################################### # 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_starch_output _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode starch_output _Assigned_chem_shift_list.Entry_ID 36775 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36775 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 36775 1 2 $software_2 . . 36775 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 PRO CA C 13 64.182 0.000 . 1 . . . . A 2 PRO CA . 36775 1 2 . 1 . 1 2 2 PRO CB C 13 32.095 0.000 . 1 . . . . A 2 PRO CB . 36775 1 3 . 1 . 1 3 3 ASP H H 1 8.958 0.004 . 1 . . . . A 3 ASP H . 36775 1 4 . 1 . 1 3 3 ASP HA H 1 4.719 0.000 . 1 . . . . A 3 ASP HA . 36775 1 5 . 1 . 1 3 3 ASP HB2 H 1 2.970 0.000 . . . . . . A 3 ASP HB2 . 36775 1 6 . 1 . 1 3 3 ASP HB3 H 1 2.884 0.000 . . . . . . A 3 ASP HB3 . 36775 1 7 . 1 . 1 3 3 ASP CA C 13 55.407 0.001 . 1 . . . . A 3 ASP CA . 36775 1 8 . 1 . 1 3 3 ASP CB C 13 46.486 0.000 . 1 . . . . A 3 ASP CB . 36775 1 9 . 1 . 1 3 3 ASP N N 15 123.012 0.005 . 1 . . . . A 3 ASP N . 36775 1 10 . 1 . 1 4 4 ARG CA C 13 56.848 0.004 . 1 . . . . A 4 ARG CA . 36775 1 11 . 1 . 1 4 4 ARG CB C 13 29.557 0.004 . 1 . . . . A 4 ARG CB . 36775 1 12 . 1 . 1 4 4 ARG CD C 13 41.748 0.000 . 1 . . . . A 4 ARG CD . 36775 1 13 . 1 . 1 4 4 ARG CG C 13 26.629 0.000 . 1 . . . . A 4 ARG CG . 36775 1 14 . 1 . 1 5 5 THR H H 1 8.156 0.005 . 1 . . . . A 5 THR H . 36775 1 15 . 1 . 1 5 5 THR HA H 1 4.724 0.000 . 1 . . . . A 5 THR HA . 36775 1 16 . 1 . 1 5 5 THR HB H 1 4.048 0.000 . 1 . . . . A 5 THR HB . 36775 1 17 . 1 . 1 5 5 THR HG21 H 1 1.204 0.000 . 1 . . . . A 5 THR HG21 . 36775 1 18 . 1 . 1 5 5 THR HG22 H 1 1.204 0.000 . 1 . . . . A 5 THR HG22 . 36775 1 19 . 1 . 1 5 5 THR HG23 H 1 1.204 0.000 . 1 . . . . A 5 THR HG23 . 36775 1 20 . 1 . 1 5 5 THR CA C 13 60.870 0.000 . 1 . . . . A 5 THR CA . 36775 1 21 . 1 . 1 5 5 THR CB C 13 65.277 0.000 . 1 . . . . A 5 THR CB . 36775 1 22 . 1 . 1 5 5 THR N N 15 116.900 0.000 . 1 . . . . A 5 THR N . 36775 1 23 . 1 . 1 7 7 PRO HA H 1 4.415 0.003 . 1 . . . . A 7 PRO HA . 36775 1 24 . 1 . 1 7 7 PRO HB2 H 1 2.350 0.000 . . . . . . A 7 PRO HB2 . 36775 1 25 . 1 . 1 7 7 PRO HB3 H 1 1.915 0.000 . . . . . . A 7 PRO HB3 . 36775 1 26 . 1 . 1 7 7 PRO HD2 H 1 3.710 0.000 . . . . . . A 7 PRO HD2 . 36775 1 27 . 1 . 1 7 7 PRO HD3 H 1 3.274 0.000 . . . . . . A 7 PRO HD3 . 36775 1 28 . 1 . 1 7 7 PRO HG2 H 1 1.726 0.000 . . . . . . A 7 PRO HG2 . 36775 1 29 . 1 . 1 7 7 PRO HG3 H 1 1.639 0.000 . . . . . . A 7 PRO HG3 . 36775 1 30 . 1 . 1 7 7 PRO CA C 13 62.600 0.001 . 1 . . . . A 7 PRO CA . 36775 1 31 . 1 . 1 7 7 PRO CB C 13 32.376 0.001 . 1 . . . . A 7 PRO CB . 36775 1 32 . 1 . 1 7 7 PRO CD C 13 50.773 0.000 . 1 . . . . A 7 PRO CD . 36775 1 33 . 1 . 1 7 7 PRO CG C 13 27.961 0.000 . 1 . . . . A 7 PRO CG . 36775 1 34 . 1 . 1 8 8 ALA H H 1 8.271 0.003 . 1 . . . . A 8 ALA H . 36775 1 35 . 1 . 1 8 8 ALA HA H 1 4.160 0.003 . 1 . . . . A 8 ALA HA . 36775 1 36 . 1 . 1 8 8 ALA HB1 H 1 1.399 0.002 . 1 . . . . A 8 ALA HB1 . 36775 1 37 . 1 . 1 8 8 ALA HB2 H 1 1.399 0.002 . 1 . . . . A 8 ALA HB2 . 36775 1 38 . 1 . 1 8 8 ALA HB3 H 1 1.399 0.002 . 1 . . . . A 8 ALA HB3 . 36775 1 39 . 1 . 1 8 8 ALA CA C 13 53.800 0.001 . 1 . . . . A 8 ALA CA . 36775 1 40 . 1 . 1 8 8 ALA CB C 13 18.164 0.000 . 1 . . . . A 8 ALA CB . 36775 1 41 . 1 . 1 8 8 ALA N N 15 122.624 0.025 . 1 . . . . A 8 ALA N . 36775 1 42 . 1 . 1 9 9 GLY H H 1 8.236 0.003 . 1 . . . . A 9 GLY H . 36775 1 43 . 1 . 1 9 9 GLY HA2 H 1 4.240 0.005 . . . . . . A 9 GLY HA2 . 36775 1 44 . 1 . 1 9 9 GLY HA3 H 1 4.240 0.005 . . . . . . A 9 GLY HA3 . 36775 1 45 . 1 . 1 9 9 GLY CA C 13 45.205 0.003 . 1 . . . . A 9 GLY CA . 36775 1 46 . 1 . 1 9 9 GLY N N 15 114.200 0.000 . 1 . . . . A 9 GLY N . 36775 1 47 . 1 . 1 10 10 GLN H H 1 8.291 0.004 . 1 . . . . A 10 GLN H . 36775 1 48 . 1 . 1 10 10 GLN HA H 1 4.468 0.002 . 1 . . . . A 10 GLN HA . 36775 1 49 . 1 . 1 10 10 GLN HB2 H 1 1.932 0.000 . . . . . . A 10 GLN HB2 . 36775 1 50 . 1 . 1 10 10 GLN HB3 H 1 1.864 0.000 . . . . . . A 10 GLN HB3 . 36775 1 51 . 1 . 1 10 10 GLN HG2 H 1 2.575 0.004 . . . . . . A 10 GLN HG2 . 36775 1 52 . 1 . 1 10 10 GLN HG3 H 1 2.533 0.001 . . . . . . A 10 GLN HG3 . 36775 1 53 . 1 . 1 10 10 GLN CA C 13 54.613 0.006 . 1 . . . . A 10 GLN CA . 36775 1 54 . 1 . 1 10 10 GLN CB C 13 31.939 0.003 . 1 . . . . A 10 GLN CB . 36775 1 55 . 1 . 1 10 10 GLN CG C 13 34.333 0.000 . 1 . . . . A 10 GLN CG . 36775 1 56 . 1 . 1 10 10 GLN N N 15 119.853 0.000 . 1 . . . . A 10 GLN N . 36775 1 57 . 1 . 1 11 11 THR H H 1 9.050 0.003 . 1 . . . . A 11 THR H . 36775 1 58 . 1 . 1 11 11 THR HA H 1 4.687 0.000 . 1 . . . . A 11 THR HA . 36775 1 59 . 1 . 1 11 11 THR HB H 1 4.029 0.000 . 1 . . . . A 11 THR HB . 36775 1 60 . 1 . 1 11 11 THR HG21 H 1 1.239 0.000 . 1 . . . . A 11 THR HG21 . 36775 1 61 . 1 . 1 11 11 THR HG22 H 1 1.239 0.000 . 1 . . . . A 11 THR HG22 . 36775 1 62 . 1 . 1 11 11 THR HG23 H 1 1.239 0.000 . 1 . . . . A 11 THR HG23 . 36775 1 63 . 1 . 1 11 11 THR CA C 13 60.837 0.003 . 1 . . . . A 11 THR CA . 36775 1 64 . 1 . 1 11 11 THR CB C 13 71.895 0.003 . 1 . . . . A 11 THR CB . 36775 1 65 . 1 . 1 11 11 THR CG2 C 13 21.418 0.000 . 1 . . . . A 11 THR CG2 . 36775 1 66 . 1 . 1 11 11 THR N N 15 113.566 0.000 . 1 . . . . A 11 THR N . 36775 1 67 . 1 . 1 12 12 TYR H H 1 8.936 0.003 . 1 . . . . A 12 TYR H . 36775 1 68 . 1 . 1 12 12 TYR HA H 1 4.695 0.000 . 1 . . . . A 12 TYR HA . 36775 1 69 . 1 . 1 12 12 TYR HB2 H 1 3.210 0.000 . . . . . . A 12 TYR HB2 . 36775 1 70 . 1 . 1 12 12 TYR HB3 H 1 3.013 0.000 . . . . . . A 12 TYR HB3 . 36775 1 71 . 1 . 1 12 12 TYR CA C 13 60.669 0.004 . 1 . . . . A 12 TYR CA . 36775 1 72 . 1 . 1 12 12 TYR CB C 13 38.371 0.004 . 1 . . . . A 12 TYR CB . 36775 1 73 . 1 . 1 12 12 TYR N N 15 128.120 0.000 . 1 . . . . A 12 TYR N . 36775 1 74 . 1 . 1 13 13 ASP H H 1 8.593 0.004 . 1 . . . . A 13 ASP H . 36775 1 75 . 1 . 1 13 13 ASP HA H 1 4.849 0.001 . 1 . . . . A 13 ASP HA . 36775 1 76 . 1 . 1 13 13 ASP HB2 H 1 2.507 0.002 . . . . . . A 13 ASP HB2 . 36775 1 77 . 1 . 1 13 13 ASP HB3 H 1 2.357 0.001 . . . . . . A 13 ASP HB3 . 36775 1 78 . 1 . 1 13 13 ASP CA C 13 56.033 0.004 . 1 . . . . A 13 ASP CA . 36775 1 79 . 1 . 1 13 13 ASP CB C 13 46.858 0.003 . 1 . . . . A 13 ASP CB . 36775 1 80 . 1 . 