################################### # 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 34935 _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-1H COSY' . . . 34935 1 2 '2D 1H-1H TOCSY' . . . 34935 1 3 '2D 1H-1H NOESY' . . . 34935 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 GLU HA H 1 4.035425611 0.0004448530919 . 1 . . . . A 1 GLU HA . 34935 1 2 . 1 . 1 1 1 GLU HB2 H 1 2.058420632 0.003193811914 . 2 . . . . A 1 GLU HB2 . 34935 1 3 . 1 . 1 1 1 GLU HB3 H 1 2.124231978 0.0001947486635 . 2 . . . . A 1 GLU HB3 . 34935 1 4 . 1 . 1 1 1 GLU HG2 H 1 2.36503496 0.001280415102 . 2 . . . . A 1 GLU HG2 . 34935 1 5 . 1 . 1 1 1 GLU HG3 H 1 2.36503496 0.001280415102 . 2 . . . . A 1 GLU HG3 . 34935 1 6 . 1 . 1 2 2 GLU HA H 1 4.339553309 0.002854995012 . 1 . . . . A 2 GLU HA . 34935 1 7 . 1 . 1 2 2 GLU HB2 H 1 2.18222636 0.0009007330055 . 2 . . . . A 2 GLU HB2 . 34935 1 8 . 1 . 1 2 2 GLU HB3 H 1 2.18222636 0.0009007330055 . 2 . . . . A 2 GLU HB3 . 34935 1 9 . 1 . 1 2 2 GLU HG2 H 1 2.309185485 0.001614854976 . 2 . . . . A 2 GLU HG2 . 34935 1 10 . 1 . 1 2 2 GLU HG3 H 1 2.355018976 0.001705841392 . 2 . . . . A 2 GLU HG3 . 34935 1 11 . 1 . 1 3 3 GLU H H 1 8.866427399 0.0008613791054 . 1 . . . . A 3 GLU H . 34935 1 12 . 1 . 1 3 3 GLU HA H 1 4.140556017 0.002924032074 . 1 . . . . A 3 GLU HA . 34935 1 13 . 1 . 1 3 3 GLU HB2 H 1 2.062206396 0.001237563091 . 2 . . . . A 3 GLU HB2 . 34935 1 14 . 1 . 1 3 3 GLU HB3 H 1 2.062206396 0.001237563091 . 2 . . . . A 3 GLU HB3 . 34935 1 15 . 1 . 1 3 3 GLU HG2 H 1 2.317392808 0.001829276443 . 2 . . . . A 3 GLU HG2 . 34935 1 16 . 1 . 1 3 3 GLU HG3 H 1 2.317392808 0.001829276443 . 2 . . . . A 3 GLU HG3 . 34935 1 17 . 1 . 1 4 4 ALA H H 1 8.493080877 0.0009914456514 . 1 . . . . A 4 ALA H . 34935 1 18 . 1 . 1 4 4 ALA HA H 1 4.116501956 0.001167775544 . 1 . . . . A 4 ALA HA . 34935 1 19 . 1 . 1 4 4 ALA HB1 H 1 1.447448545 0.001220029987 . 1 . . . . A 4 ALA HB1 . 34935 1 20 . 1 . 1 4 4 ALA HB2 H 1 1.447448545 0.001220029987 . 1 . . . . A 4 ALA HB2 . 34935 1 21 . 1 . 1 4 4 ALA HB3 H 1 1.447448545 0.001220029987 . 1 . . . . A 4 ALA HB3 . 34935 1 22 . 1 . 1 5 5 VAL H H 1 7.496170254 0.001153193582 . 1 . . . . A 5 VAL H . 34935 1 23 . 1 . 1 5 5 VAL HA H 1 3.897151768 0.002681957371 . 1 . . . . A 5 VAL HA . 34935 1 24 . 1 . 1 5 5 VAL HB H 1 2.198841846 0.00250026384 . 1 . . . . A 5 VAL HB . 34935 1 25 . 1 . 1 5 5 VAL HG11 H 1 1.020726608 0.003733948511 . 2 . . . . A 5 VAL HG11 . 34935 1 26 . 1 . 1 5 5 VAL HG12 H 1 1.020726608 0.003733948511 . 2 . . . . A 5 VAL HG12 . 34935 1 27 . 1 . 