################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51407 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name INF2-2-19_5H _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 2 '2D 1H-1H TOCSY' . . . 51407 1 3 '2D 1H-1H NOESY' . . . 51407 1 4 '2D 1H-13C HSQC aliphatic' . . . 51407 1 5 '2D 1H-13C HSQC aromatic' . . . 51407 1 6 '2D DQF-COSY' . . . 51407 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 2 $software_2 . . 51407 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 1 1 SER HA H 1 4.203 0.001 . 1 . . . . . 1 SER HA . 51407 1 2 . 1 . 1 1 1 SER HB2 H 1 3.989 0.004 . 2 . . . . . 1 SER HB2 . 51407 1 3 . 1 . 1 1 1 SER HB3 H 1 3.989 0.004 . 2 . . . . . 1 SER HB3 . 51407 1 4 . 1 . 1 1 1 SER CA C 13 57.225 0.000 . 1 . . . . . 1 SER CA . 51407 1 5 . 1 . 1 1 1 SER CB C 13 63.261 0.000 . 1 . . . . . 1 SER CB . 51407 1 6 . 1 . 1 2 2 VAL H H 1 8.733 0.001 . 1 . . . . . 2 VAL H . 51407 1 7 . 1 . 1 2 2 VAL HA H 1 4.169 0.003 . 1 . . . . . 2 VAL HA . 51407 1 8 . 1 . 1 2 2 VAL HB H 1 2.077 0.003 . 1 . . . . . 2 VAL HB . 51407 1 9 . 1 . 1 2 2 VAL HG11 H 1 0.949 0.003 . 2 . . . . . 2 VAL QG1 . 51407 1 10 . 1 . 1 2 2 VAL HG12 H 1 0.949 0.003 . 2 . . . . . 2 VAL QG1 . 51407 1 11 . 1 . 1 2 2 VAL HG13 H 1 0.949 0.003 . 2 . . . . . 2 VAL QG1 . 51407 1 12 . 1 . 1 2 2 VAL HG21 H 1 0.949 0.003 . 2 . . . . . 2 VAL QG2 . 51407 1 13 . 1 . 1 2 2 VAL HG22 H 1 0.949 0.003 . 2 . . . . . 2 VAL QG2 . 51407 1 14 . 1 . 1 2 2 VAL HG23 H 1 0.949 0.003 . 2 . . . . . 2 VAL QG2 . 51407 1 15 . 1 . 1 2 2 VAL CA C 13 62.536 0.000 . 1 . . . . . 2 VAL CA . 51407 1 16 . 1 . 1 2 2 VAL CB C 13 32.907 0.000 . 1 . . . . . 2 VAL CB . 51407 1 17 . 1 . 1 2 2 VAL CG1 C 13 20.493 0.000 . 1 . . . . . 2 VAL CG1 . 51407 1 18 . 1 . 1 2 2 VAL CG2 C 13 21.106 0.000 . 1 . . . . . 2 VAL CG2 . 51407 1 19 . 1 . 1 3 3 LYS H H 1 8.624 0.001 . 1 . . . . . 3 LYS H . 51407 1 20 . 1 . 1 3 3 LYS HA H 1 4.286 0.002 . 1 . . . . . 3 LYS HA . 51407 1 21 . 1 . 1 3 3 LYS HB2 H 1 1.759 0.002 . 2 . . . . . 3 LYS HB2 . 51407 1 22 . 1 . 1 3 3 LYS HB3 H 1 1.791 0.005 . 2 . . . . . 3 LYS HB3 . 51407 1 23 . 1 . 1 3 3 LYS HG2 H 1 1.433 0.004 . 2 . . . . . 3 LYS HG2 . 51407 1 24 . 1 . 1 3 3 LYS HG3 H 1 1.433 0.004 . 2 . . . . . 3 LYS HG3 . 51407 1 25 . 1 . 1 3 3 LYS HD2 H 1 1.668 0.001 . 2 . . . . . 3 LYS HD2 . 51407 1 26 . 1 . 1 3 3 LYS HD3 H 1 1.668 0.001 . 2 . . . . . 3 LYS HD3 . 51407 1 27 . 1 . 1 3 3 LYS HE2 H 1 2.977 0.006 . 2 . . . . . 3 LYS HE2 . 51407 1 28 . 1 . 1 3 3 LYS HE3 H 1 2.977 0.006 . 2 . . . . . 3 LYS HE3 . 51407 1 29 . 1 . 1 3 3 LYS HZ1 H 1 7.608 0.000 . 1 . . . . . 3 LYS HZ1 . 51407 1 30 . 1 . 1 3 3 LYS HZ2 H 1 7.608 0.000 . 1 . . . . . 3 LYS HZ2 . 51407 1 31 . 1 . 1 3 3 LYS HZ3 H 1 7.608 0.000 . 1 . . . . . 3 LYS HZ3 . 51407 1 32 . 1 . 1 3 3 LYS CA C 13 56.563 0.000 . 1 . . . . . 3 LYS CA . 51407 1 33 . 1 . 1 3 3 LYS CB C 13 32.897 0.005 . 1 . . . . . 3 LYS CB . 51407 1 34 . 1 . 1 3 3 LYS CG C 13 24.790 0.000 . 1 . . . . . 3 LYS CG . 51407 1 35 . 1 . 1 3 3 LYS CD C 13 29.114 0.000 . 1 . . . . . 3 LYS CD . 51407 1 36 . 1 . 1 3 3 LYS CE C 13 42.093 0.000 . 1 . . . . . 3 LYS CE . 51407 1 37 . 1 . 1 4 4 GLU H H 1 8.591 0.001 . 1 . . . . . 4 GLU H . 51407 1 38 . 1 . 1 4 4 GLU HA H 1 4.258 0.002 . 1 . . . . . 4 GLU HA . 51407 1 39 . 1 . 1 4 4 GLU HB2 H 1 1.977 0.002 . 2 . . . . . 4 GLU HB2 . 51407 1 40 . 1 . 1 4 4 GLU HB3 H 1 2.042 0.001 . 2 . . . . . 