 ARG HG2 . 17904 1 240 . 1 1 43 43 ARG HG3 H 1 2.168 0.020 . . . . . A 38 ARG HG3 . 17904 1 241 . 1 1 43 43 ARG HD2 H 1 2.937 0.021 . . . . . A 38 ARG HD2 . 17904 1 242 . 1 1 43 43 ARG HD3 H 1 3.133 0.030 . . . . . A 38 ARG HD3 . 17904 1 243 . 1 1 44 44 HIS H H 1 7.894 0.002 . . . . . A 39 HIS H . 17904 1 244 . 1 1 44 44 HIS HA H 1 5.616 0.026 . . . . . A 39 HIS HA . 17904 1 245 . 1 1 44 44 HIS HB2 H 1 2.719 0.002 . . . . . A 39 HIS HB2 . 17904 1 246 . 1 1 44 44 HIS HB3 H 1 2.873 0.001 . . . . . A 39 HIS HB3 . 17904 1 247 . 1 1 44 44 HIS HD2 H 1 6.740 0.002 . . . . . A 39 HIS HD2 . 17904 1 248 . 1 1 44 44 HIS HE1 H 1 8.031 0.000 . . . . . A 39 HIS HE1 . 17904 1 249 . 1 1 45 45 SER H H 1 8.779 0.002 . . . . . A 40 SER H . 17904 1 250 . 1 1 45 45 SER HA H 1 5.06 0.002 . . . . . A 40 SER HA . 17904 1 251 . 1 1 45 45 SER HB2 H 1 3.602 0.000 . . . . . A 40 SER HB2 . 17904 1 252 . 1 1 45 45 SER HB3 H 1 3.766 0.000 . . . . . A 40 SER HB3 . 17904 1 253 . 1 1 46 46 GLY H H 1 8.279 0.007 . . . . . A 41 GLY H . 17904 1 254 . 1 1 46 46 GLY HA2 H 1 3.491 0.012 . . . . . A 41 GLY HA2 . 17904 1 255 . 1 1 46 46 GLY HA3 H 1 1.353 0.000 . . . . . A 41 GLY HA3 . 17904 1 256 . 1 1 47 47 GLN H H 1 8.725 0.003 . . . . . A 42 GLN H . 17904 1 257 . 1 1 47 47 GLN HA H 1 4.659 0.004 . . . . . A 42 GLN HA . 17904 1 258 . 1 1 47 47 GLN HB2 H 1 1.853 0.002 . . . . . A 42 GLN HB2 . 17904 1 259 . 1 1 47 47 GLN HG2 H 1 2.206 0.001 . . . . . A 42 GLN HG2 . 17904 1 260 . 1 1 47 47 GLN HG3 H 1 2.384 0.003 . . . . . A 42 GLN HG3 . 17904 1 261 . 1 1 47 47 GLN HE21 H 1 6.762 0.003 . . . . . A 42 GLN HE21 . 17904 1 262 . 1 1 48 48 ALA H H 1 8.725 0.003 . . . . . A 43 ALA H . 17904 1 263 . 1 1 48 48 ALA HA H 1 4.141 0.002 . . . . . A 43 ALA HA . 17904 1 264 . 1 1 48 48 ALA HB1 H 1 1.537 0.003 . . . . . A 43 ALA HB1 . 17904 1 265 . 1 1 48 48 ALA HB2 H 1 1.537 0.003 . . . . . A 43 ALA HB2 . 17904 1 266 . 1 1 48 48 ALA HB3 H 1 1.537 0.003 . . . . . A 43 ALA HB3 . 17904 1 267 . 1 1 49 49 GLU H H 1 8.863 0.000 . . . . . A 44 GLU H . 17904 1 268 . 1 1 49 49 GLU HA H 1 4.281 0.001 . . . . . A 44 GLU HA . 17904 1 269 . 1 1 49 49 GLU HB2 H 1 2.072 0.000 . . . . . A 44 GLU HB2 . 17904 1 270 . 1 1 49 49 GLU HB3 H 1 2.398 0.000 . . . . . A 44 GLU HB3 . 17904 1 271 . 1 1 49 49 GLU HG2 H 1 2.310 0.000 . . . . . A 44 GLU HG2 . 17904 1 272 . 1 1 50 50 GLY H H 1 8.861 0.001 . . . . . A 45 GLY H . 17904 1 273 . 1 1 50 50 GLY HA2 H 1 3.501 0.003 . . . . . A 45 GLY HA2 . 17904 1 274 . 1 1 51 51 TYR H H 1 7.208 0.002 . . . . . A 46 TYR H . 17904 1 275 . 1 1 51 51 TYR HA H 1 4.031 0.006 . . . . . A 46 TYR HA . 17904 1 276 . 1 1 51 51 TYR HB2 H 1 0.881 0.007 . . . . . A 46 TYR HB2 . 17904 1 277 . 1 1 51 51 TYR HB3 H 1 2.163 0.001 . . . . . A 46 TYR HB3 . 17904 1 278 . 1 1 51 51 TYR HD1 H 1 6.231 0.002 . . . . . A 46 TYR HD1 . 17904 1 279 . 1 1 51 51 TYR HE1 H 1 6.891 0.009 . . . . . A 46 TYR HE1 . 17904 1 280 . 1 1 52 52 SER H H 1 7.047 0.004 . . . . . A 47 SER H . 17904 1 281 . 1 1 52 52 SER HA H 1 4.411 0.005 . . . . . A 47 SER HA . 17904 1 282 . 1 1 52 52 SER HB2 H 1 3.401 0.003 . . . . . A 47 SER HB2 . 17904 1 283 . 1 1 52 52 SER HB3 H 1 3.564 0.000 . . . . . A 47 SER HB3 . 17904 1 284 . 1 1 53 53 TYR H H 1 8.290 0.002 . . . . . A 48 TYR H . 17904 1 285 . 1 1 53 53 TYR HA H 1 5.26 0.006 . . . . . A 48 TYR HA . 17904 1 286 . 1 1 53 53 TYR HB2 H 1 2.926 0.011 . . . . . A 48 TYR HB2 . 17904 1 287 . 1 1 53 53 TYR HB3 H 1 3.726 0.001 . . . . . A 48 TYR HB3 . 