################################### # 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 30391 _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' . . . 30391 1 2 '3D HNCO' . . . 30391 1 3 '3D HNCA' . . . 30391 1 4 '3D HNCACB' . . . 30391 1 5 '3D CBCA(CO)NH' . . . 30391 1 6 '3D C(CO)NH' . . . 30391 1 7 '3D H(CCO)NH' . . . 30391 1 8 '3D HBHA(CO)NH' . . . 30391 1 9 '3D NOESY-HSQC' . . . 30391 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 GLY HA2 H 1 4.422 0.02 1.000 2 . . . . A 1 GLY HA2 . 30391 1 2 . 1 . 1 1 1 GLY HA3 H 1 4.422 0.02 1.000 2 . . . . A 1 GLY HA3 . 30391 1 3 . 1 . 1 2 2 SER H H 1 8.432 0.02 1.000 1 . . . . A 2 SER H . 30391 1 4 . 1 . 1 2 2 SER HA H 1 4.470 0.02 1.000 1 . . . . A 2 SER HA . 30391 1 5 . 1 . 1 2 2 SER HB2 H 1 3.796 0.02 1.000 2 . . . . A 2 SER HB2 . 30391 1 6 . 1 . 1 2 2 SER HB3 H 1 3.796 0.02 1.000 2 . . . . A 2 SER HB3 . 30391 1 7 . 1 . 1 2 2 SER C C 13 174.741 0.20 1.000 1 . . . . A 2 SER C . 30391 1 8 . 1 . 1 2 2 SER CA C 13 58.377 0.20 1.000 1 . . . . A 2 SER CA . 30391 1 9 . 1 . 1 2 2 SER CB C 13 63.888 0.20 1.000 1 . . . . A 2 SER CB . 30391 1 10 . 1 . 1 2 2 SER N N 15 114.551 0.20 1.000 1 . . . . A 2 SER N . 30391 1 11 . 1 . 1 3 3 VAL H H 1 8.340 0.02 1.000 1 . . . . A 3 VAL H . 30391 1 12 . 1 . 1 3 3 VAL HA H 1 4.058 0.02 1.000 1 . . . . A 3 VAL HA . 30391 1 13 . 1 . 1 3 3 VAL HB H 1 2.023 0.02 1.000 1 . . . . A 3 VAL HB . 30391 1 14 . 1 . 1 3 3 VAL HG11 H 1 0.864 0.02 0.796 2 . . . . A 3 VAL HG11 . 30391 1 15 . 1 . 1 3 3 VAL HG12 H 1 0.864 0.02 0.796 2 . . . . A 3 VAL HG12 . 30391 1 16 . 1 . 1 3 3 VAL HG13 H 1 0.864 0.02 0.796 2 . . . . A 3 VAL HG13 . 30391 1 17 . 1 . 1 3 3 VAL HG21 H 1 0.864 0.02 0.891 2 . . . . A 3 VAL HG21 . 30391 1 18 . 1 . 1 3 3 VAL HG22 H 1 0.864 0.02 0.891 2 . . . . A 3 VAL HG22 . 30391 1 19 . 1 . 1 3 3 VAL HG23 H 1 0.864 0.02 0.891 2 . . . . A 3 VAL HG23 . 30391 1 20 . 1 . 1 3 3 VAL C C 13 176.367 0.20 1.000 1 . . . . A 3 VAL C . 30391 1 21 . 1 . 1 3 3 VAL CA C 13 62.500 0.20 1.000 1 . . . . A 3 VAL CA . 30391 1 22 . 1 . 1 3 3 VAL CB C 13 32.639 0.20 1.000 1 . . . . A 3 VAL CB . 30391 1 23 . 1 . 1 3 3 VAL CG1 C 13 21.400 0.20 0.165 2 . . . . A 3 VAL CG1 . 30391 1 24 . 1 . 1 3 3 VAL CG2 C 13 21.400 0.20 0.108 2 . . . . A 3 VAL CG2 . 30391 1 25 . 1 . 1 3 3 VAL N N 15 121.814 0.20 1.000 1 . . . . A 3 VAL N . 30391 1 26 . 1 . 1 4 4 GLU H H 1 8.522 0.02 1.000 1 . . . . A 4 GLU H . 30391 1 27 . 1 . 1 4 4 GLU HA H 1 4.190 0.02 0.124 1 . . . . A 4 GLU HA . 30391 1 28 . 1 . 1 4 4 GLU HB2 H 1 1.895 0.02 0.492 2 . . . . A 4 GLU HB2 . 30391 1 29 . 1 . 1 4 4 GLU HB3 H 1 1.752 0.02 0.466 2 . . . . A 4 GLU HB3 . 30391 1 30 . 1 . 1 4 4 GLU HG2 H 1 2.184 0.02 0.511 2 . . . . A 4 GLU HG2 . 30391 1 31 . 1 . 1 4 4 GLU HG3 H 1 2.184 0.02 0.502 2 . . . . A 4 GLU HG3 . 30391 1 32 . 1 . 1 4 4 GLU C C 13 176.501 0.20 1.000 1 . . . . A 4 GLU C . 30391 1 33 . 1 . 1 4 4 GLU CA C 13 57.036 0.20 1.000 1 . . . . A 4 GLU CA . 30391 1 34 . 1 . 1 4 4 GLU CB C 13 30.402 0.20 1.000 1 . . . . A 4 GLU CB . 30391 1 35 . 1 . 1 4 4 GLU CG C 13 36.331 0.20 1.000 1 . . . . A 4 GLU CG . 30391 1 36 . 1 . 1 4 4 GLU N N 15 124.733 0.20 1.000 1 . . . . A 4 GLU N . 30391 1 37 . 1 . 1 5 5 LYS H H 1 8.316 0.02 1.000 1 . . . . A 5 LYS H . 30391 1 38 . 1 . 1 5 5 LYS HA H 1 4.208 0.02 1.000 1 . . . . A 5 LYS HA . 30391 1 39 . 1 . 1 5 5 LYS HB2 H 1 1.732 0.02 0.488 2 . . . . A 5 LYS HB2 . 30391 1 40 . 1 . 1 5 5 LYS HB3 H 1 1.732 0.02 0.449 2 . . . . A 5 LYS HB3 . 30391 1 41 . 1 . 1 5 5 LYS HG2 H 1 1.350 0.02 0.461 2 . . . . A 5 LYS HG2 . 30391 1 42 . 1 . 1 5 5 LYS HG3 H 1 1.350 0.02 0.484 2 . . . . A 5 LYS HG3 . 30391 1 43 . 1 . 1 5 5 LYS C C 13 176.505 0.20 1.000 1 . . . . A 5 LYS C . 30391 1 44 . 1 . 1 5 5 LYS CA C 13 56.400 0.20 1.000 1 . . . . A 5 LYS CA . 30391 1 45 . 1 . 1 5 5 LYS CB C 13 32.939 0.20 1.000 1 . . . . A 5 LYS CB . 30391 1 46 . 1 . 1 5 5 LYS CG C 13 24.695 0.20 1.000 1 . . . . A 5 LYS CG . 30391 1 47 . 1 . 1 5 5 LYS CD C 13 28.967 0.20 1.000 1 . . . . A 5 LYS CD . 30391 1 48 . 1 . 1 5 5 LYS N N 15 122.736 0.20 1.000 1 . . . . A 5 LYS N . 30391 1 49 . 1 . 1 6 6 LEU H H 1 8.344 0.02 1.000 1 . . . . A 6 LEU H . 30391 1 50 . 1 . 1 6 6 LEU HA H 1 4.332 0.02 1.000 1 . . . . A 6 LEU HA . 30391 1 51 . 1 . 1 6 6 LEU HB2 H 1 1.622 0.02 0.499 2 . . . . A 6 LEU HB2 . 30391 1 52 . 1 . 1 6 6 LEU HB3 H 1 1.546 0.02 0.505 2 . . . . A 6 LEU HB3 . 30391 1 53 . 1 . 1 6 6 LEU HG H 1 1.540 0.02 0.469 1 . . . . A 6 LEU HG . 30391 1 54 . 1 . 1 6 6 LEU HD11 H 1 0.817 0.02 0.852 2 . . . . A 6 LEU HD11 . 30391 1 55 . 1 . 1 6 6 LEU HD12 H 1 0.817 0.02 0.852 2 . . . . A 6 LEU HD12 . 30391 1 56 . 1 . 1 6 6 LEU HD13 H 1 0.817 0.02 0.852 2 . . . . A 6 LEU HD13 . 30391 1 57 . 1 . 1 6 6 LEU HD21 H 1 0.817 0.02 0.866 2 . . . . A 6 LEU HD21 . 30391 1 58 . 1 . 1 6 6 LEU HD22 H 1 0.817 0.02 0.866 2 . . . . A 6 LEU HD22 . 30391 1 59 . 1 . 1 6 6 LEU HD23 H 1 0.817 0.02 0.866 2 . . . . A 6 LEU HD23 . 30391 1 60 . 1 . 1 6 6 LEU C C 13 178.061 0.20 1.000 1 . . . . A 6 LEU C . 30391 1 61 . 1 . 1 6 6 LEU CA C 13 55.200 0.20 1.000 1 . . . . A 6 LEU CA . 30391 1 62 . 1 . 1 6 6 LEU CB C 13 42.353 0.20 1.000 1 . . . . A 6 LEU CB . 30391 1 63 . 1 . 1 6 6 LEU CG C 13 27.087 0.20 1.000 1 . . . . A 6 LEU CG . 30391 1 64 . 1 . 1 6 6 LEU CD1 C 13 24.880 0.20 1.000 2 . . . . A 6 LEU CD1 . 30391 1 65 . 1 . 1 6 6 LEU CD2 C 13 23.397 0.20 1.000 2 . . . . A 6 LEU CD2 . 30391 1 66 . 1 . 1 6 6 LEU N N 15 123.480 0.20 1.000 1 . . . . A 6 LEU N . 30391 1 67 . 1 . 1 7 7 THR H H 1 8.055 0.02 1.000 1 . . . . A 7 THR H . 30391 1 68 . 1 . 1 7 7 THR HA H 1 4.236 0.02 1.000 1 . . . . A 7 THR HA . 30391 1 69 . 1 . 1 7 7 THR HB H 1 4.236 0.02 1.000 1 . . . . A 7 THR HB . 30391 1 70 . 1 . 1 7 7 THR HG21 H 1 1.175 0.02 1.000 1 . . . . A 7 THR HG21 . 30391 1 71 . 1 . 1 7 7 THR HG22 H 1 1.175 0.02 1.000 1 . . . . A 7 THR HG22 . 30391 1 72 . 1 . 