4 GLU HB3 . 51407 1 41 . 1 . 1 4 4 GLU HG2 H 1 2.299 0.003 . 2 . . . . . 4 GLU HG2 . 51407 1 42 . 1 . 1 4 4 GLU HG3 H 1 2.299 0.003 . 2 . . . . . 4 GLU HG3 . 51407 1 43 . 1 . 1 4 4 GLU CA C 13 56.946 0.000 . 1 . . . . . 4 GLU CA . 51407 1 44 . 1 . 1 4 4 GLU CB C 13 30.219 0.009 . 1 . . . . . 4 GLU CB . 51407 1 45 . 1 . 1 4 4 GLU CG C 13 36.091 0.000 . 1 . . . . . 4 GLU CG . 51407 1 46 . 1 . 1 5 5 GLY H H 1 8.622 0.001 . 1 . . . . . 5 GLY H . 51407 1 47 . 1 . 1 5 5 GLY HA2 H 1 3.959 0.003 . 2 . . . . . 5 GLY HA2 . 51407 1 48 . 1 . 1 5 5 GLY HA3 H 1 3.959 0.003 . 2 . . . . . 5 GLY HA3 . 51407 1 49 . 1 . 1 5 5 GLY CA C 13 45.358 0.000 . 1 . . . . . 5 GLY CA . 51407 1 50 . 1 . 1 6 6 ALA H H 1 8.314 0.002 . 1 . . . . . 6 ALA H . 51407 1 51 . 1 . 1 6 6 ALA HA H 1 4.272 0.003 . 1 . . . . . 6 ALA HA . 51407 1 52 . 1 . 1 6 6 ALA HB1 H 1 1.395 0.004 . 1 . . . . . 6 ALA HB# . 51407 1 53 . 1 . 1 6 6 ALA HB2 H 1 1.395 0.004 . 1 . . . . . 6 ALA HB# . 51407 1 54 . 1 . 1 6 6 ALA HB3 H 1 1.395 0.004 . 1 . . . . . 6 ALA HB# . 51407 1 55 . 1 . 1 6 6 ALA CA C 13 52.910 0.000 . 1 . . . . . 6 ALA CA . 51407 1 56 . 1 . 1 6 6 ALA CB C 13 19.160 0.000 . 1 . . . . . 6 ALA CB . 51407 1 57 . 1 . 1 7 7 GLN H H 1 8.516 0.001 . 1 . . . . . 7 GLN H . 51407 1 58 . 1 . 1 7 7 GLN HA H 1 4.242 0.004 . 1 . . . . . 7 GLN HA . 51407 1 59 . 1 . 1 7 7 GLN HB2 H 1 1.994 0.001 . 2 . . . . . 7 GLN HB2 . 51407 1 60 . 1 . 1 7 7 GLN HB3 H 1 2.090 0.002 . 2 . . . . . 7 GLN HB3 . 51407 1 61 . 1 . 1 7 7 GLN HG2 H 1 2.378 0.004 . 2 . . . . . 7 GLN HG2 . 51407 1 62 . 1 . 1 7 7 GLN HG3 H 1 2.378 0.004 . 2 . . . . . 7 GLN HG3 . 51407 1 63 . 1 . 1 7 7 GLN HE21 H 1 6.989 0.001 . 2 . . . . . 7 GLN HE21 . 51407 1 64 . 1 . 1 7 7 GLN HE22 H 1 7.646 0.001 . 2 . . . . . 7 GLN HE22 . 51407 1 65 . 1 . 1 7 7 GLN CA C 13 56.961 0.000 . 1 . . . . . 7 GLN CA . 51407 1 66 . 1 . 1 7 7 GLN CB C 13 29.151 0.007 . 1 . . . . . 7 GLN CB . 51407 1 67 . 1 . 1 7 7 GLN CG C 13 33.820 0.000 . 1 . . . . . 7 GLN CG . 51407 1 68 . 1 . 1 8 8 ARG H H 1 8.404 0.003 . 1 . . . . . 8 ARG H . 51407 1 69 . 1 . 1 8 8 ARG HA H 1 4.196 0.002 . 1 . . . . . 8 ARG HA . 51407 1 70 . 1 . 1 8 8 ARG HB2 H 1 1.693 0.003 . 2 . . . . . 8 ARG HB2 . 51407 1 71 . 1 . 1 8 8 ARG HB3 H 1 1.693 0.003 . 2 . . . . . 8 ARG HB3 . 51407 1 72 . 1 . 1 8 8 ARG HG2 H 1 1.509 0.004 . 2 . . . . . 8 ARG HG2 . 51407 1 73 . 1 . 1 8 8 ARG HG3 H 1 1.549 0.003 . 2 . . . . . 8 ARG HG3 . 51407 1 74 . 1 . 1 8 8 ARG HD2 H 1 3.103 0.002 . 2 . . . . . 8 ARG HD2 . 51407 1 75 . 1 . 1 8 8 ARG HD3 H 1 3.103 0.002 . 2 . . . . . 8 ARG HD3 . 51407 1 76 . 1 . 1 8 8 ARG HE H 1 7.202 0.001 . 1 . . . . . 8 ARG HE . 51407 1 77 . 1 . 1 8 8 ARG HH11 H 1 6.515 0.003 . 2 . . . . . 8 ARG HH11 . 51407 1 78 . 1 . 1 8 8 ARG HH12 H 1 6.515 0.003 . 2 . . . . . 8 ARG HH12 . 51407 1 79 . 1 . 1 8 8 ARG HH21 H 1 6.939 0.005 . 2 . . . . . 8 ARG HH21 . 51407 1 80 . 1 . 1 8 8 ARG HH22 H 1 6.939 0.005 . 2 . . . . . 8 ARG HH22 . 51407 1 81 . 1 . 1 8 8 ARG CA C 13 56.557 0.000 . 1 . . . . . 8 ARG CA . 51407 1 82 . 1 . 1 8 8 ARG CB C 13 30.566 0.000 . 1 . . . . . 8 ARG CB . 51407 1 83 . 1 . 1 8 8 ARG CG C 13 27.054 0.009 . 1 . . . . . 8 ARG CG . 51407 1 84 . 1 . 1 8 8 ARG CD C 13 43.260 0.000 . 1 . . . . . 8 ARG CD . 51407 1 85 . 1 . 1 9 9 LYS H H 1 8.386 0.001 . 1 . . . . . 9 LYS H . 51407 1 86 . 1 . 1 9 9 LYS HA H 1 4.230 0.002 . 1 . . . . . 9 LYS HA . 51407 1 87 . 1 . 