1 13 13 ASP N N 15 129.200 0.000 . 1 . . . . A 13 ASP N . 36775 1 81 . 1 . 1 14 14 ARG H H 1 7.116 0.003 . 1 . . . . A 14 ARG H . 36775 1 82 . 1 . 1 14 14 ARG HA H 1 4.932 0.003 . 1 . . . . A 14 ARG HA . 36775 1 83 . 1 . 1 14 14 ARG HB2 H 1 2.013 0.000 . . . . . . A 14 ARG HB2 . 36775 1 84 . 1 . 1 14 14 ARG HB3 H 1 1.930 0.001 . . . . . . A 14 ARG HB3 . 36775 1 85 . 1 . 1 14 14 ARG HD2 H 1 3.203 0.001 . . . . . . A 14 ARG HD2 . 36775 1 86 . 1 . 1 14 14 ARG HD3 H 1 3.048 0.002 . . . . . . A 14 ARG HD3 . 36775 1 87 . 1 . 1 14 14 ARG HG2 H 1 1.579 0.001 . . . . . . A 14 ARG HG2 . 36775 1 88 . 1 . 1 14 14 ARG HG3 H 1 1.488 0.001 . . . . . . A 14 ARG HG3 . 36775 1 89 . 1 . 1 14 14 ARG CA C 13 54.812 0.002 . 1 . . . . A 14 ARG CA . 36775 1 90 . 1 . 1 14 14 ARG CB C 13 31.117 0.002 . 1 . . . . A 14 ARG CB . 36775 1 91 . 1 . 1 14 14 ARG CD C 13 43.079 0.000 . 1 . . . . A 14 ARG CD . 36775 1 92 . 1 . 1 14 14 ARG CG C 13 26.045 0.000 . 1 . . . . A 14 ARG CG . 36775 1 93 . 1 . 1 14 14 ARG N N 15 108.562 0.000 . 1 . . . . A 14 ARG N . 36775 1 94 . 1 . 1 15 15 SER H H 1 8.366 0.005 . 1 . . . . A 15 SER H . 36775 1 95 . 1 . 1 15 15 SER HA H 1 5.710 0.002 . 1 . . . . A 15 SER HA . 36775 1 96 . 1 . 1 15 15 SER HB2 H 1 3.911 0.004 . . . . . . A 15 SER HB2 . 36775 1 97 . 1 . 1 15 15 SER HB3 H 1 3.791 0.003 . . . . . . A 15 SER HB3 . 36775 1 98 . 1 . 1 15 15 SER CA C 13 57.090 0.002 . 1 . . . . A 15 SER CA . 36775 1 99 . 1 . 1 15 15 SER CB C 13 65.646 0.002 . 1 . . . . A 15 SER CB . 36775 1 100 . 1 . 1 15 15 SER N N 15 110.658 0.000 . 1 . . . . A 15 SER N . 36775 1 101 . 1 . 1 16 16 VAL H H 1 9.110 0.003 . 1 . . . . A 16 VAL H . 36775 1 102 . 1 . 1 16 16 VAL HA H 1 4.590 0.002 . 1 . . . . A 16 VAL HA . 36775 1 103 . 1 . 1 16 16 VAL HB H 1 2.393 0.000 . 1 . . . . A 16 VAL HB . 36775 1 104 . 1 . 1 16 16 VAL HG11 H 1 1.009 0.001 . . . . . . A 16 VAL HG11 . 36775 1 105 . 1 . 1 16 16 VAL HG12 H 1 1.009 0.001 . . . . . . A 16 VAL HG12 . 36775 1 106 . 1 . 1 16 16 VAL HG13 H 1 1.009 0.001 . . . . . . A 16 VAL HG13 . 36775 1 107 . 1 . 1 16 16 VAL HG21 H 1 0.903 0.001 . . . . . . A 16 VAL HG21 . 36775 1 108 . 1 . 1 16 16 VAL HG22 H 1 0.903 0.001 . . . . . . A 16 VAL HG22 . 36775 1 109 . 1 . 1 16 16 VAL HG23 H 1 0.903 0.001 . . . . . . A 16 VAL HG23 . 36775 1 110 . 1 . 1 16 16 VAL CA C 13 58.800 0.003 . 1 . . . . A 16 VAL CA . 36775 1 111 . 1 . 1 16 16 VAL CB C 13 36.457 0.003 . 1 . . . . A 16 VAL CB . 36775 1 112 . 1 . 1 16 16 VAL CG1 C 13 21.995 0.000 . . . . . . A 16 VAL CG1 . 36775 1 113 . 1 . 1 16 16 VAL CG2 C 13 18.828 0.000 . . . . . . A 16 VAL CG2 . 36775 1 114 . 1 . 1 16 16 VAL N N 15 112.526 0.000 . 1 . . . . A 16 VAL N . 36775 1 115 . 1 . 1 17 17 CYS H H 1 8.650 0.004 . 1 . . . . A 17 CYS H . 36775 1 116 . 1 . 1 17 17 CYS HA H 1 5.239 0.002 . 1 . . . . A 17 CYS HA . 36775 1 117 . 1 . 1 17 17 CYS HB2 H 1 3.062 0.000 . . . . . . A 17 CYS HB2 . 36775 1 118 . 1 . 1 17 17 CYS HB3 H 1 2.716 0.001 . . . . . . A 17 CYS HB3 . 36775 1 119 . 1 . 1 17 17 CYS CA C 13 53.559 0.004 . 1 . . . . A 17 CYS CA . 36775 1 120 . 1 . 1 17 17 CYS CB C 13 37.263 0.001 . 1 . . . . A 17 CYS CB . 36775 1 121 . 1 . 1 17 17 CYS N N 15 119.494 0.000 . 1 . . . . A 17 CYS N . 36775 1 122 . 1 . 1 18 18 TYR H H 1 8.873 0.005 . 1 . . . . A 18 TYR H . 36775 1 123 . 1 . 1 18 18 TYR HA H 1 4.496 0.002 . 1 . . . . A 18 TYR HA . 36775 1 124 . 1 . 1 18 18 TYR HB2 H 1 2.877 0.000 . . . . . . A 18 TYR HB2 . 36775 1 125 . 1 . 1 18 18 TYR HB3 H 1 2.478 0.000 . . . . . . A 18 TYR HB3 . 36775 1 126 . 1 . 1 18 18 TYR CA C 13 58.369 0.001 . 1 . . . . A 18 TYR CA . 36775 1 127 . 1 . 1 18 18 TYR CB C 13 41.250 0.000 . 1 . . . . A 18 TYR CB . 36775 1 128 . 1 . 1 18 18 TYR N N 15 129.791 0.000 . 1 . . . . A 18 TYR N . 36775 1 129 . 1 . 1 19 19 LYS H H 1 7.202 0.003 . 1 . . . . A 19 LYS H . 36775 1 130 . 1 . 1 19 19 LYS HA H 1 5.010 0.003 . 1 . . . . A 19 LYS HA . 36775 1 131 . 1 . 1 19 19 LYS HB2 H 1 1.958 0.002 . . . . . . A 19 LYS HB2 . 36775 1 132 . 1 . 1 19 19 LYS HB3 H 1 1.845 0.004 . . . . . . A 19 LYS HB3 . 36775 1 133 . 1 . 1 19 19 LYS HD2 H 1 1.732 0.001 . . . . . . A 19 LYS HD2 . 36775 1 134 . 1 . 1 19 19 LYS HD3 H 1 1.655 0.000 . . . . . . A 19 LYS HD3 . 36775 1 135 . 1 . 1 19 19 LYS HE2 H 1 2.839 0.000 . . . . . . A 19 LYS HE2 . 36775 1 136 . 1 . 1 19 19 LYS HE3 H 1 2.697 0.004 . . . . . . A 19 LYS HE3 . 36775 1 137 . 1 . 1 19 19 LYS HG2 H 1 1.502 0.000 . . . . . . A 19 LYS HG2 . 36775 1 138 . 1 . 1 19 19 LYS HG3 H 1 1.415 0.001 . . . . . . A 19 LYS HG3 . 36775 1 139 . 1 . 1 19 19 LYS CA C 13 53.370 0.002 . 1 . . . . A 19 LYS CA . 36775 1 140 . 1 . 1 19 19 LYS CB C 13 32.615 0.002 . 1 . . . . A 19 LYS CB . 36775 1 141 . 1 . 1 19 19 LYS CD C 13 27.190 0.000 . 1 . . . . A 19 LYS CD . 36775 1 142 . 1 . 1 19 19 LYS CE C 13 39.634 0.000 . 1 . . . . A 19 LYS CE . 36775 1 143 . 1 . 1 19 19 LYS CG C 13 25.526 0.000 . 1 . . . . A 19 LYS CG . 36775 1 144 . 1 . 1 19 19 LYS N N 15 108.562 0.000 . 1 . . . . A 19 LYS N . 36775 1 145 . 1 . 1 20 20 TYR H H 1 8.818 0.007 . 1 . . . . A 20 TYR H . 36775 1 146 . 1 . 1 20 20 TYR HA H 1 5.167 0.004 . 1 . . . . A 20 TYR HA . 36775 1 147 . 1 . 1 20 20 TYR HB2 H 1 2.955 0.000 . . . . . . A 20 TYR HB2 . 36775 1 148 . 1 . 1 20 20 TYR HB3 H 1 2.795 0.001 . . . . . . A 20 TYR HB3 . 36775 1 149 . 1 . 1 20 20 TYR CA C 13 57.002 0.003 . 1 . . . . A 20 TYR CA . 36775 1 150 . 1 . 1 20 20 TYR CB C 13 41.273 0.000 . 1 . . . . A 20 TYR CB . 36775 1 151 . 1 . 1 20 20 TYR N N 15 122.658 0.000 . 1 . . . . A 20 TYR N . 36775 1 152 . 1 . 1 21 21 ASN H H 1 8.376 0.004 . 1 . . . . A 21 ASN H . 36775 1 153 . 1 . 1 21 21 ASN HA H 1 4.475 0.004 . 1 . . . . A 21 ASN HA . 36775 1 154 . 1 . 1 21 21 ASN HB2 H 1 2.976 0.004 . . . . . . A 21 ASN HB2 . 36775 1 155 . 1 . 1 21 21 ASN HB3 H 1 2.384 0.004 . . . . . . A 21 ASN HB3 . 36775 1 156 . 1 . 1 21 21 ASN CA C 13 51.970 0.001 . 1 . . . . A 21 ASN CA . 36775 1 157 . 1 . 1 21 21 ASN CB C 13 39.133 0.003 . 1 . . . . A 21 ASN CB . 36775 1 158 . 1 . 1 21 21 ASN N N 15 123.050 0.000 . 1 . . . . A 21 ASN N . 36775 1 159 . 1 . 1 22 22 THR H H 1 7.446 0.004 . 1 . . . . A 22 THR H . 36775 1 160 . 1 . 1 22 22 THR HA H 1 4.797 0.002 . 1 . . . . A 22 THR HA . 36775 1 161 . 1 . 1 22 22 THR HB H 1 3.984 0.001 . 1 . . . . A 22 THR HB . 36775 1 162 . 1 . 