1 7 7 THR HG23 H 1 1.175 0.02 1.000 1 . . . . A 7 THR HG23 . 30391 1 73 . 1 . 1 7 7 THR C C 13 174.781 0.20 1.000 1 . . . . A 7 THR C . 30391 1 74 . 1 . 1 7 7 THR CA C 13 62.151 0.20 1.000 1 . . . . A 7 THR CA . 30391 1 75 . 1 . 1 7 7 THR CB C 13 69.999 0.20 1.000 1 . . . . A 7 THR CB . 30391 1 76 . 1 . 1 7 7 THR CG2 C 13 21.771 0.20 1.000 1 . . . . A 7 THR CG2 . 30391 1 77 . 1 . 1 7 7 THR N N 15 114.601 0.20 1.000 1 . . . . A 7 THR N . 30391 1 78 . 1 . 1 8 8 ALA H H 1 8.418 0.02 1.000 1 . . . . A 8 ALA H . 30391 1 79 . 1 . 1 8 8 ALA HA H 1 4.188 0.02 1.000 1 . . . . A 8 ALA HA . 30391 1 80 . 1 . 1 8 8 ALA HB1 H 1 1.369 0.02 1.000 1 . . . . A 8 ALA HB1 . 30391 1 81 . 1 . 1 8 8 ALA HB2 H 1 1.369 0.02 1.000 1 . . . . A 8 ALA HB2 . 30391 1 82 . 1 . 1 8 8 ALA HB3 H 1 1.369 0.02 1.000 1 . . . . A 8 ALA HB3 . 30391 1 83 . 1 . 1 8 8 ALA C C 13 178.726 0.20 1.000 1 . . . . A 8 ALA C . 30391 1 84 . 1 . 1 8 8 ALA CA C 13 53.659 0.20 1.000 1 . . . . A 8 ALA CA . 30391 1 85 . 1 . 1 8 8 ALA CB C 13 18.801 0.20 1.000 1 . . . . A 8 ALA CB . 30391 1 86 . 1 . 1 8 8 ALA N N 15 125.794 0.20 1.000 1 . . . . A 8 ALA N . 30391 1 87 . 1 . 1 9 9 ASP H H 1 8.377 0.02 1.000 1 . . . . A 9 ASP H . 30391 1 88 . 1 . 1 9 9 ASP HA H 1 4.406 0.02 1.000 1 . . . . A 9 ASP HA . 30391 1 89 . 1 . 1 9 9 ASP HB2 H 1 2.592 0.02 1.000 2 . . . . A 9 ASP HB2 . 30391 1 90 . 1 . 1 9 9 ASP HB3 H 1 2.592 0.02 0.759 2 . . . . A 9 ASP HB3 . 30391 1 91 . 1 . 1 9 9 ASP C C 13 177.455 0.20 1.000 1 . . . . A 9 ASP C . 30391 1 92 . 1 . 1 9 9 ASP CA C 13 55.228 0.20 1.000 1 . . . . A 9 ASP CA . 30391 1 93 . 1 . 1 9 9 ASP CB C 13 40.890 0.20 1.000 1 . . . . A 9 ASP CB . 30391 1 94 . 1 . 1 9 9 ASP N N 15 119.127 0.20 1.000 1 . . . . A 9 ASP N . 30391 1 95 . 1 . 1 10 10 ALA H H 1 8.149 0.02 1.000 1 . . . . A 10 ALA H . 30391 1 96 . 1 . 1 10 10 ALA HA H 1 4.103 0.02 0.848 1 . . . . A 10 ALA HA . 30391 1 97 . 1 . 1 10 10 ALA HB1 H 1 1.395 0.02 1.000 1 . . . . A 10 ALA HB1 . 30391 1 98 . 1 . 1 10 10 ALA HB2 H 1 1.395 0.02 1.000 1 . . . . A 10 ALA HB2 . 30391 1 99 . 1 . 1 10 10 ALA HB3 H 1 1.395 0.02 1.000 1 . . . . A 10 ALA HB3 . 30391 1 100 . 1 . 1 10 10 ALA C C 13 179.782 0.20 1.000 1 . . . . A 10 ALA C . 30391 1 101 . 1 . 1 10 10 ALA CA C 13 54.207 0.20 1.000 1 . . . . A 10 ALA CA . 30391 1 102 . 1 . 1 10 10 ALA CB C 13 18.733 0.20 1.000 1 . . . . A 10 ALA CB . 30391 1 103 . 1 . 1 10 10 ALA N N 15 123.795 0.20 1.000 1 . . . . A 10 ALA N . 30391 1 104 . 1 . 1 11 11 GLU H H 1 8.211 0.02 1.000 1 . . . . A 11 GLU H . 30391 1 105 . 1 . 1 11 11 GLU HA H 1 4.147 0.02 1.000 1 . . . . A 11 GLU HA . 30391 1 106 . 1 . 1 11 11 GLU HB2 H 1 1.991 0.02 0.466 2 . . . . A 11 GLU HB2 . 30391 1 107 . 1 . 1 11 11 GLU HB3 H 1 1.991 0.02 0.440 2 . . . . A 11 GLU HB3 . 30391 1 108 . 1 . 1 11 11 GLU HG2 H 1 2.210 0.02 0.562 2 . . . . A 11 GLU HG2 . 30391 1 109 . 1 . 1 11 11 GLU HG3 H 1 2.210 0.02 0.440 2 . . . . A 11 GLU HG3 . 30391 1 110 . 1 . 1 11 11 GLU C C 13 177.952 0.20 1.000 1 . . . . A 11 GLU C . 30391 1 111 . 1 . 1 11 11 GLU CA C 13 58.195 0.20 1.000 1 . . . . A 11 GLU CA . 30391 1 112 . 1 . 1 11 11 GLU CB C 13 29.524 0.20 1.000 1 . . . . A 11 GLU CB . 30391 1 113 . 1 . 1 11 11 GLU CG C 13 36.016 0.20 1.000 1 . . . . A 11 GLU CG . 30391 1 114 . 1 . 1 11 11 GLU N N 15 119.479 0.20 1.000 1 . . . . A 11 GLU N . 30391 1 115 . 1 . 1 12 12 LEU H H 1 7.929 0.02 1.000 1 . . . . A 12 LEU H . 30391 1 116 . 1 . 1 12 12 LEU HA H 1 4.097 0.02 1.000 1 . . . . A 12 LEU HA . 30391 1 117 . 1 . 1 12 12 LEU HB2 H 1 1.710 0.02 0.474 2 . . . . A 12 LEU HB2 . 30391 1 118 . 1 . 1 12 12 LEU HB3 H 1 1.568 0.02 0.499 2 . . . . A 12 LEU HB3 . 30391 1 119 . 1 . 1 12 12 LEU HG H 1 1.568 0.02 0.499 1 . . . . A 12 LEU HG . 30391 1 120 . 1 . 1 12 12 LEU HD11 H 1 0.852 0.02 0.864 2 . . . . A 12 LEU HD11 . 30391 1 121 . 1 . 1 12 12 LEU HD12 H 1 0.852 0.02 0.864 2 . . . . A 12 LEU HD12 . 30391 1 122 . 1 . 1 12 12 LEU HD13 H 1 0.852 0.02 0.864 2 . . . . A 12 LEU HD13 . 30391 1 123 . 1 . 1 12 12 LEU HD21 H 1 0.852 0.02 0.856 2 . . . . A 12 LEU HD21 . 30391 1 124 . 1 . 1 12 12 LEU HD22 H 1 0.852 0.02 0.856 2 . . . . A 12 LEU HD22 . 30391 1 125 . 1 . 1 12 12 LEU HD23 H 1 0.852 0.02 0.856 2 . . . . A 12 LEU HD23 . 30391 1 126 . 1 . 1 12 12 LEU C C 13 179.111 0.20 1.000 1 . . . . A 12 LEU C . 30391 1 127 . 1 . 1 12 12 LEU CA C 13 57.170 0.20 1.000 1 . . . . A 12 LEU CA . 30391 1 128 . 1 . 1 12 12 LEU CB C 13 41.774 0.20 1.000 1 . . . . A 12 LEU CB . 30391 1 129 . 1 . 1 12 12 LEU CG C 13 27.100 0.20 0.174 1 . . . . A 12 LEU CG . 30391 1 130 . 1 . 1 12 12 LEU CD1 C 13 26.964 0.20 0.486 2 . . . . A 12 LEU CD1 . 30391 1 131 . 1 . 1 12 12 LEU CD2 C 13 24.808 0.20 0.582 2 . . . . A 12 LEU CD2 . 30391 1 132 . 1 . 1 12 12 LEU N N 15 120.651 0.20 1.000 1 . . . . A 12 LEU N . 30391 1 133 . 1 . 1 13 13 GLN H H 1 8.047 0.02 1.000 1 . . . . A 13 GLN H . 30391 1 134 . 1 . 1 13 13 GLN HA H 1 4.008 0.02 0.752 1 . . . . A 13 GLN HA . 30391 1 135 . 1 . 1 13 13 GLN HB2 H 1 2.016 0.02 0.487 2 . . . . A 13 GLN HB2 . 30391 1 136 . 1 . 1 13 13 GLN HB3 H 1 2.016 0.02 0.465 2 . . . . A 13 GLN HB3 . 30391 1 137 . 1 . 1 13 13 GLN HG2 H 1 2.337 0.02 0.496 2 . . . . A 13 GLN HG2 . 30391 1 138 . 1 . 1 13 13 GLN HG3 H 1 2.337 0.02 0.497 2 . . . . A 13 GLN HG3 . 30391 1 139 . 1 . 1 13 13 GLN C C 13 177.286 0.20 1.000 1 . . . . A 13 GLN C . 30391 1 140 . 1 . 1 13 13 GLN CA C 13 57.570 0.20 1.000 1 . . . . A 13 GLN CA . 30391 1 141 . 1 . 1 13 13 GLN CB C 13 28.518 0.20 1.000 1 . . . . A 13 GLN CB . 30391 1 142 . 1 . 1 13 13 GLN CG C 13 33.753 0.20 1.000 1 . . . . A 13 GLN CG . 30391 1 143 . 1 . 1 13 13 GLN N N 15 118.460 0.20 1.000 1 . . . . A 13 GLN N . 30391 1 144 . 1 . 1 14 14 ARG H H 1 7.950 0.02 1.000 1 . . . . A 14 ARG H . 30391 1 145 . 1 . 1 14 14 ARG HA H 1 4.091 0.02 0.638 1 . . . . A 14 ARG HA . 30391 1 146 . 1 . 1 14 14 ARG HB2 H 1 1.830 0.02 0.435 2 . . . . A 14 ARG HB2 . 