1 9 9 LYS HB2 H 1 1.696 0.003 . 2 . . . . . 9 LYS HB2 . 51407 1 88 . 1 . 1 9 9 LYS HB3 H 1 1.696 0.003 . 2 . . . . . 9 LYS HB3 . 51407 1 89 . 1 . 1 9 9 LYS HG2 H 1 1.247 0.002 . 2 . . . . . 9 LYS HG2 . 51407 1 90 . 1 . 1 9 9 LYS HG3 H 1 1.340 0.003 . 2 . . . . . 9 LYS HG3 . 51407 1 91 . 1 . 1 9 9 LYS HD2 H 1 1.607 0.003 . 2 . . . . . 9 LYS HD2 . 51407 1 92 . 1 . 1 9 9 LYS HD3 H 1 1.607 0.003 . 2 . . . . . 9 LYS HD3 . 51407 1 93 . 1 . 1 9 9 LYS HE2 H 1 2.901 0.001 . 2 . . . . . 9 LYS HE2 . 51407 1 94 . 1 . 1 9 9 LYS HE3 H 1 2.901 0.001 . 2 . . . . . 9 LYS HE3 . 51407 1 95 . 1 . 1 9 9 LYS HZ1 H 1 7.613 0.000 . 1 . . . . . 9 LYS HZ1 . 51407 1 96 . 1 . 1 9 9 LYS HZ2 H 1 7.613 0.000 . 1 . . . . . 9 LYS HZ2 . 51407 1 97 . 1 . 1 9 9 LYS HZ3 H 1 7.613 0.000 . 1 . . . . . 9 LYS HZ3 . 51407 1 98 . 1 . 1 9 9 LYS CA C 13 56.238 0.000 . 1 . . . . . 9 LYS CA . 51407 1 99 . 1 . 1 9 9 LYS CB C 13 32.876 0.000 . 1 . . . . . 9 LYS CB . 51407 1 100 . 1 . 1 9 9 LYS CG C 13 24.767 0.001 . 1 . . . . . 9 LYS CG . 51407 1 101 . 1 . 1 9 9 LYS CD C 13 29.113 0.000 . 1 . . . . . 9 LYS CD . 51407 1 102 . 1 . 1 9 9 LYS CE C 13 42.044 0.000 . 1 . . . . . 9 LYS CE . 51407 1 103 . 1 . 1 10 10 TRP H H 1 8.279 0.003 . 1 . . . . . 10 TRP H . 51407 1 104 . 1 . 1 10 10 TRP HA H 1 4.600 0.001 . 1 . . . . . 10 TRP HA . 51407 1 105 . 1 . 1 10 10 TRP HB2 H 1 3.234 0.003 . 2 . . . . . 10 TRP HB2 . 51407 1 106 . 1 . 1 10 10 TRP HB3 H 1 3.306 0.004 . 2 . . . . . 10 TRP HB3 . 51407 1 107 . 1 . 1 10 10 TRP HD1 H 1 7.250 0.001 . 1 . . . . . 10 TRP HD1 . 51407 1 108 . 1 . 1 10 10 TRP HE1 H 1 10.224 0.002 . 1 . . . . . 10 TRP HE1 . 51407 1 109 . 1 . 1 10 10 TRP HE3 H 1 7.602 0.003 . 1 . . . . . 10 TRP HE3 . 51407 1 110 . 1 . 1 10 10 TRP HZ2 H 1 7.469 0.002 . 1 . . . . . 10 TRP HZ2 . 51407 1 111 . 1 . 1 10 10 TRP HZ3 H 1 7.127 0.002 . 1 . . . . . 10 TRP HZ3 . 51407 1 112 . 1 . 1 10 10 TRP HH2 H 1 7.219 0.003 . 1 . . . . . 10 TRP HH2 . 51407 1 113 . 1 . 1 10 10 TRP CA C 13 57.715 0.000 . 1 . . . . . 10 TRP CA . 51407 1 114 . 1 . 1 10 10 TRP CB C 13 29.634 0.001 . 1 . . . . . 10 TRP CB . 51407 1 115 . 1 . 1 10 10 TRP CD1 C 13 127.340 0.000 . 1 . . . . . 10 TRP CD1 . 51407 1 116 . 1 . 1 10 10 TRP CE3 C 13 120.933 0.000 . 1 . . . . . 10 TRP CE3 . 51407 1 117 . 1 . 1 10 10 TRP CZ2 C 13 114.524 0.000 . 1 . . . . . 10 TRP CZ2 . 51407 1 118 . 1 . 1 10 10 TRP CZ3 C 13 122.075 0.000 . 1 . . . . . 10 TRP CZ3 . 51407 1 119 . 1 . 1 10 10 TRP CH2 C 13 124.663 0.000 . 1 . . . . . 10 TRP CH2 . 51407 1 120 . 1 . 1 11 11 ALA H H 1 8.128 0.001 . 1 . . . . . 11 ALA H . 51407 1 121 . 1 . 1 11 11 ALA HA H 1 4.144 0.002 . 1 . . . . . 11 ALA HA . 51407 1 122 . 1 . 1 11 11 ALA HB1 H 1 1.313 0.002 . 1 . . . . . 11 ALA HB# . 51407 1 123 . 1 . 1 11 11 ALA HB2 H 1 1.313 0.002 . 1 . . . . . 11 ALA HB# . 51407 1 124 . 1 . 1 11 11 ALA HB3 H 1 1.313 0.002 . 1 . . . . . 11 ALA HB# . 51407 1 125 . 1 . 1 11 11 ALA CA C 13 52.689 0.000 . 1 . . . . . 11 ALA CA . 51407 1 126 . 1 . 1 11 11 ALA CB C 13 19.384 0.000 . 1 . . . . . 11 ALA CB . 51407 1 127 . 1 . 1 12 12 ALA H H 1 8.123 0.001 . 1 . . . . . 12 ALA H . 51407 1 128 . 1 . 1 12 12 ALA HA H 1 4.162 0.003 . 1 . . . . . 12 ALA HA . 51407 1 129 . 1 . 1 12 12 ALA HB1 H 1 1.373 0.002 . 1 . . . . . 12 ALA HB# . 51407 1 130 . 1 . 1 12 12 ALA HB2 H 1 1.373 0.002 . 1 . . . . . 12 ALA HB# . 51407 1 131 . 1 . 1 12 12 ALA HB3 H 1 1.373 0.002 . 1 . . . . . 