1 22 22 THR HG21 H 1 1.065 0.001 . 1 . . . . A 22 THR HG21 . 36775 1 163 . 1 . 1 22 22 THR HG22 H 1 1.065 0.001 . 1 . . . . A 22 THR HG22 . 36775 1 164 . 1 . 1 22 22 THR HG23 H 1 1.065 0.001 . 1 . . . . A 22 THR HG23 . 36775 1 165 . 1 . 1 22 22 THR CA C 13 62.588 0.002 . 1 . . . . A 22 THR CA . 36775 1 166 . 1 . 1 22 22 THR CB C 13 73.165 0.002 . 1 . . . . A 22 THR CB . 36775 1 167 . 1 . 1 22 22 THR CG2 C 13 20.869 0.000 . 1 . . . . A 22 THR CG2 . 36775 1 168 . 1 . 1 22 22 THR N N 15 113.936 0.000 . 1 . . . . A 22 THR N . 36775 1 169 . 1 . 1 23 23 ILE H H 1 8.696 0.003 . 1 . . . . A 23 ILE H . 36775 1 170 . 1 . 1 23 23 ILE HA H 1 4.497 0.002 . 1 . . . . A 23 ILE HA . 36775 1 171 . 1 . 1 23 23 ILE HB H 1 1.756 0.000 . 1 . . . . A 23 ILE HB . 36775 1 172 . 1 . 1 23 23 ILE HD11 H 1 0.724 0.000 . 1 . . . . A 23 ILE HD11 . 36775 1 173 . 1 . 1 23 23 ILE HD12 H 1 0.724 0.000 . 1 . . . . A 23 ILE HD12 . 36775 1 174 . 1 . 1 23 23 ILE HD13 H 1 0.724 0.000 . 1 . . . . A 23 ILE HD13 . 36775 1 175 . 1 . 1 23 23 ILE HG12 H 1 1.551 0.003 . . . . . . A 23 ILE HG12 . 36775 1 176 . 1 . 1 23 23 ILE HG13 H 1 1.454 0.003 . . . . . . A 23 ILE HG13 . 36775 1 177 . 1 . 1 23 23 ILE HG21 H 1 0.812 0.001 . 1 . . . . A 23 ILE HG21 . 36775 1 178 . 1 . 1 23 23 ILE HG22 H 1 0.812 0.001 . 1 . . . . A 23 ILE HG22 . 36775 1 179 . 1 . 1 23 23 ILE HG23 H 1 0.812 0.001 . 1 . . . . A 23 ILE HG23 . 36775 1 180 . 1 . 1 23 23 ILE CA C 13 61.114 0.004 . 1 . . . . A 23 ILE CA . 36775 1 181 . 1 . 1 23 23 ILE CB C 13 40.225 0.002 . 1 . . . . A 23 ILE CB . 36775 1 182 . 1 . 1 23 23 ILE CD1 C 13 14.739 0.000 . 1 . . . . A 23 ILE CD1 . 36775 1 183 . 1 . 1 23 23 ILE CG1 C 13 28.184 0.000 . 1 . . . . A 23 ILE CG1 . 36775 1 184 . 1 . 1 23 23 ILE CG2 C 13 17.946 0.000 . 1 . . . . A 23 ILE CG2 . 36775 1 185 . 1 . 1 23 23 ILE N N 15 127.053 0.000 . 1 . . . . A 23 ILE N . 36775 1 186 . 1 . 1 24 24 ARG H H 1 9.178 0.004 . 1 . . . . A 24 ARG H . 36775 1 187 . 1 . 1 24 24 ARG HA H 1 5.126 0.001 . 1 . . . . A 24 ARG HA . 36775 1 188 . 1 . 1 24 24 ARG HB2 H 1 2.006 0.001 . . . . . . A 24 ARG HB2 . 36775 1 189 . 1 . 1 24 24 ARG HB3 H 1 1.664 0.001 . . . . . . A 24 ARG HB3 . 36775 1 190 . 1 . 1 24 24 ARG HD2 H 1 2.969 0.001 . . . . . . A 24 ARG HD2 . 36775 1 191 . 1 . 1 24 24 ARG HD3 H 1 2.873 0.000 . . . . . . A 24 ARG HD3 . 36775 1 192 . 1 . 1 24 24 ARG HG2 H 1 1.476 0.002 . . . . . . A 24 ARG HG2 . 36775 1 193 . 1 . 1 24 24 ARG HG3 H 1 1.358 0.001 . . . . . . A 24 ARG HG3 . 36775 1 194 . 1 . 1 24 24 ARG CA C 13 55.061 0.002 . 1 . . . . A 24 ARG CA . 36775 1 195 . 1 . 1 24 24 ARG CB C 13 33.762 0.004 . 1 . . . . A 24 ARG CB . 36775 1 196 . 1 . 1 24 24 ARG CD C 13 43.990 0.000 . 1 . . . . A 24 ARG CD . 36775 1 197 . 1 . 1 24 24 ARG CG C 13 25.919 0.000 . 1 . . . . A 24 ARG CG . 36775 1 198 . 1 . 1 24 24 ARG N N 15 128.650 0.000 . 1 . . . . A 24 ARG N . 36775 1 199 . 1 . 1 25 25 ARG H H 1 8.943 0.005 . 1 . . . . A 25 ARG H . 36775 1 200 . 1 . 1 25 25 ARG HA H 1 5.068 0.004 . 1 . . . . A 25 ARG HA . 36775 1 201 . 1 . 1 25 25 ARG HB2 H 1 1.954 0.000 . . . . . . A 25 ARG HB2 . 36775 1 202 . 1 . 1 25 25 ARG HB3 H 1 1.808 0.000 . . . . . . A 25 ARG HB3 . 36775 1 203 . 1 . 1 25 25 ARG HD2 H 1 3.224 0.002 . . . . . . A 25 ARG HD2 . 36775 1 204 . 1 . 1 25 25 ARG HD3 H 1 3.165 0.001 . . . . . . A 25 ARG HD3 . 36775 1 205 . 1 . 1 25 25 ARG HG2 H 1 1.512 0.000 . . . . . . A 25 ARG HG2 . 36775 1 206 . 1 . 1 25 25 ARG HG3 H 1 1.393 0.003 . . . . . . A 25 ARG HG3 . 36775 1 207 . 1 . 1 25 25 ARG CA C 13 53.659 0.002 . 1 . . . . A 25 ARG CA . 36775 1 208 . 1 . 1 25 25 ARG CB C 13 32.404 0.004 . 1 . . . . A 25 ARG CB . 36775 1 209 . 1 . 1 25 25 ARG CD C 13 42.799 0.000 . 1 . . . . A 25 ARG CD . 36775 1 210 . 1 . 1 25 25 ARG CG C 13 27.170 0.000 . 1 . . . . A 25 ARG CG . 36775 1 211 . 1 . 1 25 25 ARG N N 15 126.220 0.000 . 1 . . . . A 25 ARG N . 36775 1 212 . 1 . 1 26 26 PHE H H 1 8.960 0.005 . 1 . . . . A 26 PHE H . 36775 1 213 . 1 . 1 26 26 PHE HA H 1 5.161 0.003 . 1 . . . . A 26 PHE HA . 36775 1 214 . 1 . 1 26 26 PHE HB2 H 1 2.971 0.001 . . . . . . A 26 PHE HB2 . 36775 1 215 . 1 . 1 26 26 PHE HB3 H 1 2.857 0.000 . . . . . . A 26 PHE HB3 . 36775 1 216 . 1 . 1 26 26 PHE CA C 13 57.262 0.003 . 1 . . . . A 26 PHE CA . 36775 1 217 . 1 . 1 26 26 PHE CB C 13 41.380 0.004 . 1 . . . . A 26 PHE CB . 36775 1 218 . 1 . 1 26 26 PHE N N 15 123.743 0.000 . 1 . . . . A 26 PHE N . 36775 1 219 . 1 . 1 27 27 CYS H H 1 8.770 0.005 . 1 . . . . A 27 CYS H . 36775 1 220 . 1 . 1 27 27 CYS HA H 1 5.470 0.003 . 1 . . . . A 27 CYS HA . 36775 1 221 . 1 . 1 27 27 CYS HB2 H 1 3.046 0.001 . . . . . . A 27 CYS HB2 . 36775 1 222 . 1 . 1 27 27 CYS HB3 H 1 2.958 0.000 . . . . . . A 27 CYS HB3 . 36775 1 223 . 1 . 1 27 27 CYS CA C 13 55.693 0.002 . 1 . . . . A 27 CYS CA . 36775 1 224 . 1 . 1 27 27 CYS CB C 13 46.993 0.001 . 1 . . . . A 27 CYS CB . 36775 1 225 . 1 . 1 27 27 CYS N N 15 123.077 0.000 . 1 . . . . A 27 CYS N . 36775 1 226 . 1 . 1 28 28 VAL H H 1 9.253 0.004 . 1 . . . . A 28 VAL H . 36775 1 227 . 1 . 1 28 28 VAL HA H 1 4.704 0.000 . 1 . . . . A 28 VAL HA . 36775 1 228 . 1 . 1 28 28 VAL HB H 1 2.167 0.000 . 1 . . . . A 28 VAL HB . 36775 1 229 . 1 . 1 28 28 VAL HG11 H 1 0.897 0.000 . . . . . . A 28 VAL HG11 . 36775 1 230 . 1 . 1 28 28 VAL HG12 H 1 0.897 0.000 . . . . . . A 28 VAL HG12 . 36775 1 231 . 1 . 1 28 28 VAL HG13 H 1 0.897 0.000 . . . . . . A 28 VAL HG13 . 36775 1 232 . 1 . 1 28 28 VAL HG21 H 1 0.808 0.000 . . . . . . A 28 VAL HG21 . 36775 1 233 . 1 . 1 28 28 VAL HG22 H 1 0.808 0.000 . . . . . . A 28 VAL HG22 . 36775 1 234 . 1 . 1 28 28 VAL HG23 H 1 0.808 0.000 . . . . . . A 28 VAL HG23 . 36775 1 235 . 1 . 1 28 28 VAL CA C 13 59.665 0.004 . 1 . . . . A 28 VAL CA . 36775 1 236 . 1 . 1 28 28 VAL CB C 13 35.632 0.001 . 1 . . . . A 28 VAL CB . 36775 1 237 . 1 . 1 28 28 VAL CG1 C 13 21.619 0.000 . . . . . . A 28 VAL CG1 . 36775 1 238 . 1 . 1 28 28 VAL CG2 C 13 19.076 0.000 . . . . . . A 28 VAL CG2 . 36775 1 239 . 1 . 1 28 28 VAL N N 15 114.503 0.001 . 1 . . . . A 28 VAL N . 36775 1 240 . 1 . 1 29 29 ALA H H 1 8.737 0.003 . 1 . . . . A 29 ALA H . 36775 1 241 . 1 . 1 29 29 ALA HA H 1 4.661 0.000 . 1 . . . . A 29 ALA HA . 36775 1 242 . 1 . 1 29 29 ALA HB1 H 1 1.475 0.000 . 1 . . . . A 29 ALA HB1 . 36775 1 243 . 1 . 