30391 1 147 . 1 . 1 14 14 ARG HB3 H 1 1.830 0.02 0.476 2 . . . . A 14 ARG HB3 . 30391 1 148 . 1 . 1 14 14 ARG HG2 H 1 1.500 0.02 0.496 2 . . . . A 14 ARG HG2 . 30391 1 149 . 1 . 1 14 14 ARG HG3 H 1 1.500 0.02 0.493 2 . . . . A 14 ARG HG3 . 30391 1 150 . 1 . 1 14 14 ARG C C 13 177.831 0.20 1.000 1 . . . . A 14 ARG C . 30391 1 151 . 1 . 1 14 14 ARG CA C 13 58.253 0.20 1.000 1 . . . . A 14 ARG CA . 30391 1 152 . 1 . 1 14 14 ARG CB C 13 30.310 0.20 1.000 1 . . . . A 14 ARG CB . 30391 1 153 . 1 . 1 14 14 ARG CG C 13 27.290 0.20 1.000 1 . . . . A 14 ARG CG . 30391 1 154 . 1 . 1 14 14 ARG CD C 13 43.359 0.20 1.000 1 . . . . A 14 ARG CD . 30391 1 155 . 1 . 1 14 14 ARG N N 15 120.567 0.20 1.000 1 . . . . A 14 ARG N . 30391 1 156 . 1 . 1 15 15 LEU H H 1 8.043 0.02 1.000 1 . . . . A 15 LEU H . 30391 1 157 . 1 . 1 15 15 LEU HA H 1 4.208 0.02 0.646 1 . . . . A 15 LEU HA . 30391 1 158 . 1 . 1 15 15 LEU HB2 H 1 1.689 0.02 0.525 2 . . . . A 15 LEU HB2 . 30391 1 159 . 1 . 1 15 15 LEU HB3 H 1 1.689 0.02 0.553 2 . . . . A 15 LEU HB3 . 30391 1 160 . 1 . 1 15 15 LEU HG H 1 1.510 0.02 0.384 1 . . . . A 15 LEU HG . 30391 1 161 . 1 . 1 15 15 LEU HD11 H 1 0.814 0.02 0.642 2 . . . . A 15 LEU HD11 . 30391 1 162 . 1 . 1 15 15 LEU HD12 H 1 0.814 0.02 0.642 2 . . . . A 15 LEU HD12 . 30391 1 163 . 1 . 1 15 15 LEU HD13 H 1 0.814 0.02 0.642 2 . . . . A 15 LEU HD13 . 30391 1 164 . 1 . 1 15 15 LEU HD21 H 1 0.814 0.02 0.710 2 . . . . A 15 LEU HD21 . 30391 1 165 . 1 . 1 15 15 LEU HD22 H 1 0.814 0.02 0.710 2 . . . . A 15 LEU HD22 . 30391 1 166 . 1 . 1 15 15 LEU HD23 H 1 0.814 0.02 0.710 2 . . . . A 15 LEU HD23 . 30391 1 167 . 1 . 1 15 15 LEU C C 13 178.580 0.20 1.000 1 . . . . A 15 LEU C . 30391 1 168 . 1 . 1 15 15 LEU CA C 13 56.712 0.20 1.000 1 . . . . A 15 LEU CA . 30391 1 169 . 1 . 1 15 15 LEU CB C 13 42.183 0.20 1.000 1 . . . . A 15 LEU CB . 30391 1 170 . 1 . 1 15 15 LEU CG C 13 27.340 0.20 0.104 1 . . . . A 15 LEU CG . 30391 1 171 . 1 . 1 15 15 LEU CD1 C 13 24.959 0.20 1.000 2 . . . . A 15 LEU CD1 . 30391 1 172 . 1 . 1 15 15 LEU CD2 C 13 23.424 0.20 1.000 2 . . . . A 15 LEU CD2 . 30391 1 173 . 1 . 1 15 15 LEU N N 15 120.555 0.20 1.000 1 . . . . A 15 LEU N . 30391 1 174 . 1 . 1 16 16 LYS H H 1 8.034 0.02 1.000 1 . . . . A 16 LYS H . 30391 1 175 . 1 . 1 16 16 LYS HA H 1 4.074 0.02 1.000 1 . . . . A 16 LYS HA . 30391 1 176 . 1 . 1 16 16 LYS HB2 H 1 1.778 0.02 0.462 2 . . . . A 16 LYS HB2 . 30391 1 177 . 1 . 1 16 16 LYS HB3 H 1 1.778 0.02 0.463 2 . . . . A 16 LYS HB3 . 30391 1 178 . 1 . 1 16 16 LYS HG2 H 1 1.352 0.02 0.458 2 . . . . A 16 LYS HG2 . 30391 1 179 . 1 . 1 16 16 LYS HG3 H 1 1.352 0.02 0.242 2 . . . . A 16 LYS HG3 . 30391 1 180 . 1 . 1 16 16 LYS C C 13 177.555 0.20 1.000 1 . . . . A 16 LYS C . 30391 1 181 . 1 . 1 16 16 LYS CA C 13 57.942 0.20 1.000 1 . . . . A 16 LYS CA . 30391 1 182 . 1 . 1 16 16 LYS CB C 13 32.723 0.20 1.000 1 . . . . A 16 LYS CB . 30391 1 183 . 1 . 1 16 16 LYS CG C 13 24.993 0.20 1.000 1 . . . . A 16 LYS CG . 30391 1 184 . 1 . 1 16 16 LYS CD C 13 29.322 0.20 1.000 1 . . . . A 16 LYS CD . 30391 1 185 . 1 . 1 16 16 LYS N N 15 120.119 0.20 1.000 1 . . . . A 16 LYS N . 30391 1 186 . 1 . 1 17 17 ASN H H 1 8.243 0.02 1.000 1 . . . . A 17 ASN H . 30391 1 187 . 1 . 1 17 17 ASN HA H 1 4.575 0.02 1.000 1 . . . . A 17 ASN HA . 30391 1 188 . 1 . 1 17 17 ASN HB2 H 1 2.791 0.02 0.510 2 . . . . A 17 ASN HB2 . 30391 1 189 . 1 . 1 17 17 ASN HB3 H 1 2.791 0.02 0.857 2 . . . . A 17 ASN HB3 . 30391 1 190 . 1 . 1 17 17 ASN CA C 13 53.909 0.20 1.000 1 . . . . A 17 ASN CA . 30391 1 191 . 1 . 1 17 17 ASN CB C 13 38.701 0.20 1.000 1 . . . . A 17 ASN CB . 30391 1 192 . 1 . 1 17 17 ASN N N 15 118.737 0.20 1.000 1 . . . . A 17 ASN N . 30391 1 193 . 1 . 1 18 18 GLU H H 1 8.296 0.02 1.000 1 . . . . A 18 GLU H . 30391 1 194 . 1 . 1 18 18 GLU HA H 1 4.144 0.02 1.000 1 . . . . A 18 GLU HA . 30391 1 195 . 1 . 1 18 18 GLU HB2 H 1 1.972 0.02 0.547 2 . . . . A 18 GLU HB2 . 30391 1 196 . 1 . 1 18 18 GLU HB3 H 1 1.972 0.02 0.478 2 . . . . A 18 GLU HB3 . 30391 1 197 . 1 . 1 18 18 GLU HG2 H 1 2.292 0.02 0.462 2 . . . . A 18 GLU HG2 . 30391 1 198 . 1 . 1 18 18 GLU HG3 H 1 2.160 0.02 0.387 2 . . . . A 18 GLU HG3 . 30391 1 199 . 1 . 1 18 18 GLU C C 13 177.041 0.20 1.000 1 . . . . A 18 GLU C . 30391 1 200 . 1 . 1 18 18 GLU CA C 13 57.707 0.20 1.000 1 . . . . A 18 GLU CA . 30391 1 201 . 1 . 1 18 18 GLU CB C 13 30.121 0.20 1.000 1 . . . . A 18 GLU CB . 30391 1 202 . 1 . 1 18 18 GLU CG C 13 36.434 0.20 1.000 1 . . . . A 18 GLU CG . 30391 1 203 . 1 . 1 18 18 GLU N N 15 121.111 0.20 1.000 1 . . . . A 18 GLU N . 30391 1 204 . 1 . 1 19 19 ARG H H 1 8.221 0.02 1.000 1 . . . . A 19 ARG H . 30391 1 205 . 1 . 1 19 19 ARG HA H 1 4.220 0.02 0.200 1 . . . . A 19 ARG HA . 30391 1 206 . 1 . 1 19 19 ARG HB2 H 1 1.780 0.02 0.362 2 . . . . A 19 ARG HB2 . 30391 1 207 . 1 . 1 19 19 ARG HB3 H 1 1.780 0.02 0.318 2 . . . . A 19 ARG HB3 . 30391 1 208 . 1 . 1 19 19 ARG HG2 H 1 1.340 0.02 0.317 2 . . . . A 19 ARG HG2 . 30391 1 209 . 1 . 1 19 19 ARG HG3 H 1 1.340 0.02 0.074 2 . . . . A 19 ARG HG3 . 30391 1 210 . 1 . 1 19 19 ARG HD2 H 1 3.120 0.02 0.542 2 . . . . A 19 ARG HD2 . 30391 1 211 . 1 . 1 19 19 ARG HD3 H 1 3.120 0.02 0.787 2 . . . . A 19 ARG HD3 . 30391 1 212 . 1 . 1 19 19 ARG C C 13 176.928 0.20 1.000 1 . . . . A 19 ARG C . 30391 1 213 . 1 . 1 19 19 ARG CA C 13 56.790 0.20 1.000 1 . . . . A 19 ARG CA . 30391 1 214 . 1 . 1 19 19 ARG CB C 13 29.942 0.20 1.000 1 . . . . A 19 ARG CB . 30391 1 215 . 1 . 1 19 19 ARG CG C 13 27.252 0.20 1.000 1 . . . . A 19 ARG CG . 30391 1 216 . 1 . 1 19 19 ARG N N 15 120.496 0.20 1.000 1 . . . . A 19 ARG N . 30391 1 217 . 1 . 1 20 20 HIS H H 1 8.359 0.02 1.000 1 . . . . A 20 HIS H . 30391 1 218 . 1 . 1 20 20 HIS HA H 1 4.516 0.02 1.000 1 . . . . A 20 HIS HA . 30391 1 219 . 1 . 1 20 20 HIS HB2 H 1 3.142 0.02 1.000 2 . . . . A 20 HIS HB2 . 30391 1 220 . 1 . 