12 ALA HB# . 51407 1 132 . 1 . 1 12 12 ALA CA C 13 52.690 0.000 . 1 . . . . . 12 ALA CA . 51407 1 133 . 1 . 1 12 12 ALA CB C 13 19.018 0.000 . 1 . . . . . 12 ALA CB . 51407 1 134 . 1 . 1 13 13 LEU H H 1 8.169 0.001 . 1 . . . . . 13 LEU H . 51407 1 135 . 1 . 1 13 13 LEU HA H 1 4.264 0.000 . 1 . . . . . 13 LEU HA . 51407 1 136 . 1 . 1 13 13 LEU HB2 H 1 1.578 0.002 . 2 . . . . . 13 LEU HB2 . 51407 1 137 . 1 . 1 13 13 LEU HB3 H 1 1.667 0.003 . 2 . . . . . 13 LEU HB3 . 51407 1 138 . 1 . 1 13 13 LEU HG H 1 1.646 0.003 . 1 . . . . . 13 LEU HG . 51407 1 139 . 1 . 1 13 13 LEU HD11 H 1 0.873 0.004 . 2 . . . . . 13 LEU QD1 . 51407 1 140 . 1 . 1 13 13 LEU HD12 H 1 0.873 0.004 . 2 . . . . . 13 LEU QD1 . 51407 1 141 . 1 . 1 13 13 LEU HD13 H 1 0.873 0.004 . 2 . . . . . 13 LEU QD1 . 51407 1 142 . 1 . 1 13 13 LEU HD21 H 1 0.918 0.004 . 2 . . . . . 13 LEU QD2 . 51407 1 143 . 1 . 1 13 13 LEU HD22 H 1 0.918 0.004 . 2 . . . . . 13 LEU QD2 . 51407 1 144 . 1 . 1 13 13 LEU HD23 H 1 0.918 0.004 . 2 . . . . . 13 LEU QD2 . 51407 1 145 . 1 . 1 13 13 LEU CA C 13 55.495 0.000 . 1 . . . . . 13 LEU CA . 51407 1 146 . 1 . 1 13 13 LEU CB C 13 42.218 0.003 . 1 . . . . . 13 LEU CB . 51407 1 147 . 1 . 1 13 13 LEU CG C 13 26.959 0.000 . 1 . . . . . 13 LEU CG . 51407 1 148 . 1 . 1 13 13 LEU CD1 C 13 23.496 0.000 . 1 . . . . . 13 LEU CD1 . 51407 1 149 . 1 . 1 13 13 LEU CD2 C 13 25.016 0.000 . 1 . . . . . 13 LEU CD2 . 51407 1 150 . 1 . 1 14 14 LYS H H 1 8.303 0.002 . 1 . . . . . 14 LYS H . 51407 1 151 . 1 . 1 14 14 LYS HA H 1 4.218 0.002 . 1 . . . . . 14 LYS HA . 51407 1 152 . 1 . 1 14 14 LYS HB2 H 1 1.732 0.001 . 2 . . . . . 14 LYS HB2 . 51407 1 153 . 1 . 1 14 14 LYS HB3 H 1 1.801 0.002 . 2 . . . . . 14 LYS HB3 . 51407 1 154 . 1 . 1 14 14 LYS HG2 H 1 1.395 0.000 . 2 . . . . . 14 LYS HG2 . 51407 1 155 . 1 . 1 14 14 LYS HG3 H 1 1.395 0.000 . 2 . . . . . 14 LYS HG3 . 51407 1 156 . 1 . 1 14 14 LYS HD2 H 1 1.648 0.001 . 2 . . . . . 14 LYS HD2 . 51407 1 157 . 1 . 1 14 14 LYS HD3 H 1 1.648 0.001 . 2 . . . . . 14 LYS HD3 . 51407 1 158 . 1 . 1 14 14 LYS HE2 H 1 2.951 0.002 . 2 . . . . . 14 LYS HE2 . 51407 1 159 . 1 . 1 14 14 LYS HE3 H 1 2.951 0.002 . 2 . . . . . 14 LYS HE3 . 51407 1 160 . 1 . 1 14 14 LYS HZ1 H 1 7.609 0.000 . 1 . . . . . 14 LYS HZ1 . 51407 1 161 . 1 . 1 14 14 LYS HZ2 H 1 7.609 0.000 . 1 . . . . . 14 LYS HZ2 . 51407 1 162 . 1 . 1 14 14 LYS HZ3 H 1 7.609 0.000 . 1 . . . . . 14 LYS HZ3 . 51407 1 163 . 1 . 1 14 14 LYS CA C 13 56.274 0.000 . 1 . . . . . 14 LYS CA . 51407 1 164 . 1 . 1 14 14 LYS CB C 13 32.876 0.000 . 1 . . . . . 14 LYS CB . 51407 1 165 . 1 . 1 14 14 LYS CG C 13 24.754 0.000 . 1 . . . . . 14 LYS CG . 51407 1 166 . 1 . 1 14 14 LYS CD C 13 29.119 0.000 . 1 . . . . . 14 LYS CD . 51407 1 167 . 1 . 1 14 14 LYS CE C 13 42.083 0.000 . 1 . . . . . 14 LYS CE . 51407 1 168 . 1 . 1 15 15 GLU H H 1 8.369 0.001 . 1 . . . . . 15 GLU H . 51407 1 169 . 1 . 1 15 15 GLU HA H 1 4.210 0.002 . 1 . . . . . 15 GLU HA . 51407 1 170 . 1 . 1 15 15 GLU HB2 H 1 1.941 0.002 . 2 . . . . . 15 GLU HB2 . 51407 1 171 . 1 . 1 15 15 GLU HB3 H 1 2.027 0.002 . 2 . . . . . 15 GLU HB3 . 51407 1 172 . 1 . 1 15 15 GLU HG2 H 1 2.275 0.004 . 2 . . . . . 15 GLU HG2 . 51407 1 173 . 1 . 1 15 15 GLU HG3 H 1 2.275 0.004 . 2 . . . . . 15 GLU HG3 . 51407 1 174 . 1 . 1 15 15 GLU CA C 13 56.684 0.000 . 1 . . . . . 15 GLU CA . 51407 1 175 . 1 . 1 15 15 GLU CB C 13 30.249 0.004 . 1 . . . . . 