1 29 29 ALA HB2 H 1 1.475 0.000 . 1 . . . . A 29 ALA HB2 . 36775 1 244 . 1 . 1 29 29 ALA HB3 H 1 1.475 0.000 . 1 . . . . A 29 ALA HB3 . 36775 1 245 . 1 . 1 29 29 ALA CA C 13 51.140 0.003 . 1 . . . . A 29 ALA CA . 36775 1 246 . 1 . 1 29 29 ALA CB C 13 21.213 0.002 . 1 . . . . A 29 ALA CB . 36775 1 247 . 1 . 1 29 29 ALA N N 15 126.469 0.000 . 1 . . . . A 29 ALA N . 36775 1 248 . 1 . 1 30 30 ASN H H 1 8.021 0.004 . 1 . . . . A 30 ASN H . 36775 1 249 . 1 . 1 30 30 ASN HA H 1 4.813 0.006 . 1 . . . . A 30 ASN HA . 36775 1 250 . 1 . 1 30 30 ASN HB2 H 1 2.829 0.000 . . . . . . A 30 ASN HB2 . 36775 1 251 . 1 . 1 30 30 ASN HB3 H 1 2.617 0.001 . . . . . . A 30 ASN HB3 . 36775 1 252 . 1 . 1 30 30 ASN CA C 13 50.561 0.003 . 1 . . . . A 30 ASN CA . 36775 1 253 . 1 . 1 30 30 ASN CB C 13 40.952 0.000 . 1 . . . . A 30 ASN CB . 36775 1 254 . 1 . 1 30 30 ASN N N 15 116.620 0.000 . 1 . . . . A 30 ASN N . 36775 1 255 . 1 . 1 31 31 PRO HA H 1 4.414 0.003 . 1 . . . . A 31 PRO HA . 36775 1 256 . 1 . 1 31 31 PRO HB2 H 1 1.966 0.000 . . . . . . A 31 PRO HB2 . 36775 1 257 . 1 . 1 31 31 PRO HB3 H 1 1.867 0.000 . . . . . . A 31 PRO HB3 . 36775 1 258 . 1 . 1 31 31 PRO HD2 H 1 3.693 0.000 . . . . . . A 31 PRO HD2 . 36775 1 259 . 1 . 1 31 31 PRO HD3 H 1 3.827 0.000 . . . . . . A 31 PRO HD3 . 36775 1 260 . 1 . 1 31 31 PRO HG2 H 1 1.777 0.000 . . . . . . A 31 PRO HG2 . 36775 1 261 . 1 . 1 31 31 PRO HG3 H 1 1.675 0.000 . . . . . . A 31 PRO HG3 . 36775 1 262 . 1 . 1 31 31 PRO CA C 13 62.310 0.000 . 1 . . . . A 31 PRO CA . 36775 1 263 . 1 . 1 31 31 PRO CB C 13 30.482 0.000 . 1 . . . . A 31 PRO CB . 36775 1 264 . 1 . 1 31 31 PRO CD C 13 51.365 0.000 . 1 . . . . A 31 PRO CD . 36775 1 265 . 1 . 1 32 32 ARG H H 1 8.910 0.003 . 1 . . . . A 32 ARG H . 36775 1 266 . 1 . 1 32 32 ARG HA H 1 4.285 0.003 . 1 . . . . A 32 ARG HA . 36775 1 267 . 1 . 1 32 32 ARG HB2 H 1 1.784 0.002 . . . . . . A 32 ARG HB2 . 36775 1 268 . 1 . 1 32 32 ARG HB3 H 1 1.657 0.000 . . . . . . A 32 ARG HB3 . 36775 1 269 . 1 . 1 32 32 ARG HD2 H 1 3.160 0.000 . . . . . . A 32 ARG HD2 . 36775 1 270 . 1 . 1 32 32 ARG HD3 H 1 2.933 0.000 . . . . . . A 32 ARG HD3 . 36775 1 271 . 1 . 1 32 32 ARG HG2 H 1 1.323 0.001 . . . . . . A 32 ARG HG2 . 36775 1 272 . 1 . 1 32 32 ARG HG3 H 1 1.272 0.000 . . . . . . A 32 ARG HG3 . 36775 1 273 . 1 . 1 32 32 ARG CA C 13 56.721 0.001 . 1 . . . . A 32 ARG CA . 36775 1 274 . 1 . 1 32 32 ARG CB C 13 29.618 0.002 . 1 . . . . A 32 ARG CB . 36775 1 275 . 1 . 1 32 32 ARG CD C 13 43.226 0.000 . 1 . . . . A 32 ARG CD . 36775 1 276 . 1 . 1 32 32 ARG CG C 13 27.388 0.000 . 1 . . . . A 32 ARG CG . 36775 1 277 . 1 . 1 32 32 ARG N N 15 128.050 0.000 . 1 . . . . A 32 ARG N . 36775 1 278 . 1 . 1 33 33 SER H H 1 7.818 0.005 . 1 . . . . A 33 SER H . 36775 1 279 . 1 . 1 33 33 SER HA H 1 4.505 0.001 . 1 . . . . A 33 SER HA . 36775 1 280 . 1 . 1 33 33 SER HB2 H 1 3.958 0.001 . . . . . . A 33 SER HB2 . 36775 1 281 . 1 . 1 33 33 SER HB3 H 1 3.846 0.005 . . . . . . A 33 SER HB3 . 36775 1 282 . 1 . 1 33 33 SER CA C 13 58.079 0.002 . 1 . . . . A 33 SER CA . 36775 1 283 . 1 . 1 33 33 SER CB C 13 64.568 0.000 . 1 . . . . A 33 SER CB . 36775 1 284 . 1 . 1 33 33 SER N N 15 114.100 0.000 . 1 . . . . A 33 SER N . 36775 1 285 . 1 . 1 34 34 ASN H H 1 8.969 0.004 . 1 . . . . A 34 ASN H . 36775 1 286 . 1 . 1 34 34 ASN HA H 1 4.681 0.002 . 1 . . . . A 34 ASN HA . 36775 1 287 . 1 . 1 34 34 ASN HB2 H 1 2.928 0.001 . . . . . . A 34 ASN HB2 . 36775 1 288 . 1 . 1 34 34 ASN HB3 H 1 2.792 0.000 . . . . . . A 34 ASN HB3 . 36775 1 289 . 1 . 1 34 34 ASN CA C 13 53.751 0.003 . 1 . . . . A 34 ASN CA . 36775 1 290 . 1 . 1 34 34 ASN CB C 13 38.057 0.004 . 1 . . . . A 34 ASN CB . 36775 1 291 . 1 . 1 34 34 ASN N N 15 121.490 0.000 . 1 . . . . A 34 ASN N . 36775 1 292 . 1 . 1 35 35 ARG H H 1 8.103 0.005 . 1 . . . . A 35 ARG H . 36775 1 293 . 1 . 1 35 35 ARG HA H 1 4.505 0.003 . 1 . . . . A 35 ARG HA . 36775 1 294 . 1 . 1 35 35 ARG HB2 H 1 1.886 0.001 . . . . . . A 35 ARG HB2 . 36775 1 295 . 1 . 1 35 35 ARG HB3 H 1 1.810 0.000 . . . . . . A 35 ARG HB3 . 36775 1 296 . 1 . 1 35 35 ARG HD2 H 1 3.234 0.002 . . . . . . A 35 ARG HD2 . 36775 1 297 . 1 . 1 35 35 ARG HD3 H 1 3.149 0.003 . . . . . . A 35 ARG HD3 . 36775 1 298 . 1 . 1 35 35 ARG HG2 H 1 1.652 0.000 . . . . . . A 35 ARG HG2 . 36775 1 299 . 1 . 1 35 35 ARG HG3 H 1 1.566 0.000 . . . . . . A 35 ARG HG3 . 36775 1 300 . 1 . 1 35 35 ARG CA C 13 55.577 0.012 . 1 . . . . A 35 ARG CA . 36775 1 301 . 1 . 1 35 35 ARG CB C 13 30.696 0.006 . 1 . . . . A 35 ARG CB . 36775 1 302 . 1 . 1 35 35 ARG CD C 13 43.438 0.000 . 1 . . . . A 35 ARG CD . 36775 1 303 . 1 . 1 35 35 ARG CG C 13 26.894 0.000 . 1 . . . . A 35 ARG CG . 36775 1 304 . 1 . 1 35 35 ARG N N 15 120.240 0.000 . 1 . . . . A 35 ARG N . 36775 1 305 . 1 . 1 36 36 GLU H H 1 8.048 0.003 . 1 . . . . A 36 GLU H . 36775 1 306 . 1 . 1 36 36 GLU HA H 1 4.424 0.001 . 1 . . . . A 36 GLU HA . 36775 1 307 . 1 . 1 36 36 GLU HB2 H 1 2.150 0.000 . . . . . . A 36 GLU HB2 . 36775 1 308 . 1 . 1 36 36 GLU HB3 H 1 1.990 0.001 . . . . . . A 36 GLU HB3 . 36775 1 309 . 1 . 1 36 36 GLU HG2 H 1 2.410 0.001 . . . . . . A 36 GLU HG2 . 36775 1 310 . 1 . 1 36 36 GLU HG3 H 1 2.232 0.000 . . . . . . A 36 GLU HG3 . 36775 1 311 . 1 . 1 36 36 GLU CA C 13 55.821 0.003 . 1 . . . . A 36 GLU CA . 36775 1 312 . 1 . 1 36 36 GLU CB C 13 31.309 0.004 . 1 . . . . A 36 GLU CB . 36775 1 313 . 1 . 1 36 36 GLU CG C 13 37.462 0.000 . 1 . . . . A 36 GLU CG . 36775 1 314 . 1 . 1 36 36 GLU N N 15 122.846 0.000 . 1 . . . . A 36 GLU N . 36775 1 315 . 1 . 1 37 37 ASP H H 1 8.767 0.004 . 1 . . . . A 37 ASP H . 36775 1 316 . 1 . 1 37 37 ASP HA H 1 4.623 0.006 . 1 . . . . A 37 ASP HA . 36775 1 317 . 1 . 1 37 37 ASP HB2 H 1 2.433 0.016 . . . . . . A 37 ASP HB2 . 36775 1 318 . 1 . 1 37 37 ASP HB3 H 1 2.593 0.001 . . . . . . A 37 ASP HB3 . 36775 1 319 . 1 . 1 37 37 ASP CA C 13 55.010 0.004 . 1 . . . . A 37 ASP CA . 36775 1 320 . 1 . 1 37 37 ASP CB C 13 44.893 0.004 . 1 . . . . A 37 ASP CB . 36775 1 321 . 1 . 1 37 37 ASP N N 15 124.550 0.000 . 1 . . . . A 37 ASP N . 36775 1 322 . 1 . 1 38 38 ILE H H 1 8.117 0.003 . 1 . . . . A 38 ILE H . 36775 1 323 . 1 . 1 38 38 ILE HA H 1 4.536 0.002 . 1 . . . . A 38 ILE HA . 36775 1 324 . 1 . 1 38 38 ILE HD11 H 1 0.740 0.003 . 1 . . . . A 38 ILE HD11 . 36775 1 325 . 