1 5 5 VAL HG13 H 1 1.020726608 0.003733948511 . 2 . . . . A 5 VAL HG13 . 34935 1 28 . 1 . 1 5 5 VAL HG21 H 1 1.039303542 0.002637543532 . 2 . . . . A 5 VAL HG21 . 34935 1 29 . 1 . 1 5 5 VAL HG22 H 1 1.039303542 0.002637543532 . 2 . . . . A 5 VAL HG22 . 34935 1 30 . 1 . 1 5 5 VAL HG23 H 1 1.039303542 0.002637543532 . 2 . . . . A 5 VAL HG23 . 34935 1 31 . 1 . 1 6 6 ARG H H 1 7.904042332 0.001722043139 . 1 . . . . A 6 ARG H . 34935 1 32 . 1 . 1 6 6 ARG HA H 1 4.066194621 0.002325827141 . 1 . . . . A 6 ARG HA . 34935 1 33 . 1 . 1 6 6 ARG HB2 H 1 1.933630894 0.005171306247 . 2 . . . . A 6 ARG HB2 . 34935 1 34 . 1 . 1 6 6 ARG HB3 H 1 1.935766407 0.003252461162 . 2 . . . . A 6 ARG HB3 . 34935 1 35 . 1 . 1 6 6 ARG HG2 H 1 1.602851662 0.001955239475 . 2 . . . . A 6 ARG HG2 . 34935 1 36 . 1 . 1 6 6 ARG HG3 H 1 1.732200853 0.003133631352 . 2 . . . . A 6 ARG HG3 . 34935 1 37 . 1 . 1 6 6 ARG HD2 H 1 3.227098785 0.01871193795 . 2 . . . . A 6 ARG HD2 . 34935 1 38 . 1 . 1 6 6 ARG HD3 H 1 3.244890707 0.01915231644 . 2 . . . . A 6 ARG HD3 . 34935 1 39 . 1 . 1 7 7 LEU H H 1 8.353807049 0.0008893515551 . 1 . . . . A 7 LEU H . 34935 1 40 . 1 . 1 7 7 LEU HA H 1 4.146330218 0.001352540912 . 1 . . . . A 7 LEU HA . 34935 1 41 . 1 . 1 7 7 LEU HB2 H 1 1.406665023 0.001360751678 . 2 . . . . A 7 LEU HB2 . 34935 1 42 . 1 . 1 7 7 LEU HB3 H 1 1.878009526 0.001586210012 . 2 . . . . A 7 LEU HB3 . 34935 1 43 . 1 . 1 7 7 LEU HG H 1 1.793083154 0.002511518159 . 1 . . . . A 7 LEU HG . 34935 1 44 . 1 . 1 7 7 LEU HD11 H 1 0.8876540951 0.001406188806 . 2 . . . . A 7 LEU HD11 . 34935 1 45 . 1 . 1 7 7 LEU HD12 H 1 0.8876540951 0.001406188806 . 2 . . . . A 7 LEU HD12 . 34935 1 46 . 1 . 1 7 7 LEU HD13 H 1 0.8876540951 0.001406188806 . 2 . . . . A 7 LEU HD13 . 34935 1 47 . 1 . 1 7 7 LEU HD21 H 1 0.9202149661 0.003032479292 . 2 . . . . A 7 LEU HD21 . 34935 1 48 . 1 . 1 7 7 LEU HD22 H 1 0.9202149661 0.003032479292 . 2 . . . . A 7 LEU HD22 . 34935 1 49 . 1 . 1 7 7 LEU HD23 H 1 0.9202149661 0.003032479292 . 2 . . . . A 7 LEU HD23 . 34935 1 50 . 1 . 1 8 8 TYR H H 1 8.142690896 0.001375188108 . 1 . . . . A 8 TYR H . 34935 1 51 . 1 . 1 8 8 TYR HA H 1 4.168219129 0.003235073194 . 1 . . . . A 8 TYR HA . 34935 1 52 . 1 . 1 8 8 TYR HB2 H 1 3.153384541 0.003992326585 . 2 . . . . A 8 TYR HB2 . 34935 1 53 . 1 . 1 8 8 TYR HB3 H 1 3.216533128 0.00196379274 . 2 . . . . A 8 TYR HB3 . 34935 1 54 . 1 . 1 8 8 TYR HD1 H 1 7.000921909 0.002109124561 . 3 . . . . A 8 TYR HD1 . 34935 1 55 . 1 . 1 8 8 TYR HD2 H 1 7.000921909 0.002109124561 . 3 . . . . A 8 TYR HD2 . 34935 1 56 . 