################################### # 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 34927 _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' . . . 34927 1 2 '2D 1H-1H TOCSY' . . . 34927 1 3 '2D 1H-1H NOESY' . . . 34927 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 GLU HA H 1 4.330550612 0.0004187172927 . 1 . . . . A 2 GLU HA . 34927 1 2 . 1 . 1 2 2 GLU HB2 H 1 2.009879245 0.003203846613 . 2 . . . . A 2 GLU HB2 . 34927 1 3 . 1 . 1 2 2 GLU HB3 H 1 2.221783473 0.005327001087 . 2 . . . . A 2 GLU HB3 . 34927 1 4 . 1 . 1 2 2 GLU HG2 H 1 2.362602212 0.003411675929 . 2 . . . . A 2 GLU HG2 . 34927 1 5 . 1 . 1 2 2 GLU HG3 H 1 2.380922733 0.01353611611 . 2 . . . . A 2 GLU HG3 . 34927 1 6 . 1 . 1 3 3 GLU H H 1 9.04040639 0.0002519791416 . 1 . . . . A 3 GLU H . 34927 1 7 . 1 . 1 3 3 GLU HA H 1 4.166659782 0.003382848441 . 1 . . . . A 3 GLU HA . 34927 1 8 . 1 . 1 3 3 GLU HB2 H 1 2.030373775 0.003598587382 . 2 . . . . A 3 GLU HB2 . 34927 1 9 . 1 . 1 3 3 GLU HB3 H 1 2.108451836 0.000678221977 . 2 . . . . A 3 GLU HB3 . 34927 1 10 . 1 . 1 3 3 GLU HG2 H 1 2.337319226 0.003418350901 . 2 . . . . A 3 GLU HG2 . 34927 1 11 . 1 . 1 3 3 GLU HG3 H 1 2.338203636 0.004827251353 . 2 . . . . A 3 GLU HG3 . 34927 1 12 . 1 . 1 4 4 ALA H H 1 8.66505653 0.001049462012 . 1 . . . . A 4 ALA H . 34927 1 13 . 1 . 1 4 4 ALA HA H 1 4.099087539 0.001989681668 . 1 . . . . A 4 ALA HA . 34927 1 14 . 1 . 1 4 4 ALA HB1 H 1 1.447391668 0.00278491333 . 1 . . . . A 4 ALA HB1 . 34927 1 15 . 1 . 1 4 4 ALA HB2 H 1 1.447391668 0.00278491333 . 1 . . . . A 4 ALA HB2 . 34927 1 16 . 1 . 1 4 4 ALA HB3 H 1 1.447391668 0.00278491333 . 1 . . . . A 4 ALA HB3 . 34927 1 17 . 1 . 1 5 5 VAL H H 1 7.445856772 0.0004831348157 . 1 . . . . A 5 VAL H . 34927 1 18 . 1 . 1 5 5 VAL HA H 1 3.8607752 0.0009904028627 . 1 . . . . A 5 VAL HA . 34927 1 19 . 1 . 1 5 5 VAL HB H 1 2.213347402 0.004042059964 . 1 . . . . A 5 VAL HB . 34927 1 20 . 1 . 1 5 5 VAL HG11 H 1 1.035701547 0.004831248445 . 2 . . . . A 5 VAL HG11 . 34927 1 21 . 1 . 1 5 5 VAL HG12 H 1 1.035701547 0.004831248445 . 2 . . . . A 5 VAL HG12 . 34927 1 22 . 1 . 1 5 5 VAL HG13 H 1 1.035701547 0.004831248445 . 2 . . . . A 5 VAL HG13 . 34927 1 23 . 1 . 1 5 5 VAL HG21 H 1 1.037071213 0.005738606143 . 2 . . . . A 5 VAL HG21 . 34927 1 24 . 1 . 1 5 5 VAL HG22 H 1 1.037071213 0.005738606143 . 2 . . . . A 5 VAL HG22 . 34927 1 25 . 1 . 1 5 5 VAL HG23 H 1 1.037071213 0.005738606143 . 2 . . . . A 5 VAL HG23 . 34927 1 26 . 1 . 1 6 6 ARG H H 1 7.980580129 0.00163308739 . 1 . . . . A 6 ARG H . 