17904 1 288 . 1 1 53 53 TYR HD1 H 1 7.478 0.000 . . . . . A 48 TYR HD1 . 17904 1 289 . 1 1 53 53 TYR HD2 H 1 8.028 0.000 . . . . . A 48 TYR HD2 . 17904 1 290 . 1 1 53 53 TYR HE1 H 1 7.244 0.041 . . . . . A 48 TYR HE1 . 17904 1 291 . 1 1 53 53 TYR HE2 H 1 7.060 0.026 . . . . . A 48 TYR HE2 . 17904 1 292 . 1 1 53 53 TYR HH H 1 9.763 0.001 . . . . . A 48 TYR HH . 17904 1 293 . 1 1 54 54 THR H H 1 10.374 0.003 . . . . . A 49 THR H . 17904 1 294 . 1 1 54 54 THR HA H 1 4.521 0.002 . . . . . A 49 THR HA . 17904 1 295 . 1 1 54 54 THR HB H 1 4.732 0.003 . . . . . A 49 THR HB . 17904 1 296 . 1 1 54 54 THR HG21 H 1 1.786 0.014 . . . . . A 49 THR HG21 . 17904 1 297 . 1 1 54 54 THR HG22 H 1 1.786 0.014 . . . . . A 49 THR HG22 . 17904 1 298 . 1 1 54 54 THR HG23 H 1 1.786 0.014 . . . . . A 49 THR HG23 . 17904 1 299 . 1 1 55 55 ASP H H 1 8.689 0.003 . . . . . A 50 ASP H . 17904 1 300 . 1 1 55 55 ASP HA H 1 4.131 0.004 . . . . . A 50 ASP HA . 17904 1 301 . 1 1 55 55 ASP HB2 H 1 2.673 0.002 . . . . . A 50 ASP HB2 . 17904 1 302 . 1 1 56 56 ALA H H 1 7.709 0.003 . . . . . A 51 ALA H . 17904 1 303 . 1 1 56 56 ALA HA H 1 3.902 0.003 . . . . . A 51 ALA HA . 17904 1 304 . 1 1 56 56 ALA HB1 H 1 1.409 0.000 . . . . . A 51 ALA HB1 . 17904 1 305 . 1 1 56 56 ALA HB2 H 1 1.409 0.000 . . . . . A 51 ALA HB2 . 17904 1 306 . 1 1 56 56 ALA HB3 H 1 1.409 0.000 . . . . . A 51 ALA HB3 . 17904 1 307 . 1 1 57 57 ASN H H 1 8.285 0.002 . . . . . A 52 ASN H . 17904 1 308 . 1 1 57 57 ASN HA H 1 4.141 0.003 . . . . . A 52 ASN HA . 17904 1 309 . 1 1 57 57 ASN HB2 H 1 2.932 0.000 . . . . . A 52 ASN HB2 . 17904 1 310 . 1 1 57 57 ASN HB3 H 1 3.128 0.000 . . . . . A 52 ASN HB3 . 17904 1 311 . 1 1 58 58 ILE H H 1 7.708 0.004 . . . . . A 53 ILE H . 17904 1 312 . 1 1 58 58 ILE HA H 1 3.354 0.024 . . . . . A 53 ILE HA . 17904 1 313 . 1 1 58 58 ILE HB H 1 1.848 0.016 . . . . . A 53 ILE HB . 17904 1 314 . 1 1 58 58 ILE HG12 H 1 1.073 0.011 . . . . . A 53 ILE HG12 . 17904 1 315 . 1 1 58 58 ILE HG21 H 1 0.932 0.014 . . . . . A 53 ILE HG21 . 17904 1 316 . 1 1 58 58 ILE HG22 H 1 0.932 0.014 . . . . . A 53 ILE HG22 . 17904 1 317 . 1 1 58 58 ILE HG23 H 1 0.932 0.014 . . . . . A 53 ILE HG23 . 17904 1 318 . 1 1 58 58 ILE HD11 H 1 1.073 0.011 . . . . . A 53 ILE HD11 . 17904 1 319 . 1 1 58 58 ILE HD12 H 1 1.073 0.011 . . . . . A 53 ILE HD12 . 17904 1 320 . 1 1 58 58 ILE HD13 H 1 1.073 0.011 . . . . . A 53 ILE HD13 . 17904 1 321 . 1 1 59 59 LYS H H 1 9.160 0.002 . . . . . A 54 LYS H . 17904 1 322 . 1 1 59 59 LYS HA H 1 3.874 0.004 . . . . . A 54 LYS HA . 17904 1 323 . 1 1 59 59 LYS HB2 H 1 1.723 0.001 . . . . . A 54 LYS HB2 . 17904 1 324 . 1 1 59 59 LYS HB3 H 1 1.860 0.000 . . . . . A 54 LYS HB3 . 17904 1 325 . 1 1 59 59 LYS HG2 H 1 1.442 0.005 . . . . . A 54 LYS HG2 . 17904 1 326 . 1 1 59 59 LYS HG3 H 1 1.516 0.006 . . . . . A 54 LYS HG3 . 17904 1 327 . 1 1 59 59 LYS HD2 H 1 1.587 0.003 . . . . . A 54 LYS HD2 . 17904 1 328 . 1 1 60 60 LYS H H 1 7.484 0.005 . . . . . A 55 LYS H . 17904 1 329 . 1 1 60 60 LYS HA H 1 3.834 0.003 . . . . . A 55 LYS HA . 17904 1 330 . 1 1 60 60 LYS HB2 H 1 1.799 0.002 . . . . . A 55 LYS HB2 . 17904 1 331 . 1 1 60 60 LYS HB3 H 1 1.907 0.006 . . . . . A 55 LYS HB3 . 17904 1 332 . 1 1 61 61 ASN H H 1 7.052 0.004 . . . . . A 56 ASN H . 17904 1 333 . 1 1 61 61 ASN HA H 1 4.297 0.002 . . . . . A 56 ASN HA . 17904 1 334 . 1 1 61 61 ASN HB2 H 1 3.015 0.000 . . . . . A 56 ASN HB2 . 17904 1 335 . 