1 . 1 8 8 TYR HE1 H 1 6.802159004 0.00095699027 . 3 . . . . A 8 TYR HE1 . 34935 1 57 . 1 . 1 8 8 TYR HE2 H 1 6.802159004 0.00095699027 . 3 . . . . A 8 TYR HE2 . 34935 1 58 . 1 . 1 9 9 ILE H H 1 8.386246897 0.0008514847017 . 1 . . . . A 9 ILE H . 34935 1 59 . 1 . 1 9 9 ILE HA H 1 3.73301644 0.003619230998 . 1 . . . . A 9 ILE HA . 34935 1 60 . 1 . 1 9 9 ILE HB H 1 2.017479481 0.004302312636 . 1 . . . . A 9 ILE HB . 34935 1 61 . 1 . 1 9 9 ILE HG12 H 1 1.370536767 0.004064106393 . 2 . . . . A 9 ILE HG12 . 34935 1 62 . 1 . 1 9 9 ILE HG13 H 1 1.812010205 0.003862758416 . 2 . . . . A 9 ILE HG13 . 34935 1 63 . 1 . 1 9 9 ILE HG21 H 1 0.9258292733 0.003224566673 . 1 . . . . A 9 ILE HG21 . 34935 1 64 . 1 . 1 9 9 ILE HG22 H 1 0.9258292733 0.003224566673 . 1 . . . . A 9 ILE HG22 . 34935 1 65 . 1 . 1 9 9 ILE HG23 H 1 0.9258292733 0.003224566673 . 1 . . . . A 9 ILE HG23 . 34935 1 66 . 1 . 1 9 9 ILE HD11 H 1 0.9059023342 0.005275638037 . 1 . . . . A 9 ILE HD11 . 34935 1 67 . 1 . 1 9 9 ILE HD12 H 1 0.9059023342 0.005275638037 . 1 . . . . A 9 ILE HD12 . 34935 1 68 . 1 . 1 9 9 ILE HD13 H 1 0.9059023342 0.005275638037 . 1 . . . . A 9 ILE HD13 . 34935 1 69 . 1 . 1 10 10 GLN H H 1 7.97365206 0.00155551797 . 1 . . . . A 10 GLN H . 34935 1 70 . 1 . 1 10 10 GLN HA H 1 3.926401183 0.0007720968974 . 1 . . . . A 10 GLN HA . 34935 1 71 . 1 . 1 10 10 GLN HB2 H 1 2.126799447 0.001418194268 . 2 . . . . A 10 GLN HB2 . 34935 1 72 . 1 . 1 10 10 GLN HB3 H 1 2.199312304 0.001608652493 . 2 . . . . A 10 GLN HB3 . 34935 1 73 . 1 . 1 10 10 GLN HG2 H 1 2.396044836 0.003192453628 . 2 . . . . A 10 GLN HG2 . 34935 1 74 . 1 . 1 10 10 GLN HG3 H 1 2.396044836 0.003192453628 . 2 . . . . A 10 GLN HG3 . 34935 1 75 . 1 . 1 10 10 GLN HE21 H 1 6.835101617 0.0007046437056 . 2 . . . . A 10 GLN HE21 . 34935 1 76 . 1 . 1 10 10 GLN HE22 H 1 7.698647232 0.0005704201003 . 2 . . . . A 10 GLN HE22 . 34935 1 77 . 1 . 1 11 11 TRP H H 1 7.979849718 0.001241334088 . 1 . . . . A 11 TRP H . 34935 1 78 . 1 . 1 11 11 TRP HA H 1 4.291366077 0.00207011807 . 1 . . . . A 11 TRP HA . 34935 1 79 . 1 . 1 11 11 TRP HB2 H 1 3.179965094 0.001740282689 . 2 . . . . A 11 TRP HB2 . 34935 1 80 . 1 . 1 11 11 TRP HB3 H 1 3.564431133 0.005461185411 . 2 . . . . A 11 TRP HB3 . 34935 1 81 . 1 . 1 11 11 TRP HD1 H 1 7.023404688 0.002876757229 . 1 . . . . A 11 TRP HD1 . 34935 1 82 . 1 . 1 11 11 TRP HE1 H 1 9.708621004 0.00111709666 . 1 . . . . A 11 TRP HE1 . 34935 1 83 . 1 . 1 11 11 TRP HE3 H 1 7.140249278 0.002132222029 . 1 . . . . A 11 TRP HE3 . 34935 1 84 . 1 . 1 11 11 TRP HZ2 H 1 7.221482636 0.001329259357 . 