34927 1 27 . 1 . 1 6 6 ARG HA H 1 4.028145305 0.001055490018 . 1 . . . . A 6 ARG HA . 34927 1 28 . 1 . 1 6 6 ARG HB2 H 1 1.922732822 0.004183966074 . 2 . . . . A 6 ARG HB2 . 34927 1 29 . 1 . 1 6 6 ARG HB3 H 1 1.994339394 0.004640353694 . 2 . . . . A 6 ARG HB3 . 34927 1 30 . 1 . 1 6 6 ARG HG2 H 1 1.574458768 0.005332279499 . 2 . . . . A 6 ARG HG2 . 34927 1 31 . 1 . 1 6 6 ARG HG3 H 1 1.728875423 0.00215739361 . 2 . . . . A 6 ARG HG3 . 34927 1 32 . 1 . 1 6 6 ARG HD2 H 1 3.187333847 0.002287323531 . 2 . . . . A 6 ARG HD2 . 34927 1 33 . 1 . 1 6 6 ARG HD3 H 1 3.290629246 0.004344711262 . 2 . . . . A 6 ARG HD3 . 34927 1 34 . 1 . 1 6 6 ARG HE H 1 7.754717088 0 . 1 . . . . A 6 ARG HE . 34927 1 35 . 1 . 1 7 7 LEU H H 1 8.561375847 0.001894812042 . 1 . . . . A 7 LEU H . 34927 1 36 . 1 . 1 7 7 LEU HA H 1 4.130192593 0.00237772778 . 1 . . . . A 7 LEU HA . 34927 1 37 . 1 . 1 7 7 LEU HB2 H 1 1.386321313 0.00303109318 . 2 . . . . A 7 LEU HB2 . 34927 1 38 . 1 . 1 7 7 LEU HB3 H 1 1.921223589 0.001196173031 . 2 . . . . A 7 LEU HB3 . 34927 1 39 . 1 . 1 7 7 LEU HG H 1 1.81918546 0.002561783783 . 1 . . . . A 7 LEU HG . 34927 1 40 . 1 . 1 7 7 LEU HD11 H 1 0.8913933206 0.0009401192608 . 2 . . . . A 7 LEU HD11 . 34927 1 41 . 1 . 1 7 7 LEU HD12 H 1 0.8913933206 0.0009401192608 . 2 . . . . A 7 LEU HD12 . 34927 1 42 . 1 . 1 7 7 LEU HD13 H 1 0.8913933206 0.0009401192608 . 2 . . . . A 7 LEU HD13 . 34927 1 43 . 1 . 1 7 7 LEU HD21 H 1 0.9253361885 0.002121960128 . 2 . . . . A 7 LEU HD21 . 34927 1 44 . 1 . 1 7 7 LEU HD22 H 1 0.9253361885 0.002121960128 . 2 . . . . A 7 LEU HD22 . 34927 1 45 . 1 . 1 7 7 LEU HD23 H 1 0.9253361885 0.002121960128 . 2 . . . . A 7 LEU HD23 . 34927 1 46 . 1 . 1 8 8 TYR H H 1 8.176226212 0.0009616599793 . 1 . . . . A 8 TYR H . 34927 1 47 . 1 . 1 8 8 TYR HA H 1 4.137443893 0.00235100156 . 1 . . . . A 8 TYR HA . 34927 1 48 . 1 . 1 8 8 TYR HB2 H 1 3.178576111 0.001483477392 . 2 . . . . A 8 TYR HB2 . 34927 1 49 . 1 . 1 8 8 TYR HB3 H 1 3.267065546 0.002246171434 . 2 . . . . A 8 TYR HB3 . 34927 1 50 . 1 . 1 8 8 TYR HD1 H 1 7.023365201 0.002325244306 . 3 . . . . A 8 TYR HD1 . 34927 1 51 . 1 . 1 8 8 TYR HD2 H 1 7.023365201 0.002325244306 . 3 . . . . A 8 TYR HD2 . 34927 1 52 . 1 . 1 8 8 TYR HE1 H 1 6.817511581 0.001059409888 . 3 . . . . A 8 TYR HE1 . 34927 1 53 . 1 . 1 8 8 TYR HE2 H 1 6.817511581 0.001059409888 . 3 . . . . A 8 TYR HE2 . 34927 1 54 . 1 . 1 9 9 ILE H H 1 8.569396101 0.001271729567 . 1 . . . . A 9 ILE H . 34927 1 55 . 1 . 1 9 9 ILE HA H 1 3.704879315 0.002299593979 . 1 . . . . A 9 ILE HA . 