1 1 61 61 ASN HD21 H 1 6.297 0.013 . . . . . A 56 ASN HD21 . 17904 1 336 . 1 1 61 61 ASN HD22 H 1 7.789 0.003 . . . . . A 56 ASN HD22 . 17904 1 337 . 1 1 62 62 VAL H H 1 7.420 0.003 . . . . . A 57 VAL H . 17904 1 338 . 1 1 62 62 VAL HA H 1 3.708 0.001 . . . . . A 57 VAL HA . 17904 1 339 . 1 1 62 62 VAL HB H 1 1.347 0.001 . . . . . A 57 VAL HB . 17904 1 340 . 1 1 62 62 VAL HG11 H 1 -0.262 0.007 . . . . . A 57 VAL HG11 . 17904 1 341 . 1 1 62 62 VAL HG12 H 1 -0.262 0.007 . . . . . A 57 VAL HG12 . 17904 1 342 . 1 1 62 62 VAL HG13 H 1 -0.262 0.007 . . . . . A 57 VAL HG13 . 17904 1 343 . 1 1 62 62 VAL HG21 H 1 0.425 0.007 . . . . . A 57 VAL HG21 . 17904 1 344 . 1 1 62 62 VAL HG22 H 1 0.425 0.007 . . . . . A 57 VAL HG22 . 17904 1 345 . 1 1 62 62 VAL HG23 H 1 0.425 0.007 . . . . . A 57 VAL HG23 . 17904 1 346 . 1 1 63 63 LEU H H 1 8.346 0.005 . . . . . A 58 LEU H . 17904 1 347 . 1 1 63 63 LEU HA H 1 3.841 0.029 . . . . . A 58 LEU HA . 17904 1 348 . 1 1 63 63 LEU HB2 H 1 1.627 0.008 . . . . . A 58 LEU HB2 . 17904 1 349 . 1 1 63 63 LEU HB3 H 1 0.827 0.012 . . . . . A 58 LEU HB3 . 17904 1 350 . 1 1 63 63 LEU HG H 1 1.034 0.021 . . . . . A 58 LEU HG . 17904 1 351 . 1 1 63 63 LEU HD11 H 1 0.248 0.004 . . . . . A 58 LEU HD11 . 17904 1 352 . 1 1 63 63 LEU HD12 H 1 0.248 0.004 . . . . . A 58 LEU HD12 . 17904 1 353 . 1 1 63 63 LEU HD13 H 1 0.248 0.004 . . . . . A 58 LEU HD13 . 17904 1 354 . 1 1 63 63 LEU HD21 H 1 0.650 0.017 . . . . . A 58 LEU HD21 . 17904 1 355 . 1 1 63 63 LEU HD22 H 1 0.650 0.017 . . . . . A 58 LEU HD22 . 17904 1 356 . 1 1 63 63 LEU HD23 H 1 0.650 0.017 . . . . . A 58 LEU HD23 . 17904 1 357 . 1 1 64 64 TRP H H 1 8.014 0.002 . . . . . A 59 TRP H . 17904 1 358 . 1 1 64 64 TRP HA H 1 5.061 0.006 . . . . . A 59 TRP HA . 17904 1 359 . 1 1 64 64 TRP HB2 H 1 2.597 0.005 . . . . . A 59 TRP HB2 . 17904 1 360 . 1 1 64 64 TRP HB3 H 1 3.167 0.007 . . . . . A 59 TRP HB3 . 17904 1 361 . 1 1 64 64 TRP HD1 H 1 8.041 0.003 . . . . . A 59 TRP HD1 . 17904 1 362 . 1 1 64 64 TRP HE1 H 1 8.927 0.011 . . . . . A 59 TRP HE1 . 17904 1 363 . 1 1 64 64 TRP HE3 H 1 7.598 0.003 . . . . . A 59 TRP HE3 . 17904 1 364 . 1 1 64 64 TRP HZ2 H 1 7.340 0.000 . . . . . A 59 TRP HZ2 . 17904 1 365 . 1 1 64 64 TRP HZ3 H 1 6.665 0.005 . . . . . A 59 TRP HZ3 . 17904 1 366 . 1 1 64 64 TRP HH2 H 1 5.771 0.001 . . . . . A 59 TRP HH2 . 17904 1 367 . 1 1 65 65 ASP H H 1 9.639 0.003 . . . . . A 60 ASP H . 17904 1 368 . 1 1 65 65 ASP HA H 1 4.982 0.003 . . . . . A 60 ASP HA . 17904 1 369 . 1 1 65 65 ASP HB2 H 1 2.819 0.000 . . . . . A 60 ASP HB2 . 17904 1 370 . 1 1 65 65 ASP HB3 H 1 3.069 0.001 . . . . . A 60 ASP HB3 . 17904 1 371 . 1 1 66 66 GLU H H 1 10.320 0.002 . . . . . A 61 GLU H . 17904 1 372 . 1 1 66 66 GLU HA H 1 3.665 0.023 . . . . . A 61 GLU HA . 17904 1 373 . 1 1 66 66 GLU HB2 H 1 1.085 0.009 . . . . . A 61 GLU HB2 . 17904 1 374 . 1 1 66 66 GLU HB3 H 1 1.516 0.003 . . . . . A 61 GLU HB3 . 17904 1 375 . 1 1 66 66 GLU HG2 H 1 2.722 0.005 . . . . . A 61 GLU HG2 . 17904 1 376 . 1 1 66 66 GLU HG3 H 1 2.886 0.003 . . . . . A 61 GLU HG3 . 17904 1 377 . 1 1 67 67 ASN H H 1 8.337 0.003 . . . . . A 62 ASN H . 17904 1 378 . 1 1 67 67 ASN HA H 1 4.621 0.007 . . . . . A 62 ASN HA . 17904 1 379 . 1 1 67 67 ASN HB2 H 1 2.875 0.001 . . . . . A 62 ASN HB2 . 17904 1 380 . 1 1 67 67 ASN HB3 H 1 2.950 0.000 . . . . . A 62 ASN HB3 . 17904 1 381 . 1 1 68 68 ASN H H 1 9.641 0.002 . . . . . A 63 ASN H . 17904 1 382 . 