15 GLU CB . 51407 1 176 . 1 . 1 15 15 GLU CG C 13 36.095 0.000 . 1 . . . . . 15 GLU CG . 51407 1 177 . 1 . 1 16 16 LYS H H 1 8.359 0.001 . 1 . . . . . 16 LYS H . 51407 1 178 . 1 . 1 16 16 LYS HA H 1 4.286 0.003 . 1 . . . . . 16 LYS HA . 51407 1 179 . 1 . 1 16 16 LYS HB2 H 1 1.760 0.002 . 2 . . . . . 16 LYS HB2 . 51407 1 180 . 1 . 1 16 16 LYS HB3 H 1 1.829 0.003 . 2 . . . . . 16 LYS HB3 . 51407 1 181 . 1 . 1 16 16 LYS HG2 H 1 1.379 0.000 . 2 . . . . . 16 LYS HG2 . 51407 1 182 . 1 . 1 16 16 LYS HG3 H 1 1.421 0.002 . 2 . . . . . 16 LYS HG3 . 51407 1 183 . 1 . 1 16 16 LYS HD2 H 1 1.656 0.001 . 2 . . . . . 16 LYS HD2 . 51407 1 184 . 1 . 1 16 16 LYS HD3 H 1 1.656 0.001 . 2 . . . . . 16 LYS HD3 . 51407 1 185 . 1 . 1 16 16 LYS HE2 H 1 2.975 0.003 . 2 . . . . . 16 LYS HE2 . 51407 1 186 . 1 . 1 16 16 LYS HE3 H 1 2.975 0.003 . 2 . . . . . 16 LYS HE3 . 51407 1 187 . 1 . 1 16 16 LYS HZ1 H 1 7.605 0.002 . 1 . . . . . 16 LYS HZ1 . 51407 1 188 . 1 . 1 16 16 LYS HZ2 H 1 7.605 0.002 . 1 . . . . . 16 LYS HZ2 . 51407 1 189 . 1 . 1 16 16 LYS HZ3 H 1 7.605 0.002 . 1 . . . . . 16 LYS HZ3 . 51407 1 190 . 1 . 1 16 16 LYS CA C 13 56.334 0.000 . 1 . . . . . 16 LYS CA . 51407 1 191 . 1 . 1 16 16 LYS CB C 13 32.882 0.006 . 1 . . . . . 16 LYS CB . 51407 1 192 . 1 . 1 16 16 LYS CG C 13 24.742 0.000 . 1 . . . . . 16 LYS CG . 51407 1 193 . 1 . 1 16 16 LYS CD C 13 29.119 0.000 . 1 . . . . . 16 LYS CD . 51407 1 194 . 1 . 1 16 16 LYS CE C 13 42.093 0.000 . 1 . . . . . 16 LYS CE . 51407 1 195 . 1 . 1 17 17 LEU H H 1 8.443 0.003 . 1 . . . . . 17 LEU H . 51407 1 196 . 1 . 1 17 17 LEU HA H 1 4.412 0.002 . 1 . . . . . 17 LEU HA . 51407 1 197 . 1 . 1 17 17 LEU HB2 H 1 1.585 0.003 . 2 . . . . . 17 LEU HB2 . 51407 1 198 . 1 . 1 17 17 LEU HB3 H 1 1.679 0.005 . 2 . . . . . 17 LEU HB3 . 51407 1 199 . 1 . 1 17 17 LEU HG H 1 1.641 0.000 . 1 . . . . . 17 LEU HG . 51407 1 200 . 1 . 1 17 17 LEU HD11 H 1 0.850 0.002 . 2 . . . . . 17 LEU QD1 . 51407 1 201 . 1 . 1 17 17 LEU HD12 H 1 0.850 0.002 . 2 . . . . . 17 LEU QD1 . 51407 1 202 . 1 . 1 17 17 LEU HD13 H 1 0.850 0.002 . 2 . . . . . 17 LEU QD1 . 51407 1 203 . 1 . 1 17 17 LEU HD21 H 1 0.908 0.004 . 2 . . . . . 17 LEU QD2 . 51407 1 204 . 1 . 1 17 17 LEU HD22 H 1 0.908 0.004 . 2 . . . . . 17 LEU QD2 . 51407 1 205 . 1 . 1 17 17 LEU HD23 H 1 0.908 0.004 . 2 . . . . . 17 LEU QD2 . 51407 1 206 . 1 . 1 17 17 LEU CA C 13 54.995 0.000 . 1 . . . . . 17 LEU CA . 51407 1 207 . 1 . 1 17 17 LEU CB C 13 42.644 0.009 . 1 . . . . . 17 LEU CB . 51407 1 208 . 1 . 1 17 17 LEU CG C 13 26.959 0.000 . 1 . . . . . 17 LEU CG . 51407 1 209 . 1 . 1 17 17 LEU CD1 C 13 23.182 0.000 . 1 . . . . . 17 LEU CD1 . 51407 1 210 . 1 . 1 17 17 LEU CD2 C 13 25.019 0.000 . 1 . . . . . 17 LEU CD2 . 51407 1 211 . 1 . 1 18 18 GLY H H 1 8.466 0.001 . 1 . . . . . 18 GLY H . 51407 1 212 . 1 . 1 18 18 GLY HA2 H 1 4.051 0.003 . 2 . . . . . 18 GLY HA2 . 51407 1 213 . 1 . 1 18 18 GLY HA3 H 1 4.151 0.003 . 2 . . . . . 18 GLY HA3 . 51407 1 214 . 1 . 1 18 18 GLY CA C 13 44.562 0.001 . 1 . . . . . 18 GLY CA . 51407 1 215 . 1 . 1 19 19 PRO HA H 1 4.398 0.002 . 1 . . . . . 19 PRO HA . 51407 1 216 . 1 . 1 19 19 PRO HB2 H 1 1.962 0.003 . 2 . . . . . 19 PRO HB2 . 51407 1 217 . 1 . 1 19 19 PRO HB3 H 1 2.294 0.003 . 2 . . . . . 19 PRO HB3 . 51407 1 218 . 1 . 1 19 19 PRO HG2 H 1 2.028 0.004 . 2 . . . . . 19 PRO HG2 . 51407 1 219 . 1 . 1 19 19 PRO HG3 H 1 2.028 0.004 . 2 . . . . . 