34927 1 56 . 1 . 1 9 9 ILE HB H 1 2.048265014 0.003023440904 . 1 . . . . A 9 ILE HB . 34927 1 57 . 1 . 1 9 9 ILE HG12 H 1 1.380044138 0.001468525214 . 2 . . . . A 9 ILE HG12 . 34927 1 58 . 1 . 1 9 9 ILE HG13 H 1 1.901186208 0.002419018737 . 2 . . . . A 9 ILE HG13 . 34927 1 59 . 1 . 1 9 9 ILE HG21 H 1 0.9706700761 0.004020964035 . 1 . . . . A 9 ILE HG21 . 34927 1 60 . 1 . 1 9 9 ILE HG22 H 1 0.9706700761 0.004020964035 . 1 . . . . A 9 ILE HG22 . 34927 1 61 . 1 . 1 9 9 ILE HG23 H 1 0.9706700761 0.004020964035 . 1 . . . . A 9 ILE HG23 . 34927 1 62 . 1 . 1 9 9 ILE HD11 H 1 0.9362648489 0.00594333351 . 1 . . . . A 9 ILE HD11 . 34927 1 63 . 1 . 1 9 9 ILE HD12 H 1 0.9362648489 0.00594333351 . 1 . . . . A 9 ILE HD12 . 34927 1 64 . 1 . 1 9 9 ILE HD13 H 1 0.9362648489 0.00594333351 . 1 . . . . A 9 ILE HD13 . 34927 1 65 . 1 . 1 10 10 GLN H H 1 7.975395723 0.002923922567 . 1 . . . . A 10 GLN H . 34927 1 66 . 1 . 1 10 10 GLN HA H 1 4.028789389 0.001960986873 . 1 . . . . A 10 GLN HA . 34927 1 67 . 1 . 1 10 10 GLN HB2 H 1 2.124937468 0.004803175405 . 2 . . . . A 10 GLN HB2 . 34927 1 68 . 1 . 1 10 10 GLN HB3 H 1 2.211532906 0.002597261284 . 2 . . . . A 10 GLN HB3 . 34927 1 69 . 1 . 1 10 10 GLN HG2 H 1 2.355988801 0.001923140899 . 2 . . . . A 10 GLN HG2 . 34927 1 70 . 1 . 1 10 10 GLN HG3 H 1 2.41426734 0.002379309546 . 2 . . . . A 10 GLN HG3 . 34927 1 71 . 1 . 1 10 10 GLN HE21 H 1 6.921784806 0.0009061822798 . 2 . . . . A 10 GLN HE21 . 34927 1 72 . 1 . 1 10 10 GLN HE22 H 1 8.099897104 0.0005775409703 . 2 . . . . A 10 GLN HE22 . 34927 1 73 . 1 . 1 11 11 TRP H H 1 7.981425097 0.00244236814 . 1 . . . . A 11 TRP H . 34927 1 74 . 1 . 1 11 11 TRP HA H 1 4.195116008 0.00137707767 . 1 . . . . A 11 TRP HA . 34927 1 75 . 1 . 1 11 11 TRP HB2 H 1 3.146067539 0.004838737495 . 2 . . . . A 11 TRP HB2 . 34927 1 76 . 1 . 1 11 11 TRP HB3 H 1 3.57702951 0.001259683521 . 2 . . . . A 11 TRP HB3 . 34927 1 77 . 1 . 1 11 11 TRP HD1 H 1 7.005014157 0.002843496815 . 1 . . . . A 11 TRP HD1 . 34927 1 78 . 1 . 1 11 11 TRP HE1 H 1 9.649010115 0.000572897881 . 1 . . . . A 11 TRP HE1 . 34927 1 79 . 1 . 1 11 11 TRP HE3 H 1 7.073675124 0.001128337066 . 1 . . . . A 11 TRP HE3 . 34927 1 80 . 1 . 1 11 11 TRP HZ2 H 1 7.207157638 0.0006512339934 . 1 . . . . A 11 TRP HZ2 . 34927 1 81 . 1 . 1 11 11 TRP HZ3 H 1 7.10324891 0.002885181772 . 1 . . . . A 11 TRP HZ3 . 34927 1 82 . 1 . 1 11 11 TRP HH2 H 1 7.20722554 0.0008354323264 . 1 . . . . A 11 TRP HH2 . 34927 1 83 . 1 . 1 12 12 LEU H H 1 8.484589184 0.0006981744619 . 1 . . . . A 12 LEU H . 