1 . 1 38 38 ILE HD12 H 1 0.740 0.003 . 1 . . . . A 38 ILE HD12 . 36775 1 326 . 1 . 1 38 38 ILE HD13 H 1 0.740 0.003 . 1 . . . . A 38 ILE HD13 . 36775 1 327 . 1 . 1 38 38 ILE HG12 H 1 1.445 0.000 . . . . . . A 38 ILE HG12 . 36775 1 328 . 1 . 1 38 38 ILE HG13 H 1 1.337 0.001 . . . . . . A 38 ILE HG13 . 36775 1 329 . 1 . 1 38 38 ILE HG21 H 1 0.884 0.000 . 1 . . . . A 38 ILE HG21 . 36775 1 330 . 1 . 1 38 38 ILE HG22 H 1 0.884 0.000 . 1 . . . . A 38 ILE HG22 . 36775 1 331 . 1 . 1 38 38 ILE HG23 H 1 0.884 0.000 . 1 . . . . A 38 ILE HG23 . 36775 1 332 . 1 . 1 38 38 ILE CA C 13 60.604 0.006 . 1 . . . . A 38 ILE CA . 36775 1 333 . 1 . 1 38 38 ILE CB C 13 40.701 0.003 . 1 . . . . A 38 ILE CB . 36775 1 334 . 1 . 1 38 38 ILE CD1 C 13 14.184 0.000 . 1 . . . . A 38 ILE CD1 . 36775 1 335 . 1 . 1 38 38 ILE CG1 C 13 27.230 0.000 . 1 . . . . A 38 ILE CG1 . 36775 1 336 . 1 . 1 38 38 ILE CG2 C 13 17.488 0.000 . 1 . . . . A 38 ILE CG2 . 36775 1 337 . 1 . 1 38 38 ILE N N 15 125.776 0.000 . 1 . . . . A 38 ILE N . 36775 1 338 . 1 . 1 39 39 LYS H H 1 7.952 0.006 . 1 . . . . A 39 LYS H . 36775 1 339 . 1 . 1 39 39 LYS HA H 1 4.557 0.005 . 1 . . . . A 39 LYS HA . 36775 1 340 . 1 . 1 39 39 LYS HB2 H 1 1.717 0.001 . . . . . . A 39 LYS HB2 . 36775 1 341 . 1 . 1 39 39 LYS HB3 H 1 1.624 0.001 . . . . . . A 39 LYS HB3 . 36775 1 342 . 1 . 1 39 39 LYS HD2 H 1 1.531 0.000 . . . . . . A 39 LYS HD2 . 36775 1 343 . 1 . 1 39 39 LYS HD3 H 1 1.437 0.001 . . . . . . A 39 LYS HD3 . 36775 1 344 . 1 . 1 39 39 LYS HE2 H 1 3.118 0.001 . . . . . . A 39 LYS HE2 . 36775 1 345 . 1 . 1 39 39 LYS HE3 H 1 2.962 0.000 . . . . . . A 39 LYS HE3 . 36775 1 346 . 1 . 1 39 39 LYS HG2 H 1 1.360 0.003 . . . . . . A 39 LYS HG2 . 36775 1 347 . 1 . 1 39 39 LYS HG3 H 1 1.238 0.001 . . . . . . A 39 LYS HG3 . 36775 1 348 . 1 . 1 39 39 LYS CA C 13 55.138 0.005 . 1 . . . . A 39 LYS CA . 36775 1 349 . 1 . 1 39 39 LYS CB C 13 36.768 0.000 . 1 . . . . A 39 LYS CB . 36775 1 350 . 1 . 1 39 39 LYS N N 15 126.480 0.000 . 1 . . . . A 39 LYS N . 36775 1 351 . 1 . 1 40 40 ASN H H 1 7.570 0.003 . 1 . . . . A 40 ASN H . 36775 1 352 . 1 . 1 40 40 ASN HA H 1 4.473 0.004 . 1 . . . . A 40 ASN HA . 36775 1 353 . 1 . 1 40 40 ASN HB2 H 1 2.995 0.000 . . . . . . A 40 ASN HB2 . 36775 1 354 . 1 . 1 40 40 ASN HB3 H 1 2.360 0.002 . . . . . . A 40 ASN HB3 . 36775 1 355 . 1 . 1 40 40 ASN CA C 13 51.498 0.002 . 1 . . . . A 40 ASN CA . 36775 1 356 . 1 . 1 40 40 ASN CB C 13 39.878 0.001 . 1 . . . . A 40 ASN CB . 36775 1 357 . 1 . 1 40 40 ASN N N 15 116.044 0.020 . 1 . . . . A 40 ASN N . 36775 1 358 . 1 . 1 41 41 THR H H 1 9.457 0.005 . 1 . . . . A 41 THR H . 36775 1 359 . 1 . 1 41 41 THR HA H 1 4.826 0.001 . 1 . . . . A 41 THR HA . 36775 1 360 . 1 . 1 41 41 THR HB H 1 3.934 0.001 . 1 . . . . A 41 THR HB . 36775 1 361 . 1 . 1 41 41 THR HG21 H 1 1.223 0.003 . 1 . . . . A 41 THR HG21 . 36775 1 362 . 1 . 1 41 41 THR HG22 H 1 1.223 0.003 . 1 . . . . A 41 THR HG22 . 36775 1 363 . 1 . 1 41 41 THR HG23 H 1 1.223 0.003 . 1 . . . . A 41 THR HG23 . 36775 1 364 . 1 . 1 41 41 THR CA C 13 59.253 0.002 . 1 . . . . A 41 THR CA . 36775 1 365 . 1 . 1 41 41 THR CB C 13 71.915 0.000 . 1 . . . . A 41 THR CB . 36775 1 366 . 1 . 1 41 41 THR N N 15 119.320 0.000 . 1 . . . . A 41 THR N . 36775 1 367 . 1 . 1 42 42 PRO HA H 1 4.806 0.004 . 1 . . . . A 42 PRO HA . 36775 1 368 . 1 . 1 42 42 PRO HB2 H 1 2.415 0.000 . . . . . . A 42 PRO HB2 . 36775 1 369 . 1 . 1 42 42 PRO HB3 H 1 2.300 0.000 . . . . . . A 42 PRO HB3 . 36775 1 370 . 1 . 1 42 42 PRO HD2 H 1 3.818 0.000 . . . . . . A 42 PRO HD2 . 36775 1 371 . 1 . 1 42 42 PRO HD3 H 1 3.726 0.000 . . . . . . A 42 PRO HD3 . 36775 1 372 . 1 . 1 42 42 PRO HG2 H 1 2.125 0.000 . . . . . . A 42 PRO HG2 . 36775 1 373 . 1 . 1 42 42 PRO HG3 H 1 1.993 0.000 . . . . . . A 42 PRO HG3 . 36775 1 374 . 1 . 1 42 42 PRO CA C 13 62.815 0.009 . 1 . . . . A 42 PRO CA . 36775 1 375 . 1 . 1 42 42 PRO CB C 13 32.353 0.005 . 1 . . . . A 42 PRO CB . 36775 1 376 . 1 . 1 42 42 PRO CD C 13 51.544 0.000 . 1 . . . . A 42 PRO CD . 36775 1 377 . 1 . 1 42 42 PRO CG C 13 26.974 0.000 . 1 . . . . A 42 PRO CG . 36775 1 378 . 1 . 1 43 43 CYS H H 1 8.422 0.005 . 1 . . . . A 43 CYS H . 36775 1 379 . 1 . 1 43 43 CYS HA H 1 4.940 0.004 . 1 . . . . A 43 CYS HA . 36775 1 380 . 1 . 1 43 43 CYS HB2 H 1 2.496 0.000 . . . . . . A 43 CYS HB2 . 36775 1 381 . 1 . 1 43 43 CYS HB3 H 1 2.843 0.001 . . . . . . A 43 CYS HB3 . 36775 1 382 . 1 . 1 43 43 CYS CA C 13 52.549 0.002 . 1 . . . . A 43 CYS CA . 36775 1 383 . 1 . 1 43 43 CYS CB C 13 36.856 0.002 . 1 . . . . A 43 CYS CB . 36775 1 384 . 1 . 1 43 43 CYS N N 15 119.600 0.000 . 1 . . . . A 43 CYS N . 36775 1 385 . 1 . 1 44 44 ARG H H 1 8.837 0.003 . 1 . . . . A 44 ARG H . 36775 1 386 . 1 . 1 44 44 ARG HA H 1 4.287 0.003 . 1 . . . . A 44 ARG HA . 36775 1 387 . 1 . 1 44 44 ARG HB2 H 1 2.013 0.000 . . . . . . A 44 ARG HB2 . 36775 1 388 . 1 . 1 44 44 ARG HB3 H 1 1.732 0.002 . . . . . . A 44 ARG HB3 . 36775 1 389 . 1 . 1 44 44 ARG HD2 H 1 3.277 0.000 . . . . . . A 44 ARG HD2 . 36775 1 390 . 1 . 1 44 44 ARG HD3 H 1 3.206 0.002 . . . . . . A 44 ARG HD3 . 36775 1 391 . 1 . 1 44 44 ARG HG2 H 1 1.595 0.001 . . . . . . A 44 ARG HG2 . 36775 1 392 . 1 . 1 44 44 ARG HG3 H 1 1.510 0.001 . . . . . . A 44 ARG HG3 . 36775 1 393 . 1 . 1 44 44 ARG CA C 13 56.995 0.008 . 1 . . . . A 44 ARG CA . 36775 1 394 . 1 . 1 44 44 ARG CB C 13 31.778 0.004 . 1 . . . . A 44 ARG CB . 36775 1 395 . 1 . 1 44 44 ARG CD C 13 43.694 0.000 . 1 . . . . A 44 ARG CD . 36775 1 396 . 1 . 1 44 44 ARG CG C 13 28.137 0.000 . 1 . . . . A 44 ARG CG . 36775 1 397 . 1 . 1 44 44 ARG N N 15 120.701 0.002 . 1 . . . . A 44 ARG N . 36775 1 398 . 1 . 1 45 45 ALA H H 1 8.448 0.004 . 1 . . . . A 45 ALA H . 36775 1 399 . 1 . 1 45 45 ALA HA H 1 4.680 0.000 . 1 . . . . A 45 ALA HA . 36775 1 400 . 1 . 1 45 45 ALA HB1 H 1 1.454 0.000 . 1 . . . . A 45 ALA HB1 . 36775 1 401 . 1 . 1 45 45 ALA HB2 H 1 1.454 0.000 . 1 . . . . A 45 ALA HB2 . 36775 1 402 . 1 . 1 45 45 ALA HB3 H 1 1.454 0.000 . 1 . . . . A 45 ALA HB3 . 36775 1 403 . 1 . 1 45 45 ALA CA C 13 54.831 0.001 . 1 . . . . A 45 ALA CA . 36775 1 404 . 1 . 1 45 45 ALA CB C 13 18.525 0.005 . 1 . . . . A 45 ALA CB . 36775 1 405 . 1 . 1 45 45 ALA N N 15 121.576 0.000 . 1 . . . . A 45 ALA N . 36775 1 406 . 1 . 