19 PRO HG3 . 51407 1 220 . 1 . 1 19 19 PRO HD2 H 1 3.631 0.004 . 2 . . . . . 19 PRO HD2 . 51407 1 221 . 1 . 1 19 19 PRO HD3 H 1 3.631 0.004 . 2 . . . . . 19 PRO HD3 . 51407 1 222 . 1 . 1 19 19 PRO CA C 13 63.673 0.000 . 1 . . . . . 19 PRO CA . 51407 1 223 . 1 . 1 19 19 PRO CB C 13 32.128 0.005 . 1 . . . . . 19 PRO CB . 51407 1 224 . 1 . 1 19 19 PRO CG C 13 27.307 0.000 . 1 . . . . . 19 PRO CG . 51407 1 225 . 1 . 1 19 19 PRO CD C 13 49.769 0.000 . 1 . . . . . 19 PRO CD . 51407 1 226 . 1 . 1 20 20 GLN H H 1 8.751 0.001 . 1 . . . . . 20 GLN H . 51407 1 227 . 1 . 1 20 20 GLN HA H 1 4.364 0.004 . 1 . . . . . 20 GLN HA . 51407 1 228 . 1 . 1 20 20 GLN HB2 H 1 1.973 0.003 . 2 . . . . . 20 GLN HB2 . 51407 1 229 . 1 . 1 20 20 GLN HB3 H 1 2.165 0.002 . 2 . . . . . 20 GLN HB3 . 51407 1 230 . 1 . 1 20 20 GLN HG2 H 1 2.378 0.002 . 2 . . . . . 20 GLN HG2 . 51407 1 231 . 1 . 1 20 20 GLN HG3 H 1 2.378 0.002 . 2 . . . . . 20 GLN HG3 . 51407 1 232 . 1 . 1 20 20 GLN HE21 H 1 6.958 0.000 . 2 . . . . . 20 GLN HE21 . 51407 1 233 . 1 . 1 20 20 GLN HE22 H 1 7.603 0.001 . 2 . . . . . 20 GLN HE22 . 51407 1 234 . 1 . 1 20 20 GLN CA C 13 55.577 0.000 . 1 . . . . . 20 GLN CA . 51407 1 235 . 1 . 1 20 20 GLN CB C 13 29.483 0.003 . 1 . . . . . 20 GLN CB . 51407 1 236 . 1 . 1 20 20 GLN CG C 13 33.820 0.000 . 1 . . . . . 20 GLN CG . 51407 1 237 . 1 . 1 21 21 ASP H H 1 8.369 0.001 . 1 . . . . . 21 ASP H . 51407 1 238 . 1 . 1 21 21 ASP HA H 1 4.616 0.002 . 1 . . . . . 21 ASP HA . 51407 1 239 . 1 . 1 21 21 ASP HB2 H 1 2.651 0.002 . 2 . . . . . 21 ASP HB2 . 51407 1 240 . 1 . 1 21 21 ASP HB3 H 1 2.741 0.006 . 2 . . . . . 21 ASP HB3 . 51407 1 241 . 1 . 1 21 21 ASP CA C 13 54.626 0.000 . 1 . . . . . 21 ASP CA . 51407 1 242 . 1 . 1 21 21 ASP CB C 13 41.221 0.002 . 1 . . . . . 21 ASP CB . 51407 1 243 . 1 . 1 22 22 SER H H 1 8.246 0.002 . 1 . . . . . 22 SER H . 51407 1 244 . 1 . 1 22 22 SER HA H 1 4.413 0.003 . 1 . . . . . 22 SER HA . 51407 1 245 . 1 . 1 22 22 SER HB2 H 1 3.833 0.002 . 2 . . . . . 22 SER HB2 . 51407 1 246 . 1 . 1 22 22 SER HB3 H 1 3.833 0.002 . 2 . . . . . 22 SER HB3 . 51407 1 247 . 1 . 1 22 22 SER CA C 13 58.229 0.000 . 1 . . . . . 22 SER CA . 51407 1 248 . 1 . 1 22 22 SER CB C 13 63.930 0.000 . 1 . . . . . 22 SER CB . 51407 1 249 . 1 . 1 23 23 ASP H H 1 8.518 0.001 . 1 . . . . . 23 ASP H . 51407 1 250 . 1 . 1 23 23 ASP HA H 1 4.864 0.001 . 1 . . . . . 23 ASP HA . 51407 1 251 . 1 . 1 23 23 ASP HB2 H 1 2.574 0.005 . 2 . . . . . 23 ASP HB2 . 51407 1 252 . 1 . 1 23 23 ASP HB3 H 1 2.776 0.002 . 2 . . . . . 23 ASP HB3 . 51407 1 253 . 1 . 1 23 23 ASP CA C 13 52.377 0.000 . 1 . . . . . 23 ASP CA . 51407 1 254 . 1 . 1 23 23 ASP CB C 13 40.834 0.000 . 1 . . . . . 23 ASP CB . 51407 1 255 . 1 . 1 24 24 PRO HA H 1 4.497 0.003 . 1 . . . . . 24 PRO HA . 51407 1 256 . 1 . 1 24 24 PRO HB2 H 1 2.009 0.005 . 2 . . . . . 24 PRO HB2 . 51407 1 257 . 1 . 1 24 24 PRO HB3 H 1 2.292 0.002 . 2 . . . . . 24 PRO HB3 . 51407 1 258 . 1 . 1 24 24 PRO HD2 H 1 3.790 0.003 . 2 . . . . . 24 PRO HD2 . 51407 1 259 . 1 . 1 24 24 PRO HD3 H 1 3.867 0.004 . 2 . . . . . 24 PRO HD3 . 51407 1 260 . 1 . 1 24 24 PRO CA C 13 63.663 0.000 . 1 . . . . . 24 PRO CA . 51407 1 261 . 1 . 1 24 24 PRO CD C 13 50.816 0.002 . 1 . . . . . 24 PRO CD . 51407 1 262 . 1 . 1 25 25 THR H H 1 8.441 0.002 . 1 . . . . . 25 THR H . 51407 1 263 . 1 . 1 25 25 THR HA H 1 4.258 0.003 . 1 . . . . . 25 THR HA . 