34927 1 84 . 1 . 1 12 12 LEU HA H 1 3.367440669 0.001161911738 . 1 . . . . A 12 LEU HA . 34927 1 85 . 1 . 1 12 12 LEU HB2 H 1 1.347783711 0.001054932861 . 2 . . . . A 12 LEU HB2 . 34927 1 86 . 1 . 1 12 12 LEU HB3 H 1 1.966007026 0.002046930299 . 2 . . . . A 12 LEU HB3 . 34927 1 87 . 1 . 1 12 12 LEU HG H 1 1.631400836 0.002797955251 . 1 . . . . A 12 LEU HG . 34927 1 88 . 1 . 1 12 12 LEU HD11 H 1 0.8291092206 0.001342920179 . 2 . . . . A 12 LEU HD11 . 34927 1 89 . 1 . 1 12 12 LEU HD12 H 1 0.8291092206 0.001342920179 . 2 . . . . A 12 LEU HD12 . 34927 1 90 . 1 . 1 12 12 LEU HD13 H 1 0.8291092206 0.001342920179 . 2 . . . . A 12 LEU HD13 . 34927 1 91 . 1 . 1 12 12 LEU HD21 H 1 0.9406564678 0.002102974313 . 2 . . . . A 12 LEU HD21 . 34927 1 92 . 1 . 1 12 12 LEU HD22 H 1 0.9406564678 0.002102974313 . 2 . . . . A 12 LEU HD22 . 34927 1 93 . 1 . 1 12 12 LEU HD23 H 1 0.9406564678 0.002102974313 . 2 . . . . A 12 LEU HD23 . 34927 1 94 . 1 . 1 13 13 LYS H H 1 8.358873239 0.0008329529431 . 1 . . . . A 13 LYS H . 34927 1 95 . 1 . 1 13 13 LYS HA H 1 3.960706073 0.002023866692 . 1 . . . . A 13 LYS HA . 34927 1 96 . 1 . 1 13 13 LYS HB2 H 1 1.981540575 0.002636991351 . 2 . . . . A 13 LYS HB2 . 34927 1 97 . 1 . 1 13 13 LYS HB3 H 1 1.981540575 0.002636991351 . 2 . . . . A 13 LYS HB3 . 34927 1 98 . 1 . 1 13 13 LYS HG2 H 1 1.429969245 0.001591588765 . 2 . . . . A 13 LYS HG2 . 34927 1 99 . 1 . 1 13 13 LYS HG3 H 1 1.579557138 0.004212465116 . 2 . . . . A 13 LYS HG3 . 34927 1 100 . 1 . 1 13 13 LYS HD2 H 1 1.665682672 0.00434227066 . 2 . . . . A 13 LYS HD2 . 34927 1 101 . 1 . 1 13 13 LYS HD3 H 1 1.666504773 0.004661388103 . 2 . . . . A 13 LYS HD3 . 34927 1 102 . 1 . 1 13 13 LYS HE2 H 1 2.948197142 0.001613292816 . 2 . . . . A 13 LYS HE2 . 34927 1 103 . 1 . 1 14 14 GLU H H 1 7.660559331 0.001140506925 . 1 . . . . A 14 GLU H . 34927 1 104 . 1 . 1 14 14 GLU HA H 1 4.161120578 0.002016441898 . 1 . . . . A 14 GLU HA . 34927 1 105 . 1 . 1 14 14 GLU HB2 H 1 1.988028324 0.003686677358 . 2 . . . . A 14 GLU HB2 . 34927 1 106 . 1 . 1 14 14 GLU HB3 H 1 2.223071194 0.001992977558 . 2 . . . . A 14 GLU HB3 . 34927 1 107 . 1 . 1 14 14 GLU HG2 H 1 2.264196726 0.0003959349852 . 2 . . . . A 14 GLU HG2 . 34927 1 108 . 1 . 1 14 14 GLU HG3 H 1 2.545013124 0.001192064559 . 2 . . . . A 14 GLU HG3 . 34927 1 109 . 1 . 1 15 15 GLY H H 1 7.553335848 0.001752591197 . 1 . . . . A 15 GLY H . 34927 1 110 . 1 . 1 15 15 GLY HA2 H 1 3.483162401 0.006059731751 . 2 . . . . A 15 GLY HA2 . 34927 1 111 . 1 . 1 15 15 GLY HA3 H 1 4.159608581 0.001694895191 . 