1 1 68 68 ASN HA H 1 4.569 0.002 . . . . . A 63 ASN HA . 17904 1 383 . 1 1 68 68 ASN HB2 H 1 2.871 0.000 . . . . . A 63 ASN HB2 . 17904 1 384 . 1 1 68 68 ASN HB3 H 1 3.071 0.002 . . . . . A 63 ASN HB3 . 17904 1 385 . 1 1 68 68 ASN HD21 H 1 7.583 0.024 . . . . . A 63 ASN HD21 . 17904 1 386 . 1 1 68 68 ASN HD22 H 1 7.015 0.020 . . . . . A 63 ASN HD22 . 17904 1 387 . 1 1 69 69 MET H H 1 9.001 0.007 . . . . . A 64 MET H . 17904 1 388 . 1 1 69 69 MET HB2 H 1 2.242 0.002 . . . . . A 64 MET HB2 . 17904 1 389 . 1 1 69 69 MET HB3 H 1 2.740 0.003 . . . . . A 64 MET HB3 . 17904 1 390 . 1 1 69 69 MET HE1 H 1 1.231 0.004 . . . . . A 64 MET HE1 . 17904 1 391 . 1 1 69 69 MET HE2 H 1 1.231 0.004 . . . . . A 64 MET HE2 . 17904 1 392 . 1 1 69 69 MET HE3 H 1 1.231 0.004 . . . . . A 64 MET HE3 . 17904 1 393 . 1 1 70 70 SER H H 1 7.867 0.005 . . . . . A 65 SER H . 17904 1 394 . 1 1 70 70 SER HA H 1 3.915 0.008 . . . . . A 65 SER HA . 17904 1 395 . 1 1 71 71 GLU H H 1 7.837 0.007 . . . . . A 66 GLU H . 17904 1 396 . 1 1 71 71 GLU HA H 1 3.840 0.003 . . . . . A 66 GLU HA . 17904 1 397 . 1 1 71 71 GLU HB2 H 1 2.082 0.024 . . . . . A 66 GLU HB2 . 17904 1 398 . 1 1 71 71 GLU HB3 H 1 2.306 0.002 . . . . . A 66 GLU HB3 . 17904 1 399 . 1 1 72 72 TYR H H 1 8.463 0.005 . . . . . A 67 TYR H . 17904 1 400 . 1 1 72 72 TYR HA H 1 3.869 0.002 . . . . . A 67 TYR HA . 17904 1 401 . 1 1 72 72 TYR HB2 H 1 3.036 0.003 . . . . . A 67 TYR HB2 . 17904 1 402 . 1 1 72 72 TYR HB3 H 1 3.146 0.009 . . . . . A 67 TYR HB3 . 17904 1 403 . 1 1 72 72 TYR HD1 H 1 7.161 0.005 . . . . . A 67 TYR HD1 . 17904 1 404 . 1 1 72 72 TYR HD2 H 1 7.222 0.007 . . . . . A 67 TYR HD2 . 17904 1 405 . 1 1 72 72 TYR HE1 H 1 7.389 0.001 . . . . . A 67 TYR HE1 . 17904 1 406 . 1 1 72 72 TYR HE2 H 1 7.651 0.003 . . . . . A 67 TYR HE2 . 17904 1 407 . 1 1 73 73 LEU H H 1 8.164 0.002 . . . . . A 68 LEU H . 17904 1 408 . 1 1 73 73 LEU HA H 1 3.377 0.009 . . . . . A 68 LEU HA . 17904 1 409 . 1 1 73 73 LEU HB2 H 1 1.243 0.002 . . . . . A 68 LEU HB2 . 17904 1 410 . 1 1 73 73 LEU HB3 H 1 1.804 0.004 . . . . . A 68 LEU HB3 . 17904 1 411 . 1 1 73 73 LEU HG H 1 2.120 0.004 . . . . . A 68 LEU HG . 17904 1 412 . 1 1 73 73 LEU HD11 H 1 1.118 0.003 . . . . . A 68 LEU HD11 . 17904 1 413 . 1 1 73 73 LEU HD12 H 1 1.118 0.003 . . . . . A 68 LEU HD12 . 17904 1 414 . 1 1 73 73 LEU HD13 H 1 1.118 0.003 . . . . . A 68 LEU HD13 . 17904 1 415 . 1 1 73 73 LEU HD21 H 1 0.251 0.003 . . . . . A 68 LEU HD21 . 17904 1 416 . 1 1 73 73 LEU HD22 H 1 0.251 0.003 . . . . . A 68 LEU HD22 . 17904 1 417 . 1 1 73 73 LEU HD23 H 1 0.251 0.003 . . . . . A 68 LEU HD23 . 17904 1 418 . 1 1 74 74 THR H H 1 7.428 0.011 . . . . . A 69 THR H . 17904 1 419 . 1 1 74 74 THR HA H 1 3.811 0.001 . . . . . A 69 THR HA . 17904 1 420 . 1 1 74 74 THR HB H 1 4.127 0.002 . . . . . A 69 THR HB . 17904 1 421 . 1 1 74 74 THR HG21 H 1 1.102 0.000 . . . . . A 69 THR HG21 . 17904 1 422 . 1 1 74 74 THR HG22 H 1 1.102 0.000 . . . . . A 69 THR HG22 . 17904 1 423 . 1 1 74 74 THR HG23 H 1 1.102 0.000 . . . . . A 69 THR HG23 . 17904 1 424 . 1 1 75 75 ASN H H 1 6.486 0.008 . . . . . A 70 ASN H . 17904 1 425 . 1 1 75 75 ASN HA H 1 4.317 0.000 . . . . . A 70 ASN HA . 17904 1 426 . 1 1 75 75 ASN HB2 H 1 2.646 0.000 . . . . . A 70 ASN HB2 . 17904 1 427 . 1 1 75 75 ASN HB3 H 1 2.705 0.000 . . . . . A 70 ASN HB3 . 17904 1 428 . 1 1 76 76 HIS H H 1 9.673 0.016 . . . . . A 71 HIS H . 17904 1 429 . 1 1 76 76 HIS HA H 1 4.215 0.024 . . . . . A 71 HIS HA . 