51407 1 264 . 1 . 1 25 25 THR HB H 1 4.248 0.005 . 1 . . . . . 25 THR HB . 51407 1 265 . 1 . 1 25 25 THR HG21 H 1 1.231 0.002 . 1 . . . . . 25 THR QG2 . 51407 1 266 . 1 . 1 25 25 THR HG22 H 1 1.231 0.002 . 1 . . . . . 25 THR QG2 . 51407 1 267 . 1 . 1 25 25 THR HG23 H 1 1.231 0.002 . 1 . . . . . 25 THR QG2 . 51407 1 268 . 1 . 1 25 25 THR CA C 13 62.677 0.000 . 1 . . . . . 25 THR CA . 51407 1 269 . 1 . 1 25 25 THR CB C 13 69.698 0.000 . 1 . . . . . 25 THR CB . 51407 1 270 . 1 . 1 25 25 THR CG2 C 13 21.691 0.000 . 1 . . . . . 25 THR CG2 . 51407 1 271 . 1 . 1 26 26 GLU H H 1 8.260 0.001 . 1 . . . . . 26 GLU H . 51407 1 272 . 1 . 1 26 26 GLU HA H 1 4.249 0.000 . 1 . . . . . 26 GLU HA . 51407 1 273 . 1 . 1 26 26 GLU HB2 H 1 1.956 0.005 . 2 . . . . . 26 GLU HB2 . 51407 1 274 . 1 . 1 26 26 GLU HB3 H 1 2.083 0.005 . 2 . . . . . 26 GLU HB3 . 51407 1 275 . 1 . 1 26 26 GLU HG2 H 1 2.298 0.003 . 2 . . . . . 26 GLU HG2 . 51407 1 276 . 1 . 1 26 26 GLU HG3 H 1 2.298 0.003 . 2 . . . . . 26 GLU HG3 . 51407 1 277 . 1 . 1 26 26 GLU CB C 13 29.864 0.001 . 1 . . . . . 26 GLU CB . 51407 1 278 . 1 . 1 26 26 GLU CG C 13 35.742 0.000 . 1 . . . . . 26 GLU CG . 51407 1 279 . 1 . 1 27 27 ALA H H 1 8.326 0.001 . 1 . . . . . 27 ALA H . 51407 1 280 . 1 . 1 27 27 ALA HA H 1 4.237 0.003 . 1 . . . . . 27 ALA HA . 51407 1 281 . 1 . 1 27 27 ALA HB1 H 1 1.358 0.002 . 1 . . . . . 27 ALA HB# . 51407 1 282 . 1 . 1 27 27 ALA HB2 H 1 1.358 0.002 . 1 . . . . . 27 ALA HB# . 51407 1 283 . 1 . 1 27 27 ALA HB3 H 1 1.358 0.002 . 1 . . . . . 27 ALA HB# . 51407 1 284 . 1 . 1 27 27 ALA CA C 13 52.845 0.000 . 1 . . . . . 27 ALA CA . 51407 1 285 . 1 . 1 27 27 ALA CB C 13 19.274 0.000 . 1 . . . . . 27 ALA CB . 51407 1 286 . 1 . 1 28 28 ASN H H 1 8.488 0.002 . 1 . . . . . 28 ASN H . 51407 1 287 . 1 . 1 28 28 ASN HA H 1 4.664 0.003 . 1 . . . . . 28 ASN HA . 51407 1 288 . 1 . 1 28 28 ASN HB2 H 1 2.751 0.003 . 2 . . . . . 28 ASN HB2 . 51407 1 289 . 1 . 1 28 28 ASN HB3 H 1 2.841 0.003 . 2 . . . . . 28 ASN HB3 . 51407 1 290 . 1 . 1 28 28 ASN HD21 H 1 7.020 0.000 . 2 . . . . . 28 ASN HD21 . 51407 1 291 . 1 . 1 28 28 ASN HD22 H 1 7.713 0.000 . 2 . . . . . 28 ASN HD22 . 51407 1 292 . 1 . 1 28 28 ASN CA C 13 53.288 0.000 . 1 . . . . . 28 ASN CA . 51407 1 293 . 1 . 1 28 28 ASN CB C 13 38.684 0.002 . 1 . . . . . 28 ASN CB . 51407 1 294 . 1 . 1 29 29 LEU H H 1 8.336 0.002 . 1 . . . . . 29 LEU H . 51407 1 295 . 1 . 1 29 29 LEU HA H 1 4.313 0.001 . 1 . . . . . 29 LEU HA . 51407 1 296 . 1 . 1 29 29 LEU HB2 H 1 1.587 0.005 . 2 . . . . . 29 LEU HB2 . 51407 1 297 . 1 . 1 29 29 LEU HB3 H 1 1.662 0.001 . 2 . . . . . 29 LEU HB3 . 51407 1 298 . 1 . 1 29 29 LEU HG H 1 1.637 0.003 . 1 . . . . . 29 LEU HG . 51407 1 299 . 1 . 1 29 29 LEU HD11 H 1 0.849 0.001 . 2 . . . . . 29 LEU QD1 . 51407 1 300 . 1 . 1 29 29 LEU HD12 H 1 0.849 0.001 . 2 . . . . . 29 LEU QD1 . 51407 1 301 . 1 . 1 29 29 LEU HD13 H 1 0.849 0.001 . 2 . . . . . 29 LEU QD1 . 51407 1 302 . 1 . 1 29 29 LEU HD21 H 1 0.914 0.005 . 2 . . . . . 29 LEU QD2 . 51407 1 303 . 1 . 1 29 29 LEU HD22 H 1 0.914 0.005 . 2 . . . . . 29 LEU QD2 . 51407 1 304 . 1 . 1 29 29 LEU HD23 H 1 0.914 0.005 . 2 . . . . . 29 LEU QD2 . 51407 1 305 . 1 . 1 29 29 LEU CA C 13 55.508 0.000 . 1 . . . . . 29 LEU CA . 51407 1 306 . 1 . 1 29 29 LEU CB C 13 42.218 0.003 . 1 . . . . . 29 LEU CB . 51407 1 307 . 1 . 1 29 29 LEU CG C 13 26.959 0.000 . 1 . . . . . 29 LEU CG . 