1 20 20 HIS HB3 H 1 3.142 0.02 1.000 2 . . . . A 20 HIS HB3 . 30391 1 221 . 1 . 1 20 20 HIS C C 13 175.818 0.20 1.000 1 . . . . A 20 HIS C . 30391 1 222 . 1 . 1 20 20 HIS CA C 13 57.107 0.20 1.000 1 . . . . A 20 HIS CA . 30391 1 223 . 1 . 1 20 20 HIS CB C 13 29.839 0.20 1.000 1 . . . . A 20 HIS CB . 30391 1 224 . 1 . 1 20 20 HIS N N 15 120.703 0.20 1.000 1 . . . . A 20 HIS N . 30391 1 225 . 1 . 1 21 21 GLU H H 1 8.579 0.02 1.000 1 . . . . A 21 GLU H . 30391 1 226 . 1 . 1 21 21 GLU HA H 1 4.107 0.02 1.000 1 . . . . A 21 GLU HA . 30391 1 227 . 1 . 1 21 21 GLU HB2 H 1 1.966 0.02 0.691 2 . . . . A 21 GLU HB2 . 30391 1 228 . 1 . 1 21 21 GLU HB3 H 1 1.966 0.02 0.368 2 . . . . A 21 GLU HB3 . 30391 1 229 . 1 . 1 21 21 GLU HG2 H 1 2.220 0.02 0.353 2 . . . . A 21 GLU HG2 . 30391 1 230 . 1 . 1 21 21 GLU HG3 H 1 2.220 0.02 0.099 2 . . . . A 21 GLU HG3 . 30391 1 231 . 1 . 1 21 21 GLU C C 13 177.665 0.20 1.000 1 . . . . A 21 GLU C . 30391 1 232 . 1 . 1 21 21 GLU CA C 13 57.927 0.20 1.000 1 . . . . A 21 GLU CA . 30391 1 233 . 1 . 1 21 21 GLU CB C 13 29.925 0.20 1.000 1 . . . . A 21 GLU CB . 30391 1 234 . 1 . 1 21 21 GLU CG C 13 36.390 0.20 1.000 1 . . . . A 21 GLU CG . 30391 1 235 . 1 . 1 21 21 GLU N N 15 121.487 0.20 1.000 1 . . . . A 21 GLU N . 30391 1 236 . 1 . 1 22 22 GLU H H 1 8.509 0.02 1.000 1 . . . . A 22 GLU H . 30391 1 237 . 1 . 1 22 22 GLU HA H 1 4.061 0.02 1.000 1 . . . . A 22 GLU HA . 30391 1 238 . 1 . 1 22 22 GLU HB2 H 1 1.999 0.02 0.612 2 . . . . A 22 GLU HB2 . 30391 1 239 . 1 . 1 22 22 GLU HB3 H 1 1.999 0.02 0.369 2 . . . . A 22 GLU HB3 . 30391 1 240 . 1 . 1 22 22 GLU HG2 H 1 2.240 0.02 0.103 2 . . . . A 22 GLU HG2 . 30391 1 241 . 1 . 1 22 22 GLU HG3 H 1 2.240 0.02 0.091 2 . . . . A 22 GLU HG3 . 30391 1 242 . 1 . 1 22 22 GLU C C 13 177.702 0.20 1.000 1 . . . . A 22 GLU C . 30391 1 243 . 1 . 1 22 22 GLU CA C 13 58.376 0.20 1.000 1 . . . . A 22 GLU CA . 30391 1 244 . 1 . 1 22 22 GLU CB C 13 29.829 0.20 1.000 1 . . . . A 22 GLU CB . 30391 1 245 . 1 . 1 22 22 GLU CG C 13 36.393 0.20 1.000 1 . . . . A 22 GLU CG . 30391 1 246 . 1 . 1 22 22 GLU N N 15 121.273 0.20 1.000 1 . . . . A 22 GLU N . 30391 1 247 . 1 . 1 23 23 ALA H H 1 8.241 0.02 1.000 1 . . . . A 23 ALA H . 30391 1 248 . 1 . 1 23 23 ALA HA H 1 4.144 0.02 1.000 1 . . . . A 23 ALA HA . 30391 1 249 . 1 . 1 23 23 ALA HB1 H 1 1.390 0.02 0.332 1 . . . . A 23 ALA HB1 . 30391 1 250 . 1 . 1 23 23 ALA HB2 H 1 1.390 0.02 0.332 1 . . . . A 23 ALA HB2 . 30391 1 251 . 1 . 1 23 23 ALA HB3 H 1 1.390 0.02 0.332 1 . . . . A 23 ALA HB3 . 30391 1 252 . 1 . 1 23 23 ALA C C 13 179.700 0.20 1.000 1 . . . . A 23 ALA C . 30391 1 253 . 1 . 1 23 23 ALA CA C 13 54.012 0.20 1.000 1 . . . . A 23 ALA CA . 30391 1 254 . 1 . 1 23 23 ALA CB C 13 18.778 0.20 1.000 1 . . . . A 23 ALA CB . 30391 1 255 . 1 . 1 23 23 ALA N N 15 123.309 0.20 1.000 1 . . . . A 23 ALA N . 30391 1 256 . 1 . 1 24 24 GLU H H 1 8.189 0.02 1.000 1 . . . . A 24 GLU H . 30391 1 257 . 1 . 1 24 24 GLU HA H 1 4.130 0.02 0.354 1 . . . . A 24 GLU HA . 30391 1 258 . 1 . 1 24 24 GLU HB2 H 1 1.974 0.02 0.493 2 . . . . A 24 GLU HB2 . 30391 1 259 . 1 . 1 24 24 GLU HB3 H 1 1.974 0.02 0.476 2 . . . . A 24 GLU HB3 . 30391 1 260 . 1 . 1 24 24 GLU HG2 H 1 2.145 0.02 0.500 2 . . . . A 24 GLU HG2 . 30391 1 261 . 1 . 1 24 24 GLU HG3 H 1 2.145 0.02 0.490 2 . . . . A 24 GLU HG3 . 30391 1 262 . 1 . 1 24 24 GLU C C 13 177.897 0.20 1.000 1 . . . . A 24 GLU C . 30391 1 263 . 1 . 1 24 24 GLU CA C 13 58.095 0.20 1.000 1 . . . . A 24 GLU CA . 30391 1 264 . 1 . 1 24 24 GLU CB C 13 29.761 0.20 1.000 1 . . . . A 24 GLU CB . 30391 1 265 . 1 . 1 24 24 GLU CG C 13 36.110 0.20 1.000 1 . . . . A 24 GLU CG . 30391 1 266 . 1 . 1 24 24 GLU N N 15 119.792 0.20 1.000 1 . . . . A 24 GLU N . 30391 1 267 . 1 . 1 25 25 LEU H H 1 7.992 0.02 1.000 1 . . . . A 25 LEU H . 30391 1 268 . 1 . 1 25 25 LEU HA H 1 4.056 0.02 1.000 1 . . . . A 25 LEU HA . 30391 1 269 . 1 . 1 25 25 LEU HB2 H 1 1.726 0.02 0.504 2 . . . . A 25 LEU HB2 . 30391 1 270 . 1 . 1 25 25 LEU HB3 H 1 1.726 0.02 0.471 2 . . . . A 25 LEU HB3 . 30391 1 271 . 1 . 1 25 25 LEU HG H 1 1.530 0.02 0.475 1 . . . . A 25 LEU HG . 30391 1 272 . 1 . 1 25 25 LEU HD11 H 1 0.834 0.02 0.861 2 . . . . A 25 LEU HD11 . 30391 1 273 . 1 . 1 25 25 LEU HD12 H 1 0.834 0.02 0.861 2 . . . . A 25 LEU HD12 . 30391 1 274 . 1 . 1 25 25 LEU HD13 H 1 0.834 0.02 0.861 2 . . . . A 25 LEU HD13 . 30391 1 275 . 1 . 1 25 25 LEU HD21 H 1 0.834 0.02 0.861 2 . . . . A 25 LEU HD21 . 30391 1 276 . 1 . 1 25 25 LEU HD22 H 1 0.834 0.02 0.861 2 . . . . A 25 LEU HD22 . 30391 1 277 . 1 . 1 25 25 LEU HD23 H 1 0.834 0.02 0.861 2 . . . . A 25 LEU HD23 . 30391 1 278 . 1 . 1 25 25 LEU C C 13 179.346 0.20 1.000 1 . . . . A 25 LEU C . 30391 1 279 . 1 . 1 25 25 LEU CA C 13 57.348 0.20 1.000 1 . . . . A 25 LEU CA . 30391 1 280 . 1 . 1 25 25 LEU CB C 13 41.747 0.20 1.000 1 . . . . A 25 LEU CB . 30391 1 281 . 1 . 1 25 25 LEU CG C 13 27.040 0.20 0.236 1 . . . . A 25 LEU CG . 30391 1 282 . 1 . 1 25 25 LEU CD1 C 13 24.866 0.20 0.619 2 . . . . A 25 LEU CD1 . 30391 1 283 . 1 . 1 25 25 LEU CD2 C 13 23.530 0.20 0.329 2 . . . . A 25 LEU CD2 . 30391 1 284 . 1 . 1 25 25 LEU N N 15 120.663 0.20 1.000 1 . . . . A 25 LEU N . 30391 1 285 . 1 . 1 26 26 GLU H H 1 8.086 0.02 1.000 1 . . . . A 26 GLU H . 30391 1 286 . 1 . 1 26 26 GLU HA H 1 4.012 0.02 1.000 1 . . . . A 26 GLU HA . 30391 1 287 . 1 . 1 26 26 GLU HB2 H 1 2.006 0.02 0.556 2 . . . . A 26 GLU HB2 . 30391 1 288 . 1 . 1 26 26 GLU HB3 H 1 2.006 0.02 0.424 2 . . . . A 26 GLU HB3 . 30391 1 289 . 1 . 1 26 26 GLU HG2 H 1 2.240 0.02 0.487 2 . . . . A 26 GLU HG2 . 30391 1 290 . 1 . 1 26 26 GLU HG3 H 1 2.240 0.02 0.111 2 . . . . A 26 GLU HG3 . 30391 1 291 . 1 . 1 26 26 GLU C C 13 178.417 0.20 1.000 1 . . . . A 26 GLU C . 30391 1 292 . 1 . 1 26 26 GLU CA C 13 58.462 0.20 1.000 1 . . . . A 26 GLU CA . 30391 1 293 . 1 . 1 26 26 GLU CB C 13 29.512 0.20 1.000 1 . . . . A 26 GLU CB . 