1 46 46 ASP H H 1 8.377 0.004 . 1 . . . . A 46 ASP H . 36775 1 407 . 1 . 1 46 46 ASP HA H 1 4.576 0.000 . 1 . . . . A 46 ASP HA . 36775 1 408 . 1 . 1 46 46 ASP HB2 H 1 3.011 0.000 . . . . . . A 46 ASP HB2 . 36775 1 409 . 1 . 1 46 46 ASP HB3 H 1 2.724 0.000 . . . . . . A 46 ASP HB3 . 36775 1 410 . 1 . 1 46 46 ASP CA C 13 53.543 0.003 . 1 . . . . A 46 ASP CA . 36775 1 411 . 1 . 1 46 46 ASP CB C 13 39.505 0.003 . 1 . . . . A 46 ASP CB . 36775 1 412 . 1 . 1 46 46 ASP N N 15 114.828 0.005 . 1 . . . . A 46 ASP N . 36775 1 413 . 1 . 1 47 47 GLU H H 1 7.582 0.003 . 1 . . . . A 47 GLU H . 36775 1 414 . 1 . 1 47 47 GLU HA H 1 5.045 0.002 . 1 . . . . A 47 GLU HA . 36775 1 415 . 1 . 1 47 47 GLU HB2 H 1 1.883 0.000 . . . . . . A 47 GLU HB2 . 36775 1 416 . 1 . 1 47 47 GLU HB3 H 1 1.788 0.001 . . . . . . A 47 GLU HB3 . 36775 1 417 . 1 . 1 47 47 GLU HG2 H 1 2.279 0.001 . . . . . . A 47 GLU HG2 . 36775 1 418 . 1 . 1 47 47 GLU HG3 H 1 2.167 0.000 . . . . . . A 47 GLU HG3 . 36775 1 419 . 1 . 1 47 47 GLU CA C 13 54.375 0.005 . 1 . . . . A 47 GLU CA . 36775 1 420 . 1 . 1 47 47 GLU CB C 13 35.016 0.004 . 1 . . . . A 47 GLU CB . 36775 1 421 . 1 . 1 47 47 GLU CG C 13 36.286 0.000 . 1 . . . . A 47 GLU CG . 36775 1 422 . 1 . 1 47 47 GLU N N 15 117.630 0.000 . 1 . . . . A 47 GLU N . 36775 1 423 . 1 . 1 48 48 ILE H H 1 8.966 0.004 . 1 . . . . A 48 ILE H . 36775 1 424 . 1 . 1 48 48 ILE HA H 1 4.666 0.000 . 1 . . . . A 48 ILE HA . 36775 1 425 . 1 . 1 48 48 ILE HB H 1 1.868 0.000 . 1 . . . . A 48 ILE HB . 36775 1 426 . 1 . 1 48 48 ILE HD11 H 1 0.679 0.000 . 1 . . . . A 48 ILE HD11 . 36775 1 427 . 1 . 1 48 48 ILE HD12 H 1 0.679 0.000 . 1 . . . . A 48 ILE HD12 . 36775 1 428 . 1 . 1 48 48 ILE HD13 H 1 0.679 0.000 . 1 . . . . A 48 ILE HD13 . 36775 1 429 . 1 . 1 48 48 ILE HG12 H 1 1.214 0.000 . . . . . . A 48 ILE HG12 . 36775 1 430 . 1 . 1 48 48 ILE HG13 H 1 1.120 0.000 . . . . . . A 48 ILE HG13 . 36775 1 431 . 1 . 1 48 48 ILE HG21 H 1 0.932 0.000 . 1 . . . . A 48 ILE HG21 . 36775 1 432 . 1 . 1 48 48 ILE HG22 H 1 0.932 0.000 . 1 . . . . A 48 ILE HG22 . 36775 1 433 . 1 . 1 48 48 ILE HG23 H 1 0.932 0.000 . 1 . . . . A 48 ILE HG23 . 36775 1 434 . 1 . 1 48 48 ILE CA C 13 59.209 0.012 . 1 . . . . A 48 ILE CA . 36775 1 435 . 1 . 1 48 48 ILE CB C 13 42.724 0.002 . 1 . . . . A 48 ILE CB . 36775 1 436 . 1 . 1 48 48 ILE CD1 C 13 14.065 0.000 . 1 . . . . A 48 ILE CD1 . 36775 1 437 . 1 . 1 48 48 ILE CG1 C 13 27.181 0.000 . 1 . . . . A 48 ILE CG1 . 36775 1 438 . 1 . 1 48 48 ILE CG2 C 13 18.140 0.000 . 1 . . . . A 48 ILE CG2 . 36775 1 439 . 1 . 1 48 48 ILE N N 15 115.250 0.000 . 1 . . . . A 48 ILE N . 36775 1 440 . 1 . 1 49 49 CYS H H 1 8.414 0.005 . 1 . . . . A 49 CYS H . 36775 1 441 . 1 . 1 49 49 CYS HA H 1 5.061 0.003 . 1 . . . . A 49 CYS HA . 36775 1 442 . 1 . 1 49 49 CYS HB2 H 1 3.119 0.000 . . . . . . A 49 CYS HB2 . 36775 1 443 . 1 . 1 49 49 CYS HB3 H 1 2.936 0.001 . . . . . . A 49 CYS HB3 . 36775 1 444 . 1 . 1 49 49 CYS CA C 13 56.990 0.006 . 1 . . . . A 49 CYS CA . 36775 1 445 . 1 . 1 49 49 CYS CB C 13 39.048 0.007 . 1 . . . . A 49 CYS CB . 36775 1 446 . 1 . 1 49 49 CYS N N 15 123.200 0.000 . 1 . . . . A 49 CYS N . 36775 1 447 . 1 . 1 50 50 VAL H H 1 9.298 0.004 . 1 . . . . A 50 VAL H . 36775 1 448 . 1 . 1 50 50 VAL HA H 1 4.541 0.002 . 1 . . . . A 50 VAL HA . 36775 1 449 . 1 . 1 50 50 VAL HB H 1 1.999 0.000 . 1 . . . . A 50 VAL HB . 36775 1 450 . 1 . 1 50 50 VAL HG11 H 1 0.980 0.003 . . . . . . A 50 VAL HG11 . 36775 1 451 . 1 . 1 50 50 VAL HG12 H 1 0.980 0.003 . . . . . . A 50 VAL HG12 . 36775 1 452 . 1 . 1 50 50 VAL HG13 H 1 0.980 0.003 . . . . . . A 50 VAL HG13 . 36775 1 453 . 1 . 1 50 50 VAL HG21 H 1 0.865 0.006 . . . . . . A 50 VAL HG21 . 36775 1 454 . 1 . 1 50 50 VAL HG22 H 1 0.865 0.006 . . . . . . A 50 VAL HG22 . 36775 1 455 . 1 . 1 50 50 VAL HG23 H 1 0.865 0.006 . . . . . . A 50 VAL HG23 . 36775 1 456 . 1 . 1 50 50 VAL CA C 13 61.421 0.005 . 1 . . . . A 50 VAL CA . 36775 1 457 . 1 . 1 50 50 VAL CB C 13 35.215 0.003 . 1 . . . . A 50 VAL CB . 36775 1 458 . 1 . 1 50 50 VAL CG1 C 13 20.912 0.000 . . . . . . A 50 VAL CG1 . 36775 1 459 . 1 . 1 50 50 VAL CG2 C 13 20.922 0.000 . . . . . . A 50 VAL CG2 . 36775 1 460 . 1 . 1 50 50 VAL N N 15 128.203 0.008 . 1 . . . . A 50 VAL N . 36775 1 461 . 1 . 1 51 51 GLN H H 1 8.800 0.003 . 1 . . . . A 51 GLN H . 36775 1 462 . 1 . 1 51 51 GLN HA H 1 5.303 0.004 . 1 . . . . A 51 GLN HA . 36775 1 463 . 1 . 1 51 51 GLN HB2 H 1 1.974 0.005 . . . . . . A 51 GLN HB2 . 36775 1 464 . 1 . 1 51 51 GLN HB3 H 1 2.055 0.006 . . . . . . A 51 GLN HB3 . 36775 1 465 . 1 . 1 51 51 GLN HG2 H 1 2.167 0.002 . . . . . . A 51 GLN HG2 . 36775 1 466 . 1 . 1 51 51 GLN HG3 H 1 2.324 0.005 . . . . . . A 51 GLN HG3 . 36775 1 467 . 1 . 1 51 51 GLN CA C 13 54.342 0.003 . 1 . . . . A 51 GLN CA . 36775 1 468 . 1 . 1 51 51 GLN CB C 13 32.658 0.004 . 1 . . . . A 51 GLN CB . 36775 1 469 . 1 . 1 51 51 GLN CG C 13 34.448 0.000 . 1 . . . . A 51 GLN CG . 36775 1 470 . 1 . 1 51 51 GLN N N 15 126.803 0.013 . 1 . . . . A 51 GLN N . 36775 1 471 . 1 . 1 52 52 ARG H H 1 9.079 0.006 . 1 . . . . A 52 ARG H . 36775 1 472 . 1 . 1 52 52 ARG HA H 1 4.752 0.003 . 1 . . . . A 52 ARG HA . 36775 1 473 . 1 . 1 52 52 ARG HB2 H 1 1.865 0.004 . . . . . . A 52 ARG HB2 . 36775 1 474 . 1 . 1 52 52 ARG HB3 H 1 1.711 0.002 . . . . . . A 52 ARG HB3 . 36775 1 475 . 1 . 1 52 52 ARG HD2 H 1 3.243 0.001 . . . . . . A 52 ARG HD2 . 36775 1 476 . 1 . 1 52 52 ARG HD3 H 1 3.164 0.003 . . . . . . A 52 ARG HD3 . 36775 1 477 . 1 . 1 52 52 ARG HG2 H 1 1.562 0.000 . . . . . . A 52 ARG HG2 . 36775 1 478 . 1 . 1 52 52 ARG HG3 H 1 1.486 0.002 . . . . . . A 52 ARG HG3 . 36775 1 479 . 1 . 1 52 52 ARG CA C 13 54.290 0.002 . 1 . . . . A 52 ARG CA . 36775 1 480 . 1 . 1 52 52 ARG CB C 13 33.082 0.003 . 1 . . . . A 52 ARG CB . 36775 1 481 . 1 . 1 52 52 ARG CD C 13 43.477 0.000 . 1 . . . . A 52 ARG CD . 36775 1 482 . 1 . 1 52 52 ARG CG C 13 26.830 0.000 . 1 . . . . A 52 ARG CG . 36775 1 483 . 1 . 1 52 52 ARG N N 15 124.600 0.021 . 1 . . . . A 52 ARG N . 36775 1 484 . 1 . 1 53 53 ASN H H 1 8.745 0.006 . 1 . . . . A 53 ASN H . 36775 1 485 . 1 . 1 53 53 ASN HA H 1 4.687 0.000 . 1 . . . . A 53 ASN HA . 36775 1 486 . 1 . 1 53 53 ASN HB2 H 1 2.768 0.000 . . . . . . A 53 ASN HB2 . 36775 1 487 . 1 . 1 53 53 ASN HB3 H 1 2.656 0.000 . . . . . . A 53 ASN HB3 . 