17904 1 430 . 1 1 76 76 HIS HB2 H 1 3.046 0.018 . . . . . A 71 HIS HB2 . 17904 1 431 . 1 1 76 76 HIS HB3 H 1 2.829 0.014 . . . . . A 71 HIS HB3 . 17904 1 432 . 1 1 76 76 HIS HD2 H 1 7.389 0.003 . . . . . A 71 HIS HD2 . 17904 1 433 . 1 1 76 76 HIS HE1 H 1 9.566 0.001 . . . . . A 71 HIS HE1 . 17904 1 434 . 1 1 77 77 ALA H H 1 7.763 0.008 . . . . . A 72 ALA H . 17904 1 435 . 1 1 77 77 ALA HA H 1 3.898 0.016 . . . . . A 72 ALA HA . 17904 1 436 . 1 1 77 77 ALA HB1 H 1 1.519 0.004 . . . . . A 72 ALA HB1 . 17904 1 437 . 1 1 77 77 ALA HB2 H 1 1.519 0.004 . . . . . A 72 ALA HB2 . 17904 1 438 . 1 1 77 77 ALA HB3 H 1 1.519 0.004 . . . . . A 72 ALA HB3 . 17904 1 439 . 1 1 78 78 LYS H H 1 7.163 0.002 . . . . . A 73 LYS H . 17904 1 440 . 1 1 78 78 LYS HA H 1 4.214 0.000 . . . . . A 73 LYS HA . 17904 1 441 . 1 1 78 78 LYS HB2 H 1 1.677 0.005 . . . . . A 73 LYS HB2 . 17904 1 442 . 1 1 78 78 LYS HB3 H 1 1.746 0.000 . . . . . A 73 LYS HB3 . 17904 1 443 . 1 1 79 79 TYR H H 1 7.351 0.002 . . . . . A 74 TYR H . 17904 1 444 . 1 1 79 79 TYR HA H 1 4.093 0.003 . . . . . A 74 TYR HA . 17904 1 445 . 1 1 79 79 TYR HB2 H 1 3.158 0.005 . . . . . A 74 TYR HB2 . 17904 1 446 . 1 1 79 79 TYR HD2 H 1 7.223 0.005 . . . . . A 74 TYR HD2 . 17904 1 447 . 1 1 79 79 TYR HE2 H 1 6.672 0.026 . . . . . A 74 TYR HE2 . 17904 1 448 . 1 1 80 80 ILE H H 1 8.335 0.005 . . . . . A 75 ILE H . 17904 1 449 . 1 1 80 80 ILE HA H 1 4.103 0.000 . . . . . A 75 ILE HA . 17904 1 450 . 1 1 80 80 ILE HB H 1 2.037 0.001 . . . . . A 75 ILE HB . 17904 1 451 . 1 1 80 80 ILE HG21 H 1 0.654 0.006 . . . . . A 75 ILE HG21 . 17904 1 452 . 1 1 80 80 ILE HG22 H 1 0.654 0.006 . . . . . A 75 ILE HG22 . 17904 1 453 . 1 1 80 80 ILE HG23 H 1 0.654 0.006 . . . . . A 75 ILE HG23 . 17904 1 454 . 1 1 80 80 ILE HD11 H 1 0.908 0.114 . . . . . A 75 ILE HD11 . 17904 1 455 . 1 1 80 80 ILE HD12 H 1 0.908 0.114 . . . . . A 75 ILE HD12 . 17904 1 456 . 1 1 80 80 ILE HD13 H 1 0.908 0.114 . . . . . A 75 ILE HD13 . 17904 1 457 . 1 1 81 81 PRO HB2 H 1 2.226 0.000 . . . . . A 76 PRO HB2 . 17904 1 458 . 1 1 81 81 PRO HB3 H 1 1.955 0.000 . . . . . A 76 PRO HB3 . 17904 1 459 . 1 1 81 81 PRO HG2 H 1 0.621 0.000 . . . . . A 76 PRO HG2 . 17904 1 460 . 1 1 81 81 PRO HD2 H 1 3.001 0.000 . . . . . A 76 PRO HD2 . 17904 1 461 . 1 1 82 82 GLY H H 1 8.794 0.004 . . . . . A 77 GLY H . 17904 1 462 . 1 1 82 82 GLY HA2 H 1 3.627 0.008 . . . . . A 77 GLY HA2 . 17904 1 463 . 1 1 82 82 GLY HA3 H 1 4.280 0.000 . . . . . A 77 GLY HA3 . 17904 1 464 . 1 1 83 83 THR H H 1 8.171 0.002 . . . . . A 78 THR H . 17904 1 465 . 1 1 83 83 THR HA H 1 4.691 0.003 . . . . . A 78 THR HA . 17904 1 466 . 1 1 83 83 THR HB H 1 4.333 0.005 . . . . . A 78 THR HB . 17904 1 467 . 1 1 83 83 THR HG21 H 1 0.829 0.004 . . . . . A 78 THR HG21 . 17904 1 468 . 1 1 83 83 THR HG22 H 1 0.829 0.004 . . . . . A 78 THR HG22 . 17904 1 469 . 1 1 83 83 THR HG23 H 1 0.829 0.004 . . . . . A 78 THR HG23 . 17904 1 470 . 1 1 84 84 LYS H H 1 8.790 0.001 . . . . . A 79 LYS H . 17904 1 471 . 1 1 84 84 LYS HA H 1 4.293 0.001 . . . . . A 79 LYS HA . 17904 1 472 . 1 1 85 85 MET H H 1 7.058 0.003 . . . . . A 80 MET H . 17904 1 473 . 1 1 85 85 MET HA H 1 3.102 0.021 . . . . . A 80 MET HA . 17904 1 474 . 1 1 85 85 MET HB2 H 1 -2.402 0.003 . . . . . A 80 MET HB2 . 17904 1 475 . 1 1 85 85 MET HB3 H 1 -0.477 0.004 . . . . . A 80 MET HB3 . 17904 1 476 . 1 1 85 85 MET HG2 H 1 -3.760 0.001 . . . . . A 80 MET HG2 . 17904 1 477 . 