30391 1 294 . 1 . 1 26 26 GLU CG C 13 36.125 0.20 1.000 1 . . . . A 26 GLU CG . 30391 1 295 . 1 . 1 26 26 GLU N N 15 119.410 0.20 1.000 1 . . . . A 26 GLU N . 30391 1 296 . 1 . 1 27 27 ARG H H 1 8.020 0.02 1.000 1 . . . . A 27 ARG H . 30391 1 297 . 1 . 1 27 27 ARG HA H 1 4.078 0.02 1.000 1 . . . . A 27 ARG HA . 30391 1 298 . 1 . 1 27 27 ARG HB2 H 1 1.840 0.02 0.472 2 . . . . A 27 ARG HB2 . 30391 1 299 . 1 . 1 27 27 ARG HB3 H 1 1.840 0.02 0.497 2 . . . . A 27 ARG HB3 . 30391 1 300 . 1 . 1 27 27 ARG HG2 H 1 1.547 0.02 0.190 2 . . . . A 27 ARG HG2 . 30391 1 301 . 1 . 1 27 27 ARG HG3 H 1 1.547 0.02 0.052 2 . . . . A 27 ARG HG3 . 30391 1 302 . 1 . 1 27 27 ARG C C 13 178.173 0.20 1.000 1 . . . . A 27 ARG C . 30391 1 303 . 1 . 1 27 27 ARG CA C 13 58.456 0.20 1.000 1 . . . . A 27 ARG CA . 30391 1 304 . 1 . 1 27 27 ARG CB C 13 30.179 0.20 1.000 1 . . . . A 27 ARG CB . 30391 1 305 . 1 . 1 27 27 ARG CG C 13 27.314 0.20 1.000 1 . . . . A 27 ARG CG . 30391 1 306 . 1 . 1 27 27 ARG CD C 13 43.266 0.20 1.000 1 . . . . A 27 ARG CD . 30391 1 307 . 1 . 1 27 27 ARG N N 15 121.156 0.20 1.000 1 . . . . A 27 ARG N . 30391 1 308 . 1 . 1 28 28 LEU H H 1 8.085 0.02 1.000 1 . . . . A 28 LEU H . 30391 1 309 . 1 . 1 28 28 LEU HA H 1 4.077 0.02 1.000 1 . . . . A 28 LEU HA . 30391 1 310 . 1 . 1 28 28 LEU HB2 H 1 1.708 0.02 0.530 2 . . . . A 28 LEU HB2 . 30391 1 311 . 1 . 1 28 28 LEU HB3 H 1 1.708 0.02 0.441 2 . . . . A 28 LEU HB3 . 30391 1 312 . 1 . 1 28 28 LEU HG H 1 1.502 0.02 0.506 1 . . . . A 28 LEU HG . 30391 1 313 . 1 . 1 28 28 LEU HD11 H 1 0.807 0.02 0.645 2 . . . . A 28 LEU HD11 . 30391 1 314 . 1 . 1 28 28 LEU HD12 H 1 0.807 0.02 0.645 2 . . . . A 28 LEU HD12 . 30391 1 315 . 1 . 1 28 28 LEU HD13 H 1 0.807 0.02 0.645 2 . . . . A 28 LEU HD13 . 30391 1 316 . 1 . 1 28 28 LEU HD21 H 1 0.807 0.02 0.696 2 . . . . A 28 LEU HD21 . 30391 1 317 . 1 . 1 28 28 LEU HD22 H 1 0.807 0.02 0.696 2 . . . . A 28 LEU HD22 . 30391 1 318 . 1 . 1 28 28 LEU HD23 H 1 0.807 0.02 0.696 2 . . . . A 28 LEU HD23 . 30391 1 319 . 1 . 1 28 28 LEU C C 13 178.922 0.20 1.000 1 . . . . A 28 LEU C . 30391 1 320 . 1 . 1 28 28 LEU CA C 13 56.700 0.20 1.000 1 . . . . A 28 LEU CA . 30391 1 321 . 1 . 1 28 28 LEU CB C 13 41.998 0.20 1.000 1 . . . . A 28 LEU CB . 30391 1 322 . 1 . 1 28 28 LEU CG C 13 26.929 0.20 1.000 1 . . . . A 28 LEU CG . 30391 1 323 . 1 . 1 28 28 LEU CD1 C 13 23.414 0.20 0.822 2 . . . . A 28 LEU CD1 . 30391 1 324 . 1 . 1 28 28 LEU CD2 C 13 25.100 0.20 0.175 2 . . . . A 28 LEU CD2 . 30391 1 325 . 1 . 1 28 28 LEU N N 15 120.296 0.20 1.000 1 . . . . A 28 LEU N . 30391 1 326 . 1 . 1 29 29 LYS H H 1 7.990 0.02 1.000 1 . . . . A 29 LYS H . 30391 1 327 . 1 . 1 29 29 LYS HA H 1 4.057 0.02 1.000 1 . . . . A 29 LYS HA . 30391 1 328 . 1 . 1 29 29 LYS HB2 H 1 1.812 0.02 0.511 2 . . . . A 29 LYS HB2 . 30391 1 329 . 1 . 1 29 29 LYS HB3 H 1 1.812 0.02 0.417 2 . . . . A 29 LYS HB3 . 30391 1 330 . 1 . 1 29 29 LYS HG2 H 1 1.325 0.02 0.502 2 . . . . A 29 LYS HG2 . 30391 1 331 . 1 . 1 29 29 LYS HG3 H 1 1.325 0.02 0.476 2 . . . . A 29 LYS HG3 . 30391 1 332 . 1 . 1 29 29 LYS HD2 H 1 1.477 0.02 0.227 2 . . . . A 29 LYS HD2 . 30391 1 333 . 1 . 1 29 29 LYS HD3 H 1 1.477 0.02 0.232 2 . . . . A 29 LYS HD3 . 30391 1 334 . 1 . 1 29 29 LYS C C 13 178.005 0.20 1.000 1 . . . . A 29 LYS C . 30391 1 335 . 1 . 1 29 29 LYS CA C 13 58.358 0.20 1.000 1 . . . . A 29 LYS CA . 30391 1 336 . 1 . 1 29 29 LYS CB C 13 32.651 0.20 1.000 1 . . . . A 29 LYS CB . 30391 1 337 . 1 . 1 29 29 LYS CG C 13 25.072 0.20 1.000 1 . . . . A 29 LYS CG . 30391 1 338 . 1 . 1 29 29 LYS CD C 13 29.507 0.20 1.000 1 . . . . A 29 LYS CD . 30391 1 339 . 1 . 1 29 29 LYS N N 15 120.049 0.20 1.000 1 . . . . A 29 LYS N . 30391 1 340 . 1 . 1 30 30 SER H H 1 8.076 0.02 1.000 1 . . . . A 30 SER H . 30391 1 341 . 1 . 1 30 30 SER HA H 1 4.282 0.02 1.000 1 . . . . A 30 SER HA . 30391 1 342 . 1 . 1 30 30 SER HB2 H 1 3.890 0.02 0.843 2 . . . . A 30 SER HB2 . 30391 1 343 . 1 . 1 30 30 SER HB3 H 1 3.890 0.02 0.534 2 . . . . A 30 SER HB3 . 30391 1 344 . 1 . 1 30 30 SER C C 13 175.435 0.20 1.000 1 . . . . A 30 SER C . 30391 1 345 . 1 . 1 30 30 SER CA C 13 59.810 0.20 1.000 1 . . . . A 30 SER CA . 30391 1 346 . 1 . 1 30 30 SER CB C 13 63.500 0.20 1.000 1 . . . . A 30 SER CB . 30391 1 347 . 1 . 1 30 30 SER N N 15 115.505 0.20 1.000 1 . . . . A 30 SER N . 30391 1 348 . 1 . 1 31 31 GLU H H 1 8.230 0.02 1.000 1 . . . . A 31 GLU H . 30391 1 349 . 1 . 1 31 31 GLU HA H 1 4.162 0.02 1.000 1 . . . . A 31 GLU HA . 30391 1 350 . 1 . 1 31 31 GLU HB2 H 1 1.930 0.02 0.511 2 . . . . A 31 GLU HB2 . 30391 1 351 . 1 . 1 31 31 GLU HB3 H 1 1.930 0.02 0.506 2 . . . . A 31 GLU HB3 . 30391 1 352 . 1 . 1 31 31 GLU HG2 H 1 2.211 0.02 0.524 2 . . . . A 31 GLU HG2 . 30391 1 353 . 1 . 1 31 31 GLU HG3 H 1 2.211 0.02 0.459 2 . . . . A 31 GLU HG3 . 30391 1 354 . 1 . 1 31 31 GLU C C 13 176.700 0.20 1.000 1 . . . . A 31 GLU C . 30391 1 355 . 1 . 1 31 31 GLU CA C 13 56.942 0.20 0.726 1 . . . . A 31 GLU CA . 30391 1 356 . 1 . 1 31 31 GLU CB C 13 30.085 0.20 0.898 1 . . . . A 31 GLU CB . 30391 1 357 . 1 . 1 31 31 GLU CG C 13 36.235 0.20 1.000 1 . . . . A 31 GLU CG . 30391 1 358 . 1 . 1 31 31 GLU N N 15 122.296 0.20 1.000 1 . . . . A 31 GLU N . 30391 1 359 . 1 . 1 32 32 ARG H H 1 8.267 0.02 1.000 1 . . . . A 32 ARG H . 30391 1 360 . 1 . 1 32 32 ARG HA H 1 4.140 0.02 1.000 1 . . . . A 32 ARG HA . 30391 1 361 . 1 . 1 32 32 ARG HB2 H 1 2.098 0.02 0.494 2 . . . . A 32 ARG HB2 . 30391 1 362 . 1 . 1 32 32 ARG HB3 H 1 1.830 0.02 0.492 2 . . . . A 32 ARG HB3 . 30391 1 363 . 1 . 1 32 32 ARG HG2 H 1 1.836 0.02 0.495 2 . . . . A 32 ARG HG2 . 30391 1 364 . 1 . 1 32 32 ARG HG3 H 1 1.836 0.02 0.494 2 . . . . A 32 ARG HG3 . 30391 1 365 . 1 . 1 32 32 ARG C C 13 176.150 0.20 1.000 1 . . . . A 32 ARG C . 30391 1 366 . 1 . 1 32 32 ARG CA C 13 56.807 0.20 1.000 1 . . . . A 32 ARG CA . 