1 . . . . A 11 TRP HZ2 . 34935 1 85 . 1 . 1 11 11 TRP HZ3 H 1 7.112903369 0.001477799355 . 1 . . . . A 11 TRP HZ3 . 34935 1 86 . 1 . 1 11 11 TRP HH2 H 1 7.202825827 0.0009142285896 . 1 . . . . A 11 TRP HH2 . 34935 1 87 . 1 . 1 12 12 LEU H H 1 8.297351266 0.001753564844 . 1 . . . . A 12 LEU H . 34935 1 88 . 1 . 1 12 12 LEU HA H 1 3.471930925 0.001306715069 . 1 . . . . A 12 LEU HA . 34935 1 89 . 1 . 1 12 12 LEU HB2 H 1 1.359202894 0.0009896958299 . 2 . . . . A 12 LEU HB2 . 34935 1 90 . 1 . 1 12 12 LEU HB3 H 1 1.910561074 0.001274398922 . 2 . . . . A 12 LEU HB3 . 34935 1 91 . 1 . 1 12 12 LEU HG H 1 1.615950602 0.001845388989 . 1 . . . . A 12 LEU HG . 34935 1 92 . 1 . 1 12 12 LEU HD11 H 1 0.8244674209 0.001392394851 . 2 . . . . A 12 LEU HD11 . 34935 1 93 . 1 . 1 12 12 LEU HD12 H 1 0.8244674209 0.001392394851 . 2 . . . . A 12 LEU HD12 . 34935 1 94 . 1 . 1 12 12 LEU HD13 H 1 0.8244674209 0.001392394851 . 2 . . . . A 12 LEU HD13 . 34935 1 95 . 1 . 1 12 12 LEU HD21 H 1 0.9104586716 0.002186219566 . 2 . . . . A 12 LEU HD21 . 34935 1 96 . 1 . 1 12 12 LEU HD22 H 1 0.9104586716 0.002186219566 . 2 . . . . A 12 LEU HD22 . 34935 1 97 . 1 . 1 12 12 LEU HD23 H 1 0.9104586716 0.002186219566 . 2 . . . . A 12 LEU HD23 . 34935 1 98 . 1 . 1 13 13 LYS H H 1 8.307660228 0.0006085446016 . 1 . . . . A 13 LYS H . 34935 1 99 . 1 . 1 13 13 LYS HA H 1 3.937636043 0.001280297187 . 1 . . . . A 13 LYS HA . 34935 1 100 . 1 . 1 13 13 LYS HB2 H 1 1.903089715 0.00174524311 . 2 . . . . A 13 LYS HB2 . 34935 1 101 . 1 . 1 13 13 LYS HB3 H 1 1.903089715 0.00174524311 . 2 . . . . A 13 LYS HB3 . 34935 1 102 . 1 . 1 13 13 LYS HG2 H 1 1.432409845 0.005714724834 . 2 . . . . A 13 LYS HG2 . 34935 1 103 . 1 . 1 13 13 LYS HG3 H 1 1.560356486 0.0008783106581 . 2 . . . . A 13 LYS HG3 . 34935 1 104 . 1 . 1 13 13 LYS HD2 H 1 1.633244301 0.003806377805 . 2 . . . . A 13 LYS HD2 . 34935 1 105 . 1 . 1 13 13 LYS HD3 H 1 1.633244301 0.003806377805 . 2 . . . . A 13 LYS HD3 . 34935 1 106 . 1 . 1 13 13 LYS HE2 H 1 2.941360417 0.001625780523 . 2 . . . . A 13 LYS HE2 . 34935 1 107 . 1 . 1 13 13 LYS HE3 H 1 2.941360417 0.001625780523 . 2 . . . . A 13 LYS HE3 . 34935 1 108 . 1 . 1 14 14 ASP H H 1 7.922269935 0.001914779074 . 1 . . . . A 14 ASP H . 34935 1 109 . 1 . 1 14 14 ASP HA H 1 4.563479961 0.001981331043 . 1 . . . . A 14 ASP HA . 34935 1 110 . 1 . 1 14 14 ASP HB2 H 1 2.700081103 0.001348807705 . 2 . . . . A 14 ASP HB2 . 34935 1 111 . 1 . 1 14 14 ASP HB3 H 1 2.855141866 0.00152890654 . 2 . . . . A 14 ASP HB3 . 34935 1 112 . 1 . 