1 1 85 85 MET HG3 H 1 -2.531 0.002 . . . . . A 80 MET HG3 . 17904 1 478 . 1 1 85 85 MET HE1 H 1 -3.745 0.002 . . . . . A 80 MET HE1 . 17904 1 479 . 1 1 85 85 MET HE2 H 1 -3.745 0.002 . . . . . A 80 MET HE2 . 17904 1 480 . 1 1 85 85 MET HE3 H 1 -3.745 0.002 . . . . . A 80 MET HE3 . 17904 1 481 . 1 1 86 86 ALA H H 1 8.152 0.001 . . . . . A 81 ALA H . 17904 1 482 . 1 1 86 86 ALA HA H 1 4.212 0.001 . . . . . A 81 ALA HA . 17904 1 483 . 1 1 86 86 ALA HB1 H 1 1.377 0.003 . . . . . A 81 ALA HB1 . 17904 1 484 . 1 1 86 86 ALA HB2 H 1 1.377 0.003 . . . . . A 81 ALA HB2 . 17904 1 485 . 1 1 86 86 ALA HB3 H 1 1.377 0.003 . . . . . A 81 ALA HB3 . 17904 1 486 . 1 1 87 87 PHE H H 1 6.361 0.001 . . . . . A 82 PHE H . 17904 1 487 . 1 1 87 87 PHE HA H 1 4.369 0.003 . . . . . A 82 PHE HA . 17904 1 488 . 1 1 87 87 PHE HB2 H 1 0.630 0.013 . . . . . A 82 PHE HB2 . 17904 1 489 . 1 1 87 87 PHE HB3 H 1 2.153 0.000 . . . . . A 82 PHE HB3 . 17904 1 490 . 1 1 87 87 PHE HD1 H 1 6.780 0.006 . . . . . A 82 PHE HD1 . 17904 1 491 . 1 1 87 87 PHE HE1 H 1 7.353 0.003 . . . . . A 82 PHE HE1 . 17904 1 492 . 1 1 87 87 PHE HZ H 1 7.206 0.005 . . . . . A 82 PHE HZ . 17904 1 493 . 1 1 89 89 GLY H H 1 8.982 0.001 . . . . . A 84 GLY H . 17904 1 494 . 1 1 89 89 GLY HA2 H 1 3.841 0.002 . . . . . A 84 GLY HA2 . 17904 1 495 . 1 1 89 89 GLY HA3 H 1 4.321 0.005 . . . . . A 84 GLY HA3 . 17904 1 496 . 1 1 90 90 LEU H H 1 8.462 0.000 . . . . . A 85 LEU H . 17904 1 497 . 1 1 90 90 LEU HB2 H 1 1.511 0.002 . . . . . A 85 LEU HB2 . 17904 1 498 . 1 1 90 90 LEU HB3 H 1 1.652 0.002 . . . . . A 85 LEU HB3 . 17904 1 499 . 1 1 90 90 LEU HD11 H 1 1.095 0.001 . . . . . A 85 LEU HD11 . 17904 1 500 . 1 1 90 90 LEU HD12 H 1 1.095 0.001 . . . . . A 85 LEU HD12 . 17904 1 501 . 1 1 90 90 LEU HD13 H 1 1.095 0.001 . . . . . A 85 LEU HD13 . 17904 1 502 . 1 1 90 90 LEU HD21 H 1 1.083 0.025 . . . . . A 85 LEU HD21 . 17904 1 503 . 1 1 90 90 LEU HD22 H 1 1.083 0.025 . . . . . A 85 LEU HD22 . 17904 1 504 . 1 1 90 90 LEU HD23 H 1 1.083 0.025 . . . . . A 85 LEU HD23 . 17904 1 505 . 1 1 91 91 LYS H H 1 8.707 0.001 . . . . . A 86 LYS H . 17904 1 506 . 1 1 91 91 LYS HA H 1 3.968 0.000 . . . . . A 86 LYS HA . 17904 1 507 . 1 1 91 91 LYS HB2 H 1 1.799 0.001 . . . . . A 86 LYS HB2 . 17904 1 508 . 1 1 91 91 LYS HG2 H 1 1.191 0.003 . . . . . A 86 LYS HG2 . 17904 1 509 . 1 1 92 92 LYS H H 1 8.984 0.003 . . . . . A 87 LYS H . 17904 1 510 . 1 1 92 92 LYS HA H 1 4.791 0.002 . . . . . A 87 LYS HA . 17904 1 511 . 1 1 92 92 LYS HB2 H 1 1.827 0.002 . . . . . A 87 LYS HB2 . 17904 1 512 . 1 1 92 92 LYS HB3 H 1 1.885 0.000 . . . . . A 87 LYS HB3 . 17904 1 513 . 1 1 92 92 LYS HG2 H 1 1.573 0.000 . . . . . A 87 LYS HG2 . 17904 1 514 . 1 1 92 92 LYS HG3 H 1 1.421 0.000 . . . . . A 87 LYS HG3 . 17904 1 515 . 1 1 92 92 LYS HD2 H 1 1.573 0.000 . . . . . A 87 LYS HD2 . 17904 1 516 . 1 1 92 92 LYS HD3 H 1 1.421 0.000 . . . . . A 87 LYS HD3 . 17904 1 517 . 1 1 93 93 GLU H H 1 9.115 0.009 . . . . . A 88 GLU H . 17904 1 518 . 1 1 93 93 GLU HA H 1 3.847 0.035 . . . . . A 88 GLU HA . 17904 1 519 . 1 1 93 93 GLU HB2 H 1 2.004 0.016 . . . . . A 88 GLU HB2 . 17904 1 520 . 1 1 93 93 GLU HB3 H 1 2.236 0.018 . . . . . A 88 GLU HB3 . 17904 1 521 . 1 1 93 93 GLU HG2 H 1 2.490 0.017 . . . . . A 88 GLU HG2 . 17904 1 522 . 1 1 93 93 GLU HG3 H 1 2.769 0.019 . . . . . A 88 GLU HG3 . 17904 1 523 . 1 1 94 94 LYS H H 1 8.809 0.004 . . . . . A 89 LYS H . 17904 1 524 . 