30391 1 367 . 1 . 1 32 32 ARG CB C 13 30.454 0.20 1.000 1 . . . . A 32 ARG CB . 30391 1 368 . 1 . 1 32 32 ARG N N 15 121.508 0.20 1.000 1 . . . . A 32 ARG N . 30391 1 369 . 1 . 1 33 33 HIS H H 1 8.436 0.02 1.000 1 . . . . A 33 HIS H . 30391 1 370 . 1 . 1 33 33 HIS HA H 1 4.613 0.02 1.000 1 . . . . A 33 HIS HA . 30391 1 371 . 1 . 1 33 33 HIS HB2 H 1 3.116 0.02 0.446 2 . . . . A 33 HIS HB2 . 30391 1 372 . 1 . 1 33 33 HIS HB3 H 1 3.116 0.02 0.404 2 . . . . A 33 HIS HB3 . 30391 1 373 . 1 . 1 33 33 HIS C C 13 174.621 0.20 1.000 1 . . . . A 33 HIS C . 30391 1 374 . 1 . 1 33 33 HIS CA C 13 55.300 0.20 1.000 1 . . . . A 33 HIS CA . 30391 1 375 . 1 . 1 33 33 HIS CB C 13 29.922 0.20 1.000 1 . . . . A 33 HIS CB . 30391 1 376 . 1 . 1 33 33 HIS N N 15 119.738 0.20 1.000 1 . . . . A 33 HIS N . 30391 1 377 . 1 . 1 34 34 ASP H H 1 8.272 0.02 1.000 1 . . . . A 34 ASP H . 30391 1 378 . 1 . 1 34 34 ASP HA H 1 4.160 0.02 0.325 1 . . . . A 34 ASP HA . 30391 1 379 . 1 . 1 34 34 ASP HB2 H 1 2.594 0.02 1.000 2 . . . . A 34 ASP HB2 . 30391 1 380 . 1 . 1 34 34 ASP HB3 H 1 2.594 0.02 0.772 2 . . . . A 34 ASP HB3 . 30391 1 381 . 1 . 1 34 34 ASP C C 13 176.966 0.20 1.000 1 . . . . A 34 ASP C . 30391 1 382 . 1 . 1 34 34 ASP CA C 13 56.900 0.20 1.000 1 . . . . A 34 ASP CA . 30391 1 383 . 1 . 1 34 34 ASP CB C 13 40.793 0.20 1.000 1 . . . . A 34 ASP CB . 30391 1 384 . 1 . 1 34 34 ASP N N 15 123.747 0.20 1.000 1 . . . . A 34 ASP N . 30391 1 385 . 1 . 1 35 35 HIS H H 1 8.320 0.02 1.000 1 . . . . A 35 HIS H . 30391 1 386 . 1 . 1 35 35 HIS HA H 1 4.365 0.02 1.000 1 . . . . A 35 HIS HA . 30391 1 387 . 1 . 1 35 35 HIS HB2 H 1 3.156 0.02 1.000 2 . . . . A 35 HIS HB2 . 30391 1 388 . 1 . 1 35 35 HIS HB3 H 1 3.156 0.02 1.000 2 . . . . A 35 HIS HB3 . 30391 1 389 . 1 . 1 35 35 HIS C C 13 176.135 0.20 1.000 1 . . . . A 35 HIS C . 30391 1 390 . 1 . 1 35 35 HIS CA C 13 57.992 0.20 1.000 1 . . . . A 35 HIS CA . 30391 1 391 . 1 . 1 35 35 HIS CB C 13 29.996 0.20 1.000 1 . . . . A 35 HIS CB . 30391 1 392 . 1 . 1 35 35 HIS N N 15 119.484 0.20 1.000 1 . . . . A 35 HIS N . 30391 1 393 . 1 . 1 36 36 ASP H H 1 8.427 0.02 1.000 1 . . . . A 36 ASP H . 30391 1 394 . 1 . 1 36 36 ASP HA H 1 4.399 0.02 0.767 1 . . . . A 36 ASP HA . 30391 1 395 . 1 . 1 36 36 ASP HB2 H 1 2.639 0.02 0.547 2 . . . . A 36 ASP HB2 . 30391 1 396 . 1 . 1 36 36 ASP HB3 H 1 2.639 0.02 0.078 2 . . . . A 36 ASP HB3 . 30391 1 397 . 1 . 1 36 36 ASP C C 13 177.633 0.20 1.000 1 . . . . A 36 ASP C . 30391 1 398 . 1 . 1 36 36 ASP CA C 13 55.722 0.20 1.000 1 . . . . A 36 ASP CA . 30391 1 399 . 1 . 1 36 36 ASP CB C 13 40.549 0.20 1.000 1 . . . . A 36 ASP CB . 30391 1 400 . 1 . 1 36 36 ASP N N 15 120.634 0.20 1.000 1 . . . . A 36 ASP N . 30391 1 401 . 1 . 1 37 37 LYS H H 1 8.193 0.02 1.000 1 . . . . A 37 LYS H . 30391 1 402 . 1 . 1 37 37 LYS HA H 1 4.098 0.02 1.000 1 . . . . A 37 LYS HA . 30391 1 403 . 1 . 1 37 37 LYS HB2 H 1 1.740 0.02 0.462 2 . . . . A 37 LYS HB2 . 30391 1 404 . 1 . 1 37 37 LYS HB3 H 1 1.740 0.02 0.054 2 . . . . A 37 LYS HB3 . 30391 1 405 . 1 . 1 37 37 LYS HG2 H 1 1.397 0.02 0.326 2 . . . . A 37 LYS HG2 . 30391 1 406 . 1 . 1 37 37 LYS HG3 H 1 1.397 0.02 0.100 2 . . . . A 37 LYS HG3 . 30391 1 407 . 1 . 1 37 37 LYS C C 13 177.831 0.20 1.000 1 . . . . A 37 LYS C . 30391 1 408 . 1 . 1 37 37 LYS CA C 13 58.092 0.20 1.000 1 . . . . A 37 LYS CA . 30391 1 409 . 1 . 1 37 37 LYS CB C 13 32.617 0.20 1.000 1 . . . . A 37 LYS CB . 30391 1 410 . 1 . 1 37 37 LYS CG C 13 24.880 0.20 1.000 1 . . . . A 37 LYS CG . 30391 1 411 . 1 . 1 37 37 LYS CD C 13 29.524 0.20 1.000 1 . . . . A 37 LYS CD . 30391 1 412 . 1 . 1 37 37 LYS CE C 13 41.076 0.20 1.000 1 . . . . A 37 LYS CE . 30391 1 413 . 1 . 1 37 37 LYS N N 15 122.340 0.20 1.000 1 . . . . A 37 LYS N . 30391 1 414 . 1 . 1 38 38 LYS H H 1 8.169 0.02 1.000 1 . . . . A 38 LYS H . 30391 1 415 . 1 . 1 38 38 LYS HA H 1 4.167 0.02 0.606 1 . . . . A 38 LYS HA . 30391 1 416 . 1 . 1 38 38 LYS HB2 H 1 1.750 0.02 0.483 2 . . . . A 38 LYS HB2 . 30391 1 417 . 1 . 1 38 38 LYS HB3 H 1 1.750 0.02 0.104 2 . . . . A 38 LYS HB3 . 30391 1 418 . 1 . 1 38 38 LYS HG2 H 1 1.360 0.02 0.346 2 . . . . A 38 LYS HG2 . 30391 1 419 . 1 . 1 38 38 LYS HG3 H 1 1.360 0.02 0.072 2 . . . . A 38 LYS HG3 . 30391 1 420 . 1 . 1 38 38 LYS HD2 H 1 1.781 0.02 0.493 2 . . . . A 38 LYS HD2 . 30391 1 421 . 1 . 1 38 38 LYS HD3 H 1 1.781 0.02 0.493 2 . . . . A 38 LYS HD3 . 30391 1 422 . 1 . 1 38 38 LYS HE2 H 1 2.791 0.02 0.750 2 . . . . A 38 LYS HE2 . 30391 1 423 . 1 . 1 38 38 LYS HE3 H 1 2.791 0.02 0.768 2 . . . . A 38 LYS HE3 . 30391 1 424 . 1 . 1 38 38 LYS C C 13 178.603 0.20 1.000 1 . . . . A 38 LYS C . 30391 1 425 . 1 . 1 38 38 LYS CA C 13 57.975 0.20 0.881 1 . . . . A 38 LYS CA . 30391 1 426 . 1 . 1 38 38 LYS CB C 13 32.800 0.20 0.074 1 . . . . A 38 LYS CB . 30391 1 427 . 1 . 1 38 38 LYS CG C 13 25.103 0.20 1.000 1 . . . . A 38 LYS CG . 30391 1 428 . 1 . 1 38 38 LYS CE C 13 41.250 0.20 1.000 1 . . . . A 38 LYS CE . 30391 1 429 . 1 . 1 38 38 LYS N N 15 120.826 0.20 1.000 1 . . . . A 38 LYS N . 30391 1 430 . 1 . 1 39 39 GLU H H 1 8.295 0.02 1.000 1 . . . . A 39 GLU H . 30391 1 431 . 1 . 1 39 39 GLU HA H 1 4.106 0.02 0.871 1 . . . . A 39 GLU HA . 30391 1 432 . 1 . 1 39 39 GLU HB2 H 1 1.924 0.02 0.619 2 . . . . A 39 GLU HB2 . 30391 1 433 . 1 . 1 39 39 GLU HB3 H 1 1.924 0.02 0.077 2 . . . . A 39 GLU HB3 . 30391 1 434 . 1 . 1 39 39 GLU HG2 H 1 2.137 0.02 0.082 2 . . . . A 39 GLU HG2 . 30391 1 435 . 1 . 1 39 39 GLU HG3 H 1 2.137 0.02 0.062 2 . . . . A 39 GLU HG3 . 30391 1 436 . 1 . 1 39 39 GLU C C 13 177.728 0.20 0.009 1 . . . . A 39 GLU C . 30391 1 437 . 1 . 1 39 39 GLU CA C 13 58.376 0.20 1.000 1 . . . . A 39 GLU CA . 30391 1 438 . 1 . 1 39 39 GLU CB C 13 30.100 0.20 0.105 1 . . . . A 39 GLU CB . 30391 1 439 . 1 . 1 39 39 GLU CG C 13 36.420 0.20 0.124 1 . . . . A 39 GLU CG . 30391 1 440 . 1 . 1 39 39 GLU N N 15 121.043 0.20 1.000 1 . . . . A 39 GLU N . 