1 15 15 GLY H H 1 7.571166871 0.001858071124 . 1 . . . . A 15 GLY H . 34935 1 113 . 1 . 1 15 15 GLY HA2 H 1 3.515500998 0.001524798101 . 2 . . . . A 15 GLY HA2 . 34935 1 114 . 1 . 1 15 15 GLY HA3 H 1 4.120366674 0.0005139197918 . 2 . . . . A 15 GLY HA3 . 34935 1 115 . 1 . 1 16 16 GLY H H 1 8.35362564 0.001113399385 . 1 . . . . A 16 GLY H . 34935 1 116 . 1 . 1 16 16 GLY HA2 H 1 1.230247165 0.006384539327 . 2 . . . . A 16 GLY HA2 . 34935 1 117 . 1 . 1 16 16 GLY HA3 H 1 3.17322729 0.001421148692 . 2 . . . . A 16 GLY HA3 . 34935 1 118 . 1 . 1 17 17 PRO HA H 1 4.575572307 0.002746747518 . 1 . . . . A 17 PRO HA . 34935 1 119 . 1 . 1 17 17 PRO HB2 H 1 2.039268303 0.002093338277 . 2 . . . . A 17 PRO HB2 . 34935 1 120 . 1 . 1 17 17 PRO HB3 H 1 2.4868373 0.0007225744567 . 2 . . . . A 17 PRO HB3 . 34935 1 121 . 1 . 1 17 17 PRO HG2 H 1 2.126302429 0.001742166293 . 2 . . . . A 17 PRO HG2 . 34935 1 122 . 1 . 1 17 17 PRO HG3 H 1 2.127406196 0.0008703712965 . 2 . . . . A 17 PRO HG3 . 34935 1 123 . 1 . 1 17 17 PRO HD2 H 1 3.390591968 0.003243097225 . 2 . . . . A 17 PRO HD2 . 34935 1 124 . 1 . 1 17 17 PRO HD3 H 1 3.763092565 0.002546403722 . 2 . . . . A 17 PRO HD3 . 34935 1 125 . 1 . 1 18 18 SER H H 1 7.738495609 0.0003679175097 . 1 . . . . A 18 SER H . 34935 1 126 . 1 . 1 18 18 SER HA H 1 4.46291141 0.0002266693406 . 1 . . . . A 18 SER HA . 34935 1 127 . 1 . 1 18 18 SER HB2 H 1 3.917631678 0.0005931354622 . 2 . . . . A 18 SER HB2 . 34935 1 128 . 1 . 1 18 18 SER HB3 H 1 3.917631678 0.0005931354622 . 2 . . . . A 18 SER HB3 . 34935 1 129 . 1 . 1 19 19 SER HA H 1 4.188092251 0.0008701154456 . 1 . . . . A 19 SER HA . 34935 1 130 . 1 . 1 19 19 SER HB2 H 1 3.555826902 0.002159359649 . 2 . . . . A 19 SER HB2 . 34935 1 131 . 1 . 1 19 19 SER HB3 H 1 3.862600334 0.001959384299 . 2 . . . . A 19 SER HB3 . 34935 1 132 . 1 . 1 20 20 GLY H H 1 7.919159046 0.0008054646099 . 1 . . . . A 20 GLY H . 34935 1 133 . 1 . 1 20 20 GLY HA2 H 1 3.818476436 0.0001428724765 . 2 . . . . A 20 GLY HA2 . 34935 1 134 . 1 . 1 20 20 GLY HA3 H 1 4.235142655 0.00292916261 . 2 . . . . A 20 GLY HA3 . 34935 1 135 . 1 . 1 21 21 ARG H H 1 8.084367157 0.002521500597 . 1 . . . . A 21 ARG H . 34935 1 136 . 1 . 1 21 21 ARG HA H 1 4.966839478 0.001455418783 . 1 . . . . A 21 ARG HA . 34935 1 137 . 1 . 1 21 21 ARG HB2 H 1 1.846110706 0.002346518711 . 2 . . . . A 21 ARG HB2 . 34935 1 138 . 1 . 1 21 21 ARG HB3 H 1 1.846110706 0.002346518711 . 2 . . . . A 21 ARG HB3 . 34935 1 139 . 1 . 1 21 21 ARG HG2 H 1 1.657284817 0.003450283207 . 2 . . . . A 21 ARG HG2 . 34935 1 140 . 1 . 