1 1 94 94 LYS HA H 1 3.968 0.000 . . . . . A 89 LYS HA . 17904 1 525 . 1 1 94 94 LYS HB2 H 1 1.720 0.004 . . . . . A 89 LYS HB2 . 17904 1 526 . 1 1 94 94 LYS HB3 H 1 1.858 0.001 . . . . . A 89 LYS HB3 . 17904 1 527 . 1 1 94 94 LYS HG2 H 1 1.492 0.000 . . . . . A 89 LYS HG2 . 17904 1 528 . 1 1 94 94 LYS HG3 H 1 1.567 0.000 . . . . . A 89 LYS HG3 . 17904 1 529 . 1 1 95 95 ASP H H 1 6.540 0.006 . . . . . A 90 ASP H . 17904 1 530 . 1 1 95 95 ASP HA H 1 4.019 0.088 . . . . . A 90 ASP HA . 17904 1 531 . 1 1 95 95 ASP HB2 H 1 2.633 0.020 . . . . . A 90 ASP HB2 . 17904 1 532 . 1 1 95 95 ASP HB3 H 1 2.957 0.017 . . . . . A 90 ASP HB3 . 17904 1 533 . 1 1 96 96 ARG H H 1 7.653 0.003 . . . . . A 91 ARG H . 17904 1 534 . 1 1 96 96 ARG HA H 1 3.937 0.020 . . . . . A 91 ARG HA . 17904 1 535 . 1 1 96 96 ARG HB2 H 1 2.222 0.003 . . . . . A 91 ARG HB2 . 17904 1 536 . 1 1 96 96 ARG HB3 H 1 2.012 0.003 . . . . . A 91 ARG HB3 . 17904 1 537 . 1 1 96 96 ARG HG2 H 1 1.229 0.002 . . . . . A 91 ARG HG2 . 17904 1 538 . 1 1 96 96 ARG HG3 H 1 1.741 0.002 . . . . . A 91 ARG HG3 . 17904 1 539 . 1 1 97 97 ASN H H 1 8.843 0.001 . . . . . A 92 ASN H . 17904 1 540 . 1 1 97 97 ASN HA H 1 3.970 0.003 . . . . . A 92 ASN HA . 17904 1 541 . 1 1 97 97 ASN HB2 H 1 2.805 0.001 . . . . . A 92 ASN HB2 . 17904 1 542 . 1 1 97 97 ASN HB3 H 1 3.005 0.002 . . . . . A 92 ASN HB3 . 17904 1 543 . 1 1 97 97 ASN HD21 H 1 7.082 0.000 . . . . . A 92 ASN HD21 . 17904 1 544 . 1 1 97 97 ASN HD22 H 1 7.216 0.000 . . . . . A 92 ASN HD22 . 17904 1 545 . 1 1 98 98 ASP H H 1 8.850 0.007 . . . . . A 93 ASP H . 17904 1 546 . 1 1 98 98 ASP HA H 1 4.262 0.020 . . . . . A 93 ASP HA . 17904 1 547 . 1 1 98 98 ASP HB2 H 1 3.053 0.018 . . . . . A 93 ASP HB2 . 17904 1 548 . 1 1 98 98 ASP HB3 H 1 2.799 0.010 . . . . . A 93 ASP HB3 . 17904 1 549 . 1 1 99 99 LEU H H 1 8.711 0.006 . . . . . A 94 LEU H . 17904 1 550 . 1 1 99 99 LEU HA H 1 4.250 0.018 . . . . . A 94 LEU HA . 17904 1 551 . 1 1 99 99 LEU HB2 H 1 2.209 0.000 . . . . . A 94 LEU HB2 . 17904 1 552 . 1 1 99 99 LEU HB3 H 1 2.058 0.000 . . . . . A 94 LEU HB3 . 17904 1 553 . 1 1 99 99 LEU HD11 H 1 1.219 0.000 . . . . . A 94 LEU HD11 . 17904 1 554 . 1 1 99 99 LEU HD12 H 1 1.219 0.000 . . . . . A 94 LEU HD12 . 17904 1 555 . 1 1 99 99 LEU HD13 H 1 1.219 0.000 . . . . . A 94 LEU HD13 . 17904 1 556 . 1 1 99 99 LEU HD21 H 1 1.501 0.006 . . . . . A 94 LEU HD21 . 17904 1 557 . 1 1 99 99 LEU HD22 H 1 1.501 0.006 . . . . . A 94 LEU HD22 . 17904 1 558 . 1 1 99 99 LEU HD23 H 1 1.501 0.006 . . . . . A 94 LEU HD23 . 17904 1 559 . 1 1 100 100 ILE H H 1 9.304 0.003 . . . . . A 95 ILE H . 17904 1 560 . 1 1 100 100 ILE HA H 1 3.653 0.032 . . . . . A 95 ILE HA . 17904 1 561 . 1 1 100 100 ILE HB H 1 2.176 0.014 . . . . . A 95 ILE HB . 17904 1 562 . 1 1 100 100 ILE HG12 H 1 2.054 0.015 . . . . . A 95 ILE HG12 . 17904 1 563 . 1 1 100 100 ILE HG21 H 1 0.617 0.014 . . . . . A 95 ILE HG21 . 17904 1 564 . 1 1 100 100 ILE HG22 H 1 0.617 0.014 . . . . . A 95 ILE HG22 . 17904 1 565 . 1 1 100 100 ILE HG23 H 1 0.617 0.014 . . . . . A 95 ILE HG23 . 17904 1 566 . 1 1 100 100 ILE HD11 H 1 1.098 0.012 . . . . . A 95 ILE HD11 . 17904 1 567 . 1 1 100 100 ILE HD12 H 1 1.098 0.012 . . . . . A 95 ILE HD12 . 17904 1 568 . 1 1 100 100 ILE HD13 H 1 1.098 0.012 . . . . . A 95 ILE HD13 . 17904 1 569 . 1 1 101 101 THR H H 1 8.346 0.005 . . . . . A 96 THR H . 17904 1 570 . 1 1 101 101 THR HA H 1 3.890 0.001 . . . . . A 96 THR HA . 17904 1 571 . 