2 . . . . A 15 GLY HA3 . 34927 1 112 . 1 . 1 16 16 GLY H H 1 8.264827746 0.001118866462 . 1 . . . . A 16 GLY H . 34927 1 113 . 1 . 1 16 16 GLY HA2 H 1 0.9765954665 0.0003874192017 . 2 . . . . A 16 GLY HA2 . 34927 1 114 . 1 . 1 16 16 GLY HA3 H 1 3.071008946 0.001822332966 . 2 . . . . A 16 GLY HA3 . 34927 1 115 . 1 . 1 17 17 PRO HA H 1 4.6017839 0.001416980514 . 1 . . . . A 17 PRO HA . 34927 1 116 . 1 . 1 17 17 PRO HB2 H 1 2.054594729 0.00296096516 . 2 . . . . A 17 PRO HB2 . 34927 1 117 . 1 . 1 17 17 PRO HB3 H 1 2.510482942 0.0009562522529 . 2 . . . . A 17 PRO HB3 . 34927 1 118 . 1 . 1 17 17 PRO HG2 H 1 2.14396067 0.0007019748556 . 2 . . . . A 17 PRO HG2 . 34927 1 119 . 1 . 1 17 17 PRO HG3 H 1 2.14418271 0.001472818484 . 2 . . . . A 17 PRO HG3 . 34927 1 120 . 1 . 1 17 17 PRO HD2 H 1 3.368325172 0.002932818745 . 2 . . . . A 17 PRO HD2 . 34927 1 121 . 1 . 1 17 17 PRO HD3 H 1 3.786346316 0.001208435295 . 2 . . . . A 17 PRO HD3 . 34927 1 122 . 1 . 1 18 18 SER H H 1 7.786075892 0.002505939121 . 1 . . . . A 18 SER H . 34927 1 123 . 1 . 1 18 18 SER HA H 1 4.457485455 0.0008584604441 . 1 . . . . A 18 SER HA . 34927 1 124 . 1 . 1 18 18 SER HB2 H 1 3.925396256 0.001955836052 . 2 . . . . A 18 SER HB2 . 34927 1 125 . 1 . 1 18 18 SER HB3 H 1 3.925396256 0.001955836052 . 2 . . . . A 18 SER HB3 . 34927 1 126 . 1 . 1 19 19 SER H H 1 8.182718862 0.002769869603 . 1 . . . . A 19 SER H . 34927 1 127 . 1 . 1 19 19 SER HA H 1 4.213026312 0.0007508177385 . 1 . . . . A 19 SER HA . 34927 1 128 . 1 . 1 19 19 SER HB2 H 1 3.569962084 0.005882061469 . 2 . . . . A 19 SER HB2 . 34927 1 129 . 1 . 1 19 19 SER HB3 H 1 3.918007645 0.003831574479 . 2 . . . . A 19 SER HB3 . 34927 1 130 . 1 . 1 20 20 GLY H H 1 7.9790426 0.001695263387 . 1 . . . . A 20 GLY H . 34927 1 131 . 1 . 1 20 20 GLY HA2 H 1 3.825465607 0.003679438225 . 2 . . . . A 20 GLY HA2 . 34927 1 132 . 1 . 1 20 20 GLY HA3 H 1 4.249667113 0.001592802422 . 2 . . . . A 20 GLY HA3 . 34927 1 133 . 1 . 1 21 21 ARG H H 1 8.097920153 0.002363509776 . 1 . . . . A 21 ARG H . 34927 1 134 . 1 . 1 21 21 ARG HA H 1 4.967278532 0.0008277995104 . 1 . . . . A 21 ARG HA . 34927 1 135 . 1 . 1 21 21 ARG HB2 H 1 1.868145497 0.001457702122 . 2 . . . . A 21 ARG HB2 . 34927 1 136 . 1 . 1 21 21 ARG HB3 H 1 1.868145497 0.001457702122 . 2 . . . . A 21 ARG HB3 . 34927 1 137 . 1 . 1 21 21 ARG HG2 H 1 1.659966179 0.003287752424 . 2 . . . . A 21 ARG HG2 . 34927 1 138 . 1 . 1 21 21 ARG HG3 H 1 1.77117274 0.001347691587 . 2 . . . . A 21 ARG HG3 . 34927 1 139 . 1 . 