1 21 21 ARG HG3 H 1 1.769397152 0.001834206155 . 2 . . . . A 21 ARG HG3 . 34935 1 141 . 1 . 1 21 21 ARG HD2 H 1 3.229145036 0.0004868292656 . 2 . . . . A 21 ARG HD2 . 34935 1 142 . 1 . 1 21 21 ARG HD3 H 1 3.288875146 0.0008293335731 . 2 . . . . A 21 ARG HD3 . 34935 1 143 . 1 . 1 22 22 PRO HA H 1 4.735333356 0.001276544462 . 1 . . . . A 22 PRO HA . 34935 1 144 . 1 . 1 22 22 PRO HB2 H 1 1.806505575 0.002798878282 . 2 . . . . A 22 PRO HB2 . 34935 1 145 . 1 . 1 22 22 PRO HB3 H 1 2.325471925 0.003312506502 . 2 . . . . A 22 PRO HB3 . 34935 1 146 . 1 . 1 22 22 PRO HG2 H 1 1.996913427 0.002478922335 . 2 . . . . A 22 PRO HG2 . 34935 1 147 . 1 . 1 22 22 PRO HG3 H 1 1.996952631 0.002610071055 . 2 . . . . A 22 PRO HG3 . 34935 1 148 . 1 . 1 22 22 PRO HD2 H 1 3.65080141 0.002281594068 . 2 . . . . A 22 PRO HD2 . 34935 1 149 . 1 . 1 22 22 PRO HD3 H 1 3.845540287 0.004551369681 . 2 . . . . A 22 PRO HD3 . 34935 1 150 . 1 . 1 23 23 PRO HA H 1 2.842068876 0.001858534522 . 1 . . . . A 23 PRO HA . 34935 1 151 . 1 . 1 23 23 PRO HB2 H 1 0.6462959232 0.004359294357 . 2 . . . . A 23 PRO HB2 . 34935 1 152 . 1 . 1 23 23 PRO HB3 H 1 1.425405098 0.002090323346 . 2 . . . . A 23 PRO HB3 . 34935 1 153 . 1 . 1 23 23 PRO HG2 H 1 1.659782892 0.002749642 . 2 . . . . A 23 PRO HG2 . 34935 1 154 . 1 . 1 23 23 PRO HG3 H 1 1.776049704 0.003187718519 . 2 . . . . A 23 PRO HG3 . 34935 1 155 . 1 . 1 23 23 PRO HD2 H 1 3.510009849 0.00689935761 . 2 . . . . A 23 PRO HD2 . 34935 1 156 . 1 . 1 23 23 PRO HD3 H 1 3.550315115 0.003753953888 . 2 . . . . A 23 PRO HD3 . 34935 1 157 . 1 . 1 24 24 PRO HA H 1 4.324488113 0.003717964533 . 1 . . . . A 24 PRO HA . 34935 1 158 . 1 . 1 24 24 PRO HB2 H 1 2.00092831 0.002869967896 . 2 . . . . A 24 PRO HB2 . 34935 1 159 . 1 . 1 24 24 PRO HB3 H 1 2.205011584 0.003604555139 . 2 . . . . A 24 PRO HB3 . 34935 1 160 . 1 . 1 24 24 PRO HG2 H 1 1.824021573 0.003624360981 . 2 . . . . A 24 PRO HG2 . 34935 1 161 . 1 . 1 24 24 PRO HG3 H 1 1.919683438 0.003688231534 . 2 . . . . A 24 PRO HG3 . 34935 1 162 . 1 . 1 24 24 PRO HD2 H 1 3.023668784 0.001856832737 . 2 . . . . A 24 PRO HD2 . 34935 1 163 . 1 . 1 24 24 PRO HD3 H 1 3.170418458 0.001261289743 . 2 . . . . A 24 PRO HD3 . 34935 1 164 . 1 . 1 25 25 SER H H 1 7.62749127 0.001142770328 . 1 . . . . A 25 SER H . 34935 1 165 . 1 . 1 25 25 SER HA H 1 4.158454049 0.001310874605 . 1 . . . . A 25 SER HA . 34935 1 166 . 1 . 1 25 25 SER HB2 H 1 3.778843022 0.0001054397574 . 2 . . . . A 25 SER HB2 . 34935 1 167 . 1 . 1 25 25 SER HB3 H 1 3.778843022 0.0001054397574 . 2 . . . . A 25 SER HB3 . 34935 1 stop_ save_