36775 1 488 . 1 . 1 53 53 ASN CA C 13 52.770 0.004 . 1 . . . . A 53 ASN CA . 36775 1 489 . 1 . 1 53 53 ASN CB C 13 39.505 0.003 . 1 . . . . A 53 ASN CB . 36775 1 490 . 1 . 1 53 53 ASN N N 15 120.400 0.000 . 1 . . . . A 53 ASN N . 36775 1 491 . 1 . 1 54 54 LEU H H 1 8.659 0.003 . 1 . . . . A 54 LEU H . 36775 1 492 . 1 . 1 54 54 LEU HA H 1 4.654 0.000 . 1 . . . . A 54 LEU HA . 36775 1 493 . 1 . 1 54 54 LEU HB2 H 1 1.773 0.000 . . . . . . A 54 LEU HB2 . 36775 1 494 . 1 . 1 54 54 LEU HB3 H 1 1.646 0.000 . . . . . . A 54 LEU HB3 . 36775 1 495 . 1 . 1 54 54 LEU HD11 H 1 0.947 0.000 . . . . . . A 54 LEU HD11 . 36775 1 496 . 1 . 1 54 54 LEU HD12 H 1 0.947 0.000 . . . . . . A 54 LEU HD12 . 36775 1 497 . 1 . 1 54 54 LEU HD13 H 1 0.947 0.000 . . . . . . A 54 LEU HD13 . 36775 1 498 . 1 . 1 54 54 LEU HD21 H 1 0.763 0.000 . . . . . . A 54 LEU HD21 . 36775 1 499 . 1 . 1 54 54 LEU HD22 H 1 0.763 0.000 . . . . . . A 54 LEU HD22 . 36775 1 500 . 1 . 1 54 54 LEU HD23 H 1 0.763 0.000 . . . . . . A 54 LEU HD23 . 36775 1 501 . 1 . 1 54 54 LEU HG H 1 1.496 0.000 . 1 . . . . A 54 LEU HG . 36775 1 502 . 1 . 1 54 54 LEU CA C 13 54.029 0.010 . 1 . . . . A 54 LEU CA . 36775 1 503 . 1 . 1 54 54 LEU CB C 13 42.650 0.000 . 1 . . . . A 54 LEU CB . 36775 1 504 . 1 . 1 54 54 LEU N N 15 122.900 0.000 . 1 . . . . A 54 LEU N . 36775 1 505 . 1 . 1 55 55 SER H H 1 8.658 0.003 . 1 . . . . A 55 SER H . 36775 1 506 . 1 . 1 55 55 SER HA H 1 4.601 0.003 . 1 . . . . A 55 SER HA . 36775 1 507 . 1 . 1 55 55 SER HB2 H 1 4.075 0.003 . . . . . . A 55 SER HB2 . 36775 1 508 . 1 . 1 55 55 SER HB3 H 1 3.867 0.002 . . . . . . A 55 SER HB3 . 36775 1 509 . 1 . 1 55 55 SER CA C 13 59.260 0.000 . 1 . . . . A 55 SER CA . 36775 1 510 . 1 . 1 55 55 SER CB C 13 63.894 0.000 . 1 . . . . A 55 SER CB . 36775 1 511 . 1 . 1 55 55 SER N N 15 114.159 0.001 . 1 . . . . A 55 SER N . 36775 1 512 . 1 . 1 56 56 ASN H H 1 9.339 0.006 . 1 . . . . A 56 ASN H . 36775 1 513 . 1 . 1 56 56 ASN HA H 1 5.250 0.000 . 1 . . . . A 56 ASN HA . 36775 1 514 . 1 . 1 56 56 ASN HB2 H 1 3.044 0.000 . . . . . . A 56 ASN HB2 . 36775 1 515 . 1 . 1 56 56 ASN HB3 H 1 2.755 0.001 . . . . . . A 56 ASN HB3 . 36775 1 516 . 1 . 1 56 56 ASN CA C 13 52.801 0.002 . 1 . . . . A 56 ASN CA . 36775 1 517 . 1 . 1 56 56 ASN CB C 13 37.381 0.002 . 1 . . . . A 56 ASN CB . 36775 1 518 . 1 . 1 56 56 ASN N N 15 121.390 0.000 . 1 . . . . A 56 ASN N . 36775 1 519 . 1 . 1 57 57 GLY H H 1 8.213 0.005 . 1 . . . . A 57 GLY H . 36775 1 520 . 1 . 1 57 57 GLY HA2 H 1 4.686 0.000 . . . . . . A 57 GLY HA2 . 36775 1 521 . 1 . 1 57 57 GLY HA3 H 1 4.686 0.000 . . . . . . A 57 GLY HA3 . 36775 1 522 . 1 . 1 57 57 GLY CA C 13 45.353 0.007 . 1 . . . . A 57 GLY CA . 36775 1 523 . 1 . 1 57 57 GLY N N 15 107.425 0.001 . 1 . . . . A 57 GLY N . 36775 1 524 . 1 . 1 58 58 LYS H H 1 7.698 0.005 . 1 . . . . A 58 LYS H . 36775 1 525 . 1 . 1 58 58 LYS HA H 1 4.552 0.004 . 1 . . . . A 58 LYS HA . 36775 1 526 . 1 . 1 58 58 LYS HB2 H 1 1.804 0.004 . . . . . . A 58 LYS HB2 . 36775 1 527 . 1 . 1 58 58 LYS HB3 H 1 1.906 0.007 . . . . . . A 58 LYS HB3 . 36775 1 528 . 1 . 1 58 58 LYS HD2 H 1 1.640 0.004 . . . . . . A 58 LYS HD2 . 36775 1 529 . 1 . 1 58 58 LYS HD3 H 1 1.469 0.010 . . . . . . A 58 LYS HD3 . 36775 1 530 . 1 . 1 58 58 LYS HE2 H 1 3.003 0.017 . . . . . . A 58 LYS HE2 . 36775 1 531 . 1 . 1 58 58 LYS HE3 H 1 2.902 0.017 . . . . . . A 58 LYS HE3 . 36775 1 532 . 1 . 1 58 58 LYS HG2 H 1 1.276 0.003 . . . . . . A 58 LYS HG2 . 36775 1 533 . 1 . 1 58 58 LYS HG3 H 1 1.192 0.002 . . . . . . A 58 LYS HG3 . 36775 1 534 . 1 . 1 58 58 LYS CA C 13 54.890 0.003 . 1 . . . . A 58 LYS CA . 36775 1 535 . 1 . 1 58 58 LYS CB C 13 33.188 0.018 . 1 . . . . A 58 LYS CB . 36775 1 536 . 1 . 1 58 58 LYS CD C 13 28.540 0.000 . 1 . . . . A 58 LYS CD . 36775 1 537 . 1 . 1 58 58 LYS CE C 13 42.642 0.000 . 1 . . . . A 58 LYS CE . 36775 1 538 . 1 . 1 58 58 LYS CG C 13 25.157 0.000 . 1 . . . . A 58 LYS CG . 36775 1 539 . 1 . 1 58 58 LYS N N 15 119.659 0.000 . 1 . . . . A 58 LYS N . 36775 1 540 . 1 . 1 59 59 SER H H 1 7.617 0.005 . 1 . . . . A 59 SER H . 36775 1 541 . 1 . 1 59 59 SER HA H 1 5.202 0.004 . 1 . . . . A 59 SER HA . 36775 1 542 . 1 . 1 59 59 SER HB2 H 1 4.018 0.005 . . . . . . A 59 SER HB2 . 36775 1 543 . 1 . 1 59 59 SER HB3 H 1 3.904 0.004 . . . . . . A 59 SER HB3 . 36775 1 544 . 1 . 1 59 59 SER CA C 13 58.387 0.004 . 1 . . . . A 59 SER CA . 36775 1 545 . 1 . 1 59 59 SER CB C 13 66.033 0.010 . 1 . . . . A 59 SER CB . 36775 1 546 . 1 . 1 59 59 SER N N 15 114.091 0.000 . 1 . . . . A 59 SER N . 36775 1 547 . 1 . 1 60 60 PHE H H 1 9.263 0.009 . 1 . . . . A 60 PHE H . 36775 1 548 . 1 . 1 60 60 PHE HA H 1 5.057 0.003 . 1 . . . . A 60 PHE HA . 36775 1 549 . 1 . 1 60 60 PHE HB2 H 1 3.160 0.015 . . . . . . A 60 PHE HB2 . 36775 1 550 . 1 . 1 60 60 PHE HB3 H 1 2.938 0.013 . . . . . . A 60 PHE HB3 . 36775 1 551 . 1 . 1 60 60 PHE CA C 13 57.214 0.011 . 1 . . . . A 60 PHE CA . 36775 1 552 . 1 . 1 60 60 PHE CB C 13 43.118 0.005 . 1 . . . . A 60 PHE CB . 36775 1 553 . 1 . 1 60 60 PHE N N 15 124.992 0.011 . 1 . . . . A 60 PHE N . 36775 1 554 . 1 . 1 61 61 ALA H H 1 8.006 0.021 . 1 . . . . A 61 ALA H . 36775 1 555 . 1 . 1 61 61 ALA HA H 1 4.186 0.000 . 1 . . . . A 61 ALA HA . 36775 1 556 . 1 . 1 61 61 ALA HB1 H 1 1.385 0.000 . 1 . . . . A 61 ALA HB1 . 36775 1 557 . 1 . 1 61 61 ALA HB2 H 1 1.385 0.000 . 1 . . . . A 61 ALA HB2 . 36775 1 558 . 1 . 1 61 61 ALA HB3 H 1 1.385 0.000 . 1 . . . . A 61 ALA HB3 . 36775 1 559 . 1 . 1 61 61 ALA CA C 13 49.664 0.018 . 1 . . . . A 61 ALA CA . 36775 1 560 . 1 . 1 61 61 ALA CB C 13 23.800 0.007 . 1 . . . . A 61 ALA CB . 36775 1 561 . 1 . 1 61 61 ALA N N 15 130.300 0.000 . 1 . . . . A 61 ALA N . 36775 1 562 . 1 . 1 62 62 GLN H H 1 8.412 0.011 . 1 . . . . A 62 GLN H . 36775 1 563 . 1 . 1 62 62 GLN HA H 1 4.554 0.006 . 1 . . . . A 62 GLN HA . 36775 1 564 . 1 . 1 62 62 GLN HB2 H 1 1.990 0.000 . . . . . . A 62 GLN HB2 . 36775 1 565 . 1 . 1 62 62 GLN HB3 H 1 1.868 0.004 . . . . . . A 62 GLN HB3 . 36775 1 566 . 1 . 1 62 62 GLN HG2 H 1 2.231 0.003 . . . . . . A 62 GLN HG2 . 36775 1 567 . 1 . 1 62 62 GLN HG3 H 1 2.127 0.001 . . . . . . A 62 GLN HG3 . 36775 1 568 . 1 . 1 62 62 GLN CA C 13 54.255 0.012 . 1 . . . . A 62 GLN CA . 36775 1 569 . 1 . 