30391 1 441 . 1 . 1 40 40 ALA H H 1 8.135 0.02 0.009 1 . . . . A 40 ALA H . 30391 1 442 . 1 . 1 40 40 ALA HA H 1 4.123 0.02 1.000 1 . . . . A 40 ALA HA . 30391 1 443 . 1 . 1 40 40 ALA HB1 H 1 1.350 0.02 1.000 1 . . . . A 40 ALA HB1 . 30391 1 444 . 1 . 1 40 40 ALA HB2 H 1 1.350 0.02 1.000 1 . . . . A 40 ALA HB2 . 30391 1 445 . 1 . 1 40 40 ALA HB3 H 1 1.350 0.02 1.000 1 . . . . A 40 ALA HB3 . 30391 1 446 . 1 . 1 40 40 ALA C C 13 179.895 0.20 1.000 1 . . . . A 40 ALA C . 30391 1 447 . 1 . 1 40 40 ALA CA C 13 52.800 0.20 0.556 1 . . . . A 40 ALA CA . 30391 1 448 . 1 . 1 40 40 ALA CB C 13 18.387 0.20 1.000 1 . . . . A 40 ALA CB . 30391 1 449 . 1 . 1 40 40 ALA N N 15 123.012 0.20 0.009 1 . . . . A 40 ALA N . 30391 1 450 . 1 . 1 41 41 GLU H H 1 8.161 0.02 1.000 1 . . . . A 41 GLU H . 30391 1 451 . 1 . 1 41 41 GLU HA H 1 4.163 0.02 1.000 1 . . . . A 41 GLU HA . 30391 1 452 . 1 . 1 41 41 GLU HB2 H 1 1.924 0.02 0.499 2 . . . . A 41 GLU HB2 . 30391 1 453 . 1 . 1 41 41 GLU HB3 H 1 1.924 0.02 0.499 2 . . . . A 41 GLU HB3 . 30391 1 454 . 1 . 1 41 41 GLU HG2 H 1 2.210 0.02 0.498 2 . . . . A 41 GLU HG2 . 30391 1 455 . 1 . 1 41 41 GLU HG3 H 1 2.210 0.02 0.486 2 . . . . A 41 GLU HG3 . 30391 1 456 . 1 . 1 41 41 GLU C C 13 177.728 0.20 1.000 1 . . . . A 41 GLU C . 30391 1 457 . 1 . 1 41 41 GLU CA C 13 58.300 0.20 0.354 1 . . . . A 41 GLU CA . 30391 1 458 . 1 . 1 41 41 GLU CB C 13 30.200 0.20 1.000 1 . . . . A 41 GLU CB . 30391 1 459 . 1 . 1 41 41 GLU CG C 13 36.340 0.20 1.000 1 . . . . A 41 GLU CG . 30391 1 460 . 1 . 1 41 41 GLU N N 15 119.424 0.20 1.000 1 . . . . A 41 GLU N . 30391 1 461 . 1 . 1 42 42 ARG H H 1 8.135 0.02 1.000 1 . . . . A 42 ARG H . 30391 1 462 . 1 . 1 42 42 ARG HA H 1 4.100 0.02 1.000 1 . . . . A 42 ARG HA . 30391 1 463 . 1 . 1 42 42 ARG HB2 H 1 1.771 0.02 0.404 2 . . . . A 42 ARG HB2 . 30391 1 464 . 1 . 1 42 42 ARG HB3 H 1 1.771 0.02 0.129 2 . . . . A 42 ARG HB3 . 30391 1 465 . 1 . 1 42 42 ARG HG2 H 1 1.344 0.02 0.497 2 . . . . A 42 ARG HG2 . 30391 1 466 . 1 . 1 42 42 ARG HG3 H 1 1.344 0.02 0.479 2 . . . . A 42 ARG HG3 . 30391 1 467 . 1 . 1 42 42 ARG C C 13 177.830 0.20 1.000 1 . . . . A 42 ARG C . 30391 1 468 . 1 . 1 42 42 ARG CA C 13 58.300 0.20 0.154 1 . . . . A 42 ARG CA . 30391 1 469 . 1 . 1 42 42 ARG CB C 13 32.700 0.20 1.000 1 . . . . A 42 ARG CB . 30391 1 470 . 1 . 1 42 42 ARG CG C 13 25.030 0.20 1.000 1 . . . . A 42 ARG CG . 30391 1 471 . 1 . 1 42 42 ARG CD C 13 41.190 0.20 1.000 1 . . . . A 42 ARG CD . 30391 1 472 . 1 . 1 42 42 ARG N N 15 123.012 0.20 1.000 1 . . . . A 42 ARG N . 30391 1 473 . 1 . 1 43 43 LYS H H 1 8.233 0.02 1.000 1 . . . . A 43 LYS H . 30391 1 474 . 1 . 1 43 43 LYS HA H 1 4.044 0.02 1.000 1 . . . . A 43 LYS HA . 30391 1 475 . 1 . 1 43 43 LYS HB2 H 1 1.776 0.02 0.463 2 . . . . A 43 LYS HB2 . 30391 1 476 . 1 . 1 43 43 LYS HB3 H 1 1.776 0.02 0.460 2 . . . . A 43 LYS HB3 . 30391 1 477 . 1 . 1 43 43 LYS HG2 H 1 1.390 0.02 0.067 2 . . . . A 43 LYS HG2 . 30391 1 478 . 1 . 1 43 43 LYS HG3 H 1 1.390 0.02 0.484 2 . . . . A 43 LYS HG3 . 30391 1 479 . 1 . 1 43 43 LYS C C 13 177.439 0.20 1.000 1 . . . . A 43 LYS C . 30391 1 480 . 1 . 1 43 43 LYS CA C 13 57.900 0.20 1.000 1 . . . . A 43 LYS CA . 30391 1 481 . 1 . 1 43 43 LYS CB C 13 32.800 0.20 1.000 1 . . . . A 43 LYS CB . 30391 1 482 . 1 . 1 43 43 LYS CG C 13 25.240 0.20 1.000 1 . . . . A 43 LYS CG . 30391 1 483 . 1 . 1 43 43 LYS CD C 13 28.995 0.20 1.000 1 . . . . A 43 LYS CD . 30391 1 484 . 1 . 1 43 43 LYS N N 15 121.018 0.20 1.000 1 . . . . A 43 LYS N . 30391 1 485 . 1 . 1 44 44 ALA H H 1 8.002 0.02 1.000 1 . . . . A 44 ALA H . 30391 1 486 . 1 . 1 44 44 ALA HA H 1 4.167 0.02 1.000 1 . . . . A 44 ALA HA . 30391 1 487 . 1 . 1 44 44 ALA HB1 H 1 1.376 0.02 1.000 1 . . . . A 44 ALA HB1 . 30391 1 488 . 1 . 1 44 44 ALA HB2 H 1 1.376 0.02 1.000 1 . . . . A 44 ALA HB2 . 30391 1 489 . 1 . 1 44 44 ALA HB3 H 1 1.376 0.02 1.000 1 . . . . A 44 ALA HB3 . 30391 1 490 . 1 . 1 44 44 ALA C C 13 179.230 0.20 1.000 1 . . . . A 44 ALA C . 30391 1 491 . 1 . 1 44 44 ALA CA C 13 53.700 0.20 1.000 1 . . . . A 44 ALA CA . 30391 1 492 . 1 . 1 44 44 ALA CB C 13 18.600 0.20 1.000 1 . . . . A 44 ALA CB . 30391 1 493 . 1 . 1 44 44 ALA N N 15 122.281 0.20 1.000 1 . . . . A 44 ALA N . 30391 1 494 . 1 . 1 45 45 LEU H H 1 7.865 0.02 1.000 1 . . . . A 45 LEU H . 30391 1 495 . 1 . 1 45 45 LEU HA H 1 4.162 0.02 1.000 1 . . . . A 45 LEU HA . 30391 1 496 . 1 . 1 45 45 LEU HB2 H 1 1.645 0.02 0.633 2 . . . . A 45 LEU HB2 . 30391 1 497 . 1 . 1 45 45 LEU HB3 H 1 1.645 0.02 0.838 2 . . . . A 45 LEU HB3 . 30391 1 498 . 1 . 1 45 45 LEU HG H 1 1.640 0.02 0.702 1 . . . . A 45 LEU HG . 30391 1 499 . 1 . 1 45 45 LEU HD11 H 1 0.836 0.02 0.852 2 . . . . A 45 LEU HD11 . 30391 1 500 . 1 . 1 45 45 LEU HD12 H 1 0.836 0.02 0.852 2 . . . . A 45 LEU HD12 . 30391 1 501 . 1 . 1 45 45 LEU HD13 H 1 0.836 0.02 0.852 2 . . . . A 45 LEU HD13 . 30391 1 502 . 1 . 1 45 45 LEU HD21 H 1 0.836 0.02 0.851 2 . . . . A 45 LEU HD21 . 30391 1 503 . 1 . 1 45 45 LEU HD22 H 1 0.836 0.02 0.851 2 . . . . A 45 LEU HD22 . 30391 1 504 . 1 . 1 45 45 LEU HD23 H 1 0.836 0.02 0.851 2 . . . . A 45 LEU HD23 . 30391 1 505 . 1 . 1 45 45 LEU C C 13 178.423 0.20 1.000 1 . . . . A 45 LEU C . 30391 1 506 . 1 . 1 45 45 LEU CA C 13 56.400 0.20 1.000 1 . . . . A 45 LEU CA . 30391 1 507 . 1 . 1 45 45 LEU CB C 13 42.117 0.20 1.000 1 . . . . A 45 LEU CB . 30391 1 508 . 1 . 1 45 45 LEU CG C 13 27.070 0.20 1.000 1 . . . . A 45 LEU CG . 30391 1 509 . 1 . 1 45 45 LEU CD1 C 13 24.890 0.20 0.856 2 . . . . A 45 LEU CD1 . 30391 1 510 . 1 . 1 45 45 LEU CD2 C 13 23.700 0.20 0.141 2 . . . . A 45 LEU CD2 . 30391 1 511 . 1 . 1 45 45 LEU N N 15 119.757 0.20 1.000 1 . . . . A 45 LEU N . 30391 1 512 . 1 . 1 46 46 GLU H H 1 8.163 0.02 1.000 1 . . . . A 46 GLU H . 30391 1 513 . 1 . 1 46 46 GLU HA H 1 4.363 0.02 0.658 1 . . . . A 46 GLU HA . 30391 1 514 . 