1 21 21 ARG HD2 H 1 3.265872339 0.0009411629164 . 2 . . . . A 21 ARG HD2 . 34927 1 140 . 1 . 1 21 21 ARG HD3 H 1 3.266168131 0.0007334757087 . 2 . . . . A 21 ARG HD3 . 34927 1 141 . 1 . 1 21 21 ARG HE H 1 7.665676039 0 . 1 . . . . A 21 ARG HE . 34927 1 142 . 1 . 1 22 22 PRO HA H 1 4.737551769 0.001508929917 . 1 . . . . A 22 PRO HA . 34927 1 143 . 1 . 1 22 22 PRO HB2 H 1 1.796456612 0.0009538447095 . 2 . . . . A 22 PRO HB2 . 34927 1 144 . 1 . 1 22 22 PRO HB3 H 1 2.32722976 0.002101719616 . 2 . . . . A 22 PRO HB3 . 34927 1 145 . 1 . 1 22 22 PRO HG2 H 1 1.994732852 0.002603884467 . 2 . . . . A 22 PRO HG2 . 34927 1 146 . 1 . 1 22 22 PRO HG3 H 1 1.994732852 0.002603884467 . 2 . . . . A 22 PRO HG3 . 34927 1 147 . 1 . 1 22 22 PRO HD2 H 1 3.666739205 0.002000043711 . 2 . . . . A 22 PRO HD2 . 34927 1 148 . 1 . 1 22 22 PRO HD3 H 1 3.863283309 0.0008846524771 . 2 . . . . A 22 PRO HD3 . 34927 1 149 . 1 . 1 23 23 PRO HA H 1 2.576411361 0.002502917992 . 1 . . . . A 23 PRO HA . 34927 1 150 . 1 . 1 23 23 PRO HB2 H 1 0.4796100872 0.002408962867 . 2 . . . . A 23 PRO HB2 . 34927 1 151 . 1 . 1 23 23 PRO HB3 H 1 1.387934405 0.002239401649 . 2 . . . . A 23 PRO HB3 . 34927 1 152 . 1 . 1 23 23 PRO HG2 H 1 1.655809292 0.001697810558 . 2 . . . . A 23 PRO HG2 . 34927 1 153 . 1 . 1 23 23 PRO HG3 H 1 1.739718552 0.003428900731 . 2 . . . . A 23 PRO HG3 . 34927 1 154 . 1 . 1 23 23 PRO HD2 H 1 3.506988313 0.003544455712 . 2 . . . . A 23 PRO HD2 . 34927 1 155 . 1 . 1 23 23 PRO HD3 H 1 3.509948286 0.003397812653 . 2 . . . . A 23 PRO HD3 . 34927 1 156 . 1 . 1 24 24 PRO HA H 1 4.291413987 0.00280938578 . 1 . . . . A 24 PRO HA . 34927 1 157 . 1 . 1 24 24 PRO HB2 H 1 2.01082506 0.00301509607 . 2 . . . . A 24 PRO HB2 . 34927 1 158 . 1 . 1 24 24 PRO HB3 H 1 2.224537936 0.00174058849 . 2 . . . . A 24 PRO HB3 . 34927 1 159 . 1 . 1 24 24 PRO HG2 H 1 1.81579182 0.003178238731 . 2 . . . . A 24 PRO HG2 . 34927 1 160 . 1 . 1 24 24 PRO HG3 H 1 1.931070144 0.004058386063 . 2 . . . . A 24 PRO HG3 . 34927 1 161 . 1 . 1 24 24 PRO HD2 H 1 2.969923723 0.003047227166 . 2 . . . . A 24 PRO HD2 . 34927 1 162 . 1 . 1 24 24 PRO HD3 H 1 3.086520012 0.003048587353 . 2 . . . . A 24 PRO HD3 . 34927 1 163 . 1 . 1 25 25 SER H H 1 7.753233038 0.001509029512 . 1 . . . . A 25 SER H . 34927 1 164 . 1 . 1 25 25 SER HA H 1 4.146935114 0.002188572561 . 1 . . . . A 25 SER HA . 34927 1 165 . 1 . 1 25 25 SER HB2 H 1 3.784220815 0.002572351665 . 2 . . . . A 25 SER HB2 . 34927 1 166 . 1 . 1 25 25 SER HB3 H 1 3.784220815 0.002572351665 . 2 . . . . A 25 SER HB3 . 34927 1 stop_ save_