1 1 101 101 THR HB H 1 4.161 0.003 . . . . . A 96 THR HB . 17904 1 572 . 1 1 101 101 THR HG21 H 1 1.396 0.009 . . . . . A 96 THR HG21 . 17904 1 573 . 1 1 101 101 THR HG22 H 1 1.396 0.009 . . . . . A 96 THR HG22 . 17904 1 574 . 1 1 101 101 THR HG23 H 1 1.396 0.009 . . . . . A 96 THR HG23 . 17904 1 575 . 1 1 102 102 TYR H H 1 8.017 0.005 . . . . . A 97 TYR H . 17904 1 576 . 1 1 102 102 TYR HA H 1 4.129 0.000 . . . . . A 97 TYR HA . 17904 1 577 . 1 1 102 102 TYR HB2 H 1 3.692 0.008 . . . . . A 97 TYR HB2 . 17904 1 578 . 1 1 102 102 TYR HB3 H 1 3.851 0.003 . . . . . A 97 TYR HB3 . 17904 1 579 . 1 1 102 102 TYR HD2 H 1 7.001 0.003 . . . . . A 97 TYR HD2 . 17904 1 580 . 1 1 102 102 TYR HE2 H 1 6.242 0.013 . . . . . A 97 TYR HE2 . 17904 1 581 . 1 1 103 103 LEU H H 1 9.407 0.001 . . . . . A 98 LEU H . 17904 1 582 . 1 1 103 103 LEU HA H 1 3.360 0.003 . . . . . A 98 LEU HA . 17904 1 583 . 1 1 103 103 LEU HB2 H 1 1.916 0.002 . . . . . A 98 LEU HB2 . 17904 1 584 . 1 1 103 103 LEU HB3 H 1 2.008 0.010 . . . . . A 98 LEU HB3 . 17904 1 585 . 1 1 103 103 LEU HG H 1 1.690 0.000 . . . . . A 98 LEU HG . 17904 1 586 . 1 1 103 103 LEU HD11 H 1 0.827 0.008 . . . . . A 98 LEU HD11 . 17904 1 587 . 1 1 103 103 LEU HD12 H 1 0.827 0.008 . . . . . A 98 LEU HD12 . 17904 1 588 . 1 1 103 103 LEU HD13 H 1 0.827 0.008 . . . . . A 98 LEU HD13 . 17904 1 589 . 1 1 103 103 LEU HD21 H 1 0.865 0.006 . . . . . A 98 LEU HD21 . 17904 1 590 . 1 1 103 103 LEU HD22 H 1 0.865 0.006 . . . . . A 98 LEU HD22 . 17904 1 591 . 1 1 103 103 LEU HD23 H 1 0.865 0.006 . . . . . A 98 LEU HD23 . 17904 1 592 . 1 1 104 104 LYS H H 1 8.846 0.002 . . . . . A 99 LYS H . 17904 1 593 . 1 1 104 104 LYS HA H 1 3.492 0.004 . . . . . A 99 LYS HA . 17904 1 594 . 1 1 104 104 LYS HB2 H 1 1.361 0.001 . . . . . A 99 LYS HB2 . 17904 1 595 . 1 1 104 104 LYS HB3 H 1 1.566 0.005 . . . . . A 99 LYS HB3 . 17904 1 596 . 1 1 104 104 LYS HE2 H 1 2.609 0.002 . . . . . A 99 LYS HE2 . 17904 1 597 . 1 1 105 105 LYS H H 1 6.661 0.007 . . . . . A 100 LYS H . 17904 1 598 . 1 1 105 105 LYS HA H 1 4.123 0.004 . . . . . A 100 LYS HA . 17904 1 599 . 1 1 105 105 LYS HB2 H 1 1.418 0.015 . . . . . A 100 LYS HB2 . 17904 1 600 . 1 1 105 105 LYS HB3 H 1 1.810 0.018 . . . . . A 100 LYS HB3 . 17904 1 601 . 1 1 105 105 LYS HE2 H 1 2.914 0.021 . . . . . A 100 LYS HE2 . 17904 1 602 . 1 1 106 106 ALA H H 1 8.465 0.001 . . . . . A 101 ALA H . 17904 1 603 . 1 1 106 106 ALA HA H 1 3.931 0.000 . . . . . A 101 ALA HA . 17904 1 604 . 1 1 106 106 ALA HB1 H 1 0.553 0.008 . . . . . A 101 ALA HB1 . 17904 1 605 . 1 1 106 106 ALA HB2 H 1 0.553 0.008 . . . . . A 101 ALA HB2 . 17904 1 606 . 1 1 106 106 ALA HB3 H 1 0.553 0.008 . . . . . A 101 ALA HB3 . 17904 1 607 . 1 1 107 107 THR H H 1 7.385 0.004 . . . . . A 102 THR H . 17904 1 608 . 1 1 107 107 THR HA H 1 3.967 0.000 . . . . . A 102 THR HA . 17904 1 609 . 1 1 107 107 THR HB H 1 4.210 0.008 . . . . . A 102 THR HB . 17904 1 610 . 1 1 107 107 THR HG21 H 1 0.861 0.000 . . . . . A 102 THR HG21 . 17904 1 611 . 1 1 107 107 THR HG22 H 1 0.861 0.000 . . . . . A 102 THR HG22 . 17904 1 612 . 1 1 107 107 THR HG23 H 1 0.861 0.000 . . . . . A 102 THR HG23 . 17904 1 613 . 1 1 108 108 GLU H H 1 7.385 0.004 . . . . . A 103 GLU H . 17904 1 614 . 1 1 108 108 GLU HA H 1 3.974 0.000 . . . . . A 103 GLU HA . 17904 1 615 . 1 1 108 108 GLU HB2 H 1 1.972 0.016 . . . . . A 103 GLU HB2 . 17904 1 616 . 1 1 108 108 GLU HB3 H 1 2.285 0.014 . . . . . A 103 GLU HB3 . 17904 1 stop_ save_