1 . 1 46 46 GLU HB2 H 1 1.987 0.02 0.512 2 . . . . A 46 GLU HB2 . 30391 1 515 . 1 . 1 46 46 GLU HB3 H 1 1.987 0.02 0.066 2 . . . . A 46 GLU HB3 . 30391 1 516 . 1 . 1 46 46 GLU HG2 H 1 2.303 0.02 0.469 2 . . . . A 46 GLU HG2 . 30391 1 517 . 1 . 1 46 46 GLU HG3 H 1 2.181 0.02 0.350 2 . . . . A 46 GLU HG3 . 30391 1 518 . 1 . 1 46 46 GLU C C 13 177.677 0.20 1.000 1 . . . . A 46 GLU C . 30391 1 519 . 1 . 1 46 46 GLU CA C 13 57.900 0.20 1.000 1 . . . . A 46 GLU CA . 30391 1 520 . 1 . 1 46 46 GLU CB C 13 30.000 0.20 1.000 1 . . . . A 46 GLU CB . 30391 1 521 . 1 . 1 46 46 GLU CG C 13 36.480 0.20 1.000 1 . . . . A 46 GLU CG . 30391 1 522 . 1 . 1 46 46 GLU N N 15 120.219 0.20 1.000 1 . . . . A 46 GLU N . 30391 1 523 . 1 . 1 47 47 ASP H H 1 8.321 0.02 1.000 1 . . . . A 47 ASP H . 30391 1 524 . 1 . 1 47 47 ASP HA H 1 4.401 0.02 1.000 1 . . . . A 47 ASP HA . 30391 1 525 . 1 . 1 47 47 ASP HB2 H 1 2.616 0.02 1.000 2 . . . . A 47 ASP HB2 . 30391 1 526 . 1 . 1 47 47 ASP HB3 H 1 2.616 0.02 0.549 2 . . . . A 47 ASP HB3 . 30391 1 527 . 1 . 1 47 47 ASP C C 13 177.169 0.20 1.000 1 . . . . A 47 ASP C . 30391 1 528 . 1 . 1 47 47 ASP CA C 13 55.964 0.20 1.000 1 . . . . A 47 ASP CA . 30391 1 529 . 1 . 1 47 47 ASP CB C 13 40.600 0.20 1.000 1 . . . . A 47 ASP CB . 30391 1 530 . 1 . 1 47 47 ASP N N 15 120.705 0.20 1.000 1 . . . . A 47 ASP N . 30391 1 531 . 1 . 1 48 48 LYS H H 1 7.999 0.02 1.000 1 . . . . A 48 LYS H . 30391 1 532 . 1 . 1 48 48 LYS HA H 1 4.185 0.02 0.608 1 . . . . A 48 LYS HA . 30391 1 533 . 1 . 1 48 48 LYS HB2 H 1 1.808 0.02 0.456 2 . . . . A 48 LYS HB2 . 30391 1 534 . 1 . 1 48 48 LYS HB3 H 1 1.808 0.02 0.070 2 . . . . A 48 LYS HB3 . 30391 1 535 . 1 . 1 48 48 LYS HG2 H 1 1.409 0.02 0.271 2 . . . . A 48 LYS HG2 . 30391 1 536 . 1 . 1 48 48 LYS HG3 H 1 1.409 0.02 0.139 2 . . . . A 48 LYS HG3 . 30391 1 537 . 1 . 1 48 48 LYS C C 13 177.486 0.20 1.000 1 . . . . A 48 LYS C . 30391 1 538 . 1 . 1 48 48 LYS CA C 13 57.117 0.20 1.000 1 . . . . A 48 LYS CA . 30391 1 539 . 1 . 1 48 48 LYS CB C 13 32.572 0.20 1.000 1 . . . . A 48 LYS CB . 30391 1 540 . 1 . 1 48 48 LYS CG C 13 24.818 0.20 1.000 1 . . . . A 48 LYS CG . 30391 1 541 . 1 . 1 48 48 LYS N N 15 120.758 0.20 1.000 1 . . . . A 48 LYS N . 30391 1 542 . 1 . 1 49 49 LEU H H 1 8.090 0.02 1.000 1 . . . . A 49 LEU H . 30391 1 543 . 1 . 1 49 49 LEU HA H 1 4.186 0.02 1.000 1 . . . . A 49 LEU HA . 30391 1 544 . 1 . 1 49 49 LEU HB2 H 1 1.655 0.02 0.496 2 . . . . A 49 LEU HB2 . 30391 1 545 . 1 . 1 49 49 LEU HB3 H 1 1.655 0.02 0.464 2 . . . . A 49 LEU HB3 . 30391 1 546 . 1 . 1 49 49 LEU HG H 1 1.523 0.02 0.465 1 . . . . A 49 LEU HG . 30391 1 547 . 1 . 1 49 49 LEU HD11 H 1 0.822 0.02 0.864 2 . . . . A 49 LEU HD11 . 30391 1 548 . 1 . 1 49 49 LEU HD12 H 1 0.822 0.02 0.864 2 . . . . A 49 LEU HD12 . 30391 1 549 . 1 . 1 49 49 LEU HD13 H 1 0.822 0.02 0.864 2 . . . . A 49 LEU HD13 . 30391 1 550 . 1 . 1 49 49 LEU HD21 H 1 0.822 0.02 0.864 2 . . . . A 49 LEU HD21 . 30391 1 551 . 1 . 1 49 49 LEU HD22 H 1 0.822 0.02 0.864 2 . . . . A 49 LEU HD22 . 30391 1 552 . 1 . 1 49 49 LEU HD23 H 1 0.822 0.02 0.864 2 . . . . A 49 LEU HD23 . 30391 1 553 . 1 . 1 49 49 LEU C C 13 177.776 0.20 1.000 1 . . . . A 49 LEU C . 30391 1 554 . 1 . 1 49 49 LEU CA C 13 55.700 0.20 1.000 1 . . . . A 49 LEU CA . 30391 1 555 . 1 . 1 49 49 LEU CB C 13 41.977 0.20 1.000 1 . . . . A 49 LEU CB . 30391 1 556 . 1 . 1 49 49 LEU CG C 13 27.070 0.20 1.000 1 . . . . A 49 LEU CG . 30391 1 557 . 1 . 1 49 49 LEU CD1 C 13 25.052 0.20 1.000 2 . . . . A 49 LEU CD1 . 30391 1 558 . 1 . 1 49 49 LEU CD2 C 13 23.374 0.20 1.000 2 . . . . A 49 LEU CD2 . 30391 1 559 . 1 . 1 49 49 LEU N N 15 121.310 0.20 1.000 1 . . . . A 49 LEU N . 30391 1 560 . 1 . 1 50 50 ALA H H 1 7.988 0.02 1.000 1 . . . . A 50 ALA H . 30391 1 561 . 1 . 1 50 50 ALA HA H 1 4.176 0.02 1.000 1 . . . . A 50 ALA HA . 30391 1 562 . 1 . 1 50 50 ALA HB1 H 1 1.349 0.02 1.000 1 . . . . A 50 ALA HB1 . 30391 1 563 . 1 . 1 50 50 ALA HB2 H 1 1.349 0.02 1.000 1 . . . . A 50 ALA HB2 . 30391 1 564 . 1 . 1 50 50 ALA HB3 H 1 1.349 0.02 1.000 1 . . . . A 50 ALA HB3 . 30391 1 565 . 1 . 1 50 50 ALA C C 13 177.838 0.20 1.000 1 . . . . A 50 ALA C . 30391 1 566 . 1 . 1 50 50 ALA CA C 13 53.100 0.20 1.000 1 . . . . A 50 ALA CA . 30391 1 567 . 1 . 1 50 50 ALA CB C 13 19.200 0.20 1.000 1 . . . . A 50 ALA CB . 30391 1 568 . 1 . 1 50 50 ALA N N 15 123.303 0.20 1.000 1 . . . . A 50 ALA N . 30391 1 569 . 1 . 1 51 51 ASP H H 1 8.124 0.02 1.000 1 . . . . A 51 ASP H . 30391 1 570 . 1 . 1 51 51 ASP HA H 1 4.483 0.02 1.000 1 . . . . A 51 ASP HA . 30391 1 571 . 1 . 1 51 51 ASP HB2 H 1 2.620 0.02 1.000 2 . . . . A 51 ASP HB2 . 30391 1 572 . 1 . 1 51 51 ASP HB3 H 1 2.620 0.02 0.744 2 . . . . A 51 ASP HB3 . 30391 1 573 . 1 . 1 51 51 ASP C C 13 176.613 0.20 1.000 1 . . . . A 51 ASP C . 30391 1 574 . 1 . 1 51 51 ASP CA C 13 57.900 0.20 1.000 1 . . . . A 51 ASP CA . 30391 1 575 . 1 . 1 51 51 ASP CB C 13 41.224 0.20 1.000 1 . . . . A 51 ASP CB . 30391 1 576 . 1 . 1 51 51 ASP N N 15 119.088 0.20 1.000 1 . . . . A 51 ASP N . 30391 1 577 . 1 . 1 52 52 LYS H H 1 8.168 0.02 1.000 1 . . . . A 52 LYS H . 30391 1 578 . 1 . 1 52 52 LYS HA H 1 4.221 0.02 0.422 1 . . . . A 52 LYS HA . 30391 1 579 . 1 . 1 52 52 LYS HB2 H 1 1.980 0.02 0.096 2 . . . . A 52 LYS HB2 . 30391 1 580 . 1 . 1 52 52 LYS HB3 H 1 1.770 0.02 0.419 2 . . . . A 52 LYS HB3 . 30391 1 581 . 1 . 1 52 52 LYS C C 13 176.897 0.20 1.000 1 . . . . A 52 LYS C . 30391 1 582 . 1 . 1 52 52 LYS CA C 13 56.616 0.20 1.000 1 . . . . A 52 LYS CA . 30391 1 583 . 1 . 1 52 52 LYS CB C 13 32.675 0.20 1.000 1 . . . . A 52 LYS CB . 30391 1 584 . 1 . 1 52 52 LYS CG C 13 24.626 0.20 1.000 1 . . . . A 52 LYS CG . 30391 1 585 . 1 . 1 52 52 LYS CD C 13 28.926 0.20 1.000 1 . . . . A 52 LYS CD . 30391 1 586 . 1 . 1 52 52 LYS N N 15 121.181 0.20 1.000 1 . . . . A 52 LYS N . 30391 1 587 . 1 . 1 53 53 GLN H H 1 8