51407 1 308 . 1 . 1 29 29 LEU CD1 C 13 23.182 0.000 . 1 . . . . . 29 LEU CD1 . 51407 1 309 . 1 . 1 29 29 LEU CD2 C 13 25.121 0.000 . 1 . . . . . 29 LEU CD2 . 51407 1 310 . 1 . 1 30 30 GLU H H 1 8.472 0.003 . 1 . . . . . 30 GLU H . 51407 1 311 . 1 . 1 30 30 GLU HA H 1 4.280 0.000 . 1 . . . . . 30 GLU HA . 51407 1 312 . 1 . 1 30 30 GLU HB2 H 1 1.961 0.001 . 2 . . . . . 30 GLU HB2 . 51407 1 313 . 1 . 1 30 30 GLU HB3 H 1 2.071 0.003 . 2 . . . . . 30 GLU HB3 . 51407 1 314 . 1 . 1 30 30 GLU HG2 H 1 2.308 0.001 . 2 . . . . . 30 GLU HG2 . 51407 1 315 . 1 . 1 30 30 GLU HG3 H 1 2.308 0.001 . 2 . . . . . 30 GLU HG3 . 51407 1 316 . 1 . 1 30 30 GLU CB C 13 29.895 0.002 . 1 . . . . . 30 GLU CB . 51407 1 317 . 1 . 1 30 30 GLU CG C 13 35.748 0.000 . 1 . . . . . 30 GLU CG . 51407 1 318 . 1 . 1 31 31 SER H H 1 8.332 0.001 . 1 . . . . . 31 SER H . 51407 1 319 . 1 . 1 31 31 SER HA H 1 4.405 0.001 . 1 . . . . . 31 SER HA . 51407 1 320 . 1 . 1 31 31 SER HB2 H 1 3.857 0.005 . 2 . . . . . 31 SER HB2 . 51407 1 321 . 1 . 1 31 31 SER HB3 H 1 3.857 0.005 . 2 . . . . . 31 SER HB3 . 51407 1 322 . 1 . 1 31 31 SER CA C 13 58.229 0.000 . 1 . . . . . 31 SER CA . 51407 1 323 . 1 . 1 31 31 SER CB C 13 63.871 0.000 . 1 . . . . . 31 SER CB . 51407 1 324 . 1 . 1 32 32 ALA H H 1 8.389 0.001 . 1 . . . . . 32 ALA H . 51407 1 325 . 1 . 1 32 32 ALA HA H 1 4.319 0.002 . 1 . . . . . 32 ALA HA . 51407 1 326 . 1 . 1 32 32 ALA HB1 H 1 1.365 0.002 . 1 . . . . . 32 ALA HB# . 51407 1 327 . 1 . 1 32 32 ALA HB2 H 1 1.365 0.002 . 1 . . . . . 32 ALA HB# . 51407 1 328 . 1 . 1 32 32 ALA HB3 H 1 1.365 0.002 . 1 . . . . . 32 ALA HB# . 51407 1 329 . 1 . 1 32 32 ALA CA C 13 52.228 0.000 . 1 . . . . . 32 ALA CA . 51407 1 330 . 1 . 1 32 32 ALA CB C 13 19.322 0.000 . 1 . . . . . 32 ALA CB . 51407 1 331 . 1 . 1 33 33 ASP H H 1 8.438 0.001 . 1 . . . . . 33 ASP H . 51407 1 332 . 1 . 1 33 33 ASP HA H 1 4.808 0.002 . 1 . . . . . 33 ASP HA . 51407 1 333 . 1 . 1 33 33 ASP HB2 H 1 2.542 0.003 . 2 . . . . . 33 ASP HB2 . 51407 1 334 . 1 . 1 33 33 ASP HB3 H 1 2.753 0.001 . 2 . . . . . 33 ASP HB3 . 51407 1 335 . 1 . 1 33 33 ASP CA C 13 52.151 0.000 . 1 . . . . . 33 ASP CA . 51407 1 336 . 1 . 1 33 33 ASP CB C 13 40.833 0.006 . 1 . . . . . 33 ASP CB . 51407 1 337 . 1 . 1 34 34 PRO HA H 1 4.393 0.003 . 1 . . . . . 34 PRO HA . 51407 1 338 . 1 . 1 34 34 PRO HD2 H 1 3.831 0.004 . 2 . . . . . 34 PRO HD2 . 51407 1 339 . 1 . 1 34 34 PRO HD3 H 1 3.856 0.002 . 2 . . . . . 34 PRO HD3 . 51407 1 340 . 1 . 1 34 34 PRO CA C 13 63.709 0.000 . 1 . . . . . 34 PRO CA . 51407 1 341 . 1 . 1 34 34 PRO CD C 13 50.849 0.000 . 1 . . . . . 34 PRO CD . 51407 1 342 . 1 . 1 35 35 GLU H H 1 8.536 0.002 . 1 . . . . . 35 GLU H . 51407 1 343 . 1 . 1 35 35 GLU HA H 1 4.214 0.001 . 1 . . . . . 35 GLU HA . 51407 1 344 . 1 . 1 35 35 GLU HB2 H 1 1.950 0.001 . 2 . . . . . 35 GLU HB2 . 51407 1 345 . 1 . 1 35 35 GLU HB3 H 1 2.108 0.002 . 2 . . . . . 35 GLU HB3 . 51407 1 346 . 1 . 1 35 35 GLU HG2 H 1 2.265 0.002 . 2 . . . . . 35 GLU HG2 . 51407 1 347 . 1 . 1 35 35 GLU HG3 H 1 2.327 0.000 . 2 . . . . . 35 GLU HG3 . 51407 1 348 . 1 . 1 35 35 GLU CB C 13 29.766 0.003 . 1 . . . . . 35 GLU CB . 51407 1 349 . 1 . 1 35 35 GLU CG C 13 35.747 0.009 . 1 . . . . . 35 GLU CG . 51407 1 350 . 1 . 1 36 36 NH2 HN1 H 1 7.196 0.004 . 2 . . . . . 36 NH2 HN1 . 51407 1 351 . 1 . 1 36 36 NH2 HN2 H 1 7.459 0.002 . 2 . . . . . 36 NH2 HN2 . 51407 1 stop_ save_