1 62 62 GLN CB C 13 33.302 0.007 . 1 . . . . A 62 GLN CB . 36775 1 570 . 1 . 1 62 62 GLN CG C 13 34.930 0.000 . 1 . . . . A 62 GLN CG . 36775 1 571 . 1 . 1 62 62 GLN N N 15 115.698 0.006 . 1 . . . . A 62 GLN N . 36775 1 572 . 1 . 1 63 63 CYS H H 1 8.724 0.004 . 1 . . . . A 63 CYS H . 36775 1 573 . 1 . 1 63 63 CYS HA H 1 5.135 0.001 . 1 . . . . A 63 CYS HA . 36775 1 574 . 1 . 1 63 63 CYS HB2 H 1 2.952 0.010 . . . . . . A 63 CYS HB2 . 36775 1 575 . 1 . 1 63 63 CYS HB3 H 1 2.828 0.003 . . . . . . A 63 CYS HB3 . 36775 1 576 . 1 . 1 63 63 CYS CA C 13 55.522 0.009 . 1 . . . . A 63 CYS CA . 36775 1 577 . 1 . 1 63 63 CYS CB C 13 41.358 0.000 . 1 . . . . A 63 CYS CB . 36775 1 578 . 1 . 1 63 63 CYS N N 15 121.502 0.009 . 1 . . . . A 63 CYS N . 36775 1 579 . 1 . 1 64 64 ILE H H 1 9.282 0.005 . 1 . . . . A 64 ILE H . 36775 1 580 . 1 . 1 64 64 ILE HA H 1 4.592 0.006 . 1 . . . . A 64 ILE HA . 36775 1 581 . 1 . 1 64 64 ILE HB H 1 2.112 0.012 . 1 . . . . A 64 ILE HB . 36775 1 582 . 1 . 1 64 64 ILE HD11 H 1 0.874 0.012 . 1 . . . . A 64 ILE HD11 . 36775 1 583 . 1 . 1 64 64 ILE HD12 H 1 0.874 0.012 . 1 . . . . A 64 ILE HD12 . 36775 1 584 . 1 . 1 64 64 ILE HD13 H 1 0.874 0.012 . 1 . . . . A 64 ILE HD13 . 36775 1 585 . 1 . 1 64 64 ILE HG12 H 1 1.226 0.001 . . . . . . A 64 ILE HG12 . 36775 1 586 . 1 . 1 64 64 ILE HG13 H 1 1.144 0.006 . . . . . . A 64 ILE HG13 . 36775 1 587 . 1 . 1 64 64 ILE HG21 H 1 0.979 0.010 . 1 . . . . A 64 ILE HG21 . 36775 1 588 . 1 . 1 64 64 ILE HG22 H 1 0.979 0.010 . 1 . . . . A 64 ILE HG22 . 36775 1 589 . 1 . 1 64 64 ILE HG23 H 1 0.979 0.010 . 1 . . . . A 64 ILE HG23 . 36775 1 590 . 1 . 1 64 64 ILE CA C 13 59.287 0.004 . 1 . . . . A 64 ILE CA . 36775 1 591 . 1 . 1 64 64 ILE CB C 13 41.478 0.007 . 1 . . . . A 64 ILE CB . 36775 1 592 . 1 . 1 64 64 ILE CD1 C 13 13.247 0.000 . 1 . . . . A 64 ILE CD1 . 36775 1 593 . 1 . 1 64 64 ILE CG1 C 13 26.777 0.000 . 1 . . . . A 64 ILE CG1 . 36775 1 594 . 1 . 1 64 64 ILE CG2 C 13 17.680 0.000 . 1 . . . . A 64 ILE CG2 . 36775 1 595 . 1 . 1 64 64 ILE N N 15 118.220 0.000 . 1 . . . . A 64 ILE N . 36775 1 596 . 1 . 1 65 65 GLU H H 1 8.536 0.007 . 1 . . . . A 65 GLU H . 36775 1 597 . 1 . 1 65 65 GLU HA H 1 4.286 0.003 . 1 . . . . A 65 GLU HA . 36775 1 598 . 1 . 1 65 65 GLU HB2 H 1 1.965 0.009 . . . . . . A 65 GLU HB2 . 36775 1 599 . 1 . 1 65 65 GLU HB3 H 1 2.058 0.008 . . . . . . A 65 GLU HB3 . 36775 1 600 . 1 . 1 65 65 GLU HG2 H 1 2.349 0.005 . . . . . . A 65 GLU HG2 . 36775 1 601 . 1 . 1 65 65 GLU HG3 H 1 2.252 0.020 . . . . . . A 65 GLU HG3 . 36775 1 602 . 1 . 1 65 65 GLU CA C 13 57.313 0.011 . 1 . . . . A 65 GLU CA . 36775 1 603 . 1 . 1 65 65 GLU CB C 13 30.435 0.006 . 1 . . . . A 65 GLU CB . 36775 1 604 . 1 . 1 65 65 GLU CG C 13 36.586 0.000 . 1 . . . . A 65 GLU CG . 36775 1 605 . 1 . 1 65 65 GLU N N 15 123.342 0.000 . 1 . . . . A 65 GLU N . 36775 1 606 . 1 . 1 66 66 LEU H H 1 8.372 0.004 . 1 . . . . A 66 LEU H . 36775 1 607 . 1 . 1 66 66 LEU HA H 1 4.306 0.009 . 1 . . . . A 66 LEU HA . 36775 1 608 . 1 . 1 66 66 LEU HB2 H 1 1.766 0.007 . . . . . . A 66 LEU HB2 . 36775 1 609 . 1 . 1 66 66 LEU HB3 H 1 1.556 0.006 . . . . . . A 66 LEU HB3 . 36775 1 610 . 1 . 1 66 66 LEU HD11 H 1 0.931 0.002 . . . . . . A 66 LEU HD11 . 36775 1 611 . 1 . 1 66 66 LEU HD12 H 1 0.931 0.002 . . . . . . A 66 LEU HD12 . 36775 1 612 . 1 . 1 66 66 LEU HD13 H 1 0.931 0.002 . . . . . . A 66 LEU HD13 . 36775 1 613 . 1 . 1 66 66 LEU HD21 H 1 0.835 0.003 . . . . . . A 66 LEU HD21 . 36775 1 614 . 1 . 1 66 66 LEU HD22 H 1 0.835 0.003 . . . . . . A 66 LEU HD22 . 36775 1 615 . 1 . 1 66 66 LEU HD23 H 1 0.835 0.003 . . . . . . A 66 LEU HD23 . 36775 1 616 . 1 . 1 66 66 LEU HG H 1 1.397 0.003 . 1 . . . . A 66 LEU HG . 36775 1 617 . 1 . 1 66 66 LEU CA C 13 55.264 0.012 . 1 . . . . A 66 LEU CA . 36775 1 618 . 1 . 1 66 66 LEU CB C 13 42.754 0.023 . 1 . . . . A 66 LEU CB . 36775 1 619 . 1 . 1 66 66 LEU CD1 C 13 24.505 0.000 . . . . . . A 66 LEU CD1 . 36775 1 620 . 1 . 1 66 66 LEU CD2 C 13 24.530 0.000 . . . . . . A 66 LEU CD2 . 36775 1 621 . 1 . 1 66 66 LEU CG C 13 27.318 0.000 . 1 . . . . A 66 LEU CG . 36775 1 622 . 1 . 1 66 66 LEU N N 15 125.974 0.004 . 1 . . . . A 66 LEU N . 36775 1 623 . 1 . 1 67 67 VAL H H 1 8.114 0.005 . 1 . . . . A 67 VAL H . 36775 1 624 . 1 . 1 67 67 VAL HA H 1 4.104 0.006 . 1 . . . . A 67 VAL HA . 36775 1 625 . 1 . 1 67 67 VAL HB H 1 2.046 0.001 . 1 . . . . A 67 VAL HB . 36775 1 626 . 1 . 1 67 67 VAL HG11 H 1 1.010 0.000 . . . . . . A 67 VAL HG11 . 36775 1 627 . 1 . 1 67 67 VAL HG12 H 1 1.010 0.000 . . . . . . A 67 VAL HG12 . 36775 1 628 . 1 . 1 67 67 VAL HG13 H 1 1.010 0.000 . . . . . . A 67 VAL HG13 . 36775 1 629 . 1 . 1 67 67 VAL HG21 H 1 0.879 0.000 . . . . . . A 67 VAL HG21 . 36775 1 630 . 1 . 1 67 67 VAL HG22 H 1 0.879 0.000 . . . . . . A 67 VAL HG22 . 36775 1 631 . 1 . 1 67 67 VAL HG23 H 1 0.879 0.000 . . . . . . A 67 VAL HG23 . 36775 1 632 . 1 . 1 67 67 VAL CA C 13 62.620 0.019 . 1 . . . . A 67 VAL CA . 36775 1 633 . 1 . 1 67 67 VAL CB C 13 32.660 0.017 . 1 . . . . A 67 VAL CB . 36775 1 634 . 1 . 1 67 67 VAL CG1 C 13 20.959 0.000 . . . . . . A 67 VAL CG1 . 36775 1 635 . 1 . 1 67 67 VAL CG2 C 13 18.685 0.000 . . . . . . A 67 VAL CG2 . 36775 1 636 . 1 . 1 67 67 VAL N N 15 124.043 0.006 . 1 . . . . A 67 VAL N . 36775 1 637 . 1 . 1 68 68 LYS H H 1 7.963 0.003 . 1 . . . . A 68 LYS H . 36775 1 638 . 1 . 1 68 68 LYS HA H 1 4.182 0.004 . 1 . . . . A 68 LYS HA . 36775 1 639 . 1 . 1 68 68 LYS HB2 H 1 1.859 0.000 . . . . . . A 68 LYS HB2 . 36775 1 640 . 1 . 1 68 68 LYS HB3 H 1 1.778 0.004 . . . . . . A 68 LYS HB3 . 36775 1 641 . 1 . 1 68 68 LYS HD2 H 1 1.699 0.002 . . . . . . A 68 LYS HD2 . 36775 1 642 . 1 . 1 68 68 LYS HD3 H 1 1.631 0.000 . . . . . . A 68 LYS HD3 . 36775 1 643 . 1 . 1 68 68 LYS HE2 H 1 3.046 0.006 . . . . . . A 68 LYS HE2 . 36775 1 644 . 1 . 1 68 68 LYS HE3 H 1 2.966 0.002 . . . . . . A 68 LYS HE3 . 36775 1 645 . 1 . 1 68 68 LYS HG2 H 1 1.438 0.001 . . . . . . A 68 LYS HG2 . 36775 1 646 . 1 . 1 68 68 LYS HG3 H 1 1.363 0.005 . . . . . . A 68 LYS HG3 . 36775 1 647 . 1 . 1 68 68 LYS CA C 13 57.729 0.002 . 1 . . . . A 68 LYS CA . 36775 1 648 . 1 . 1 68 68 LYS CB C 13 33.924 0.000 . 1 . . . . A 68 LYS CB . 36775 1 649 . 1 . 1 68 68 LYS N N 15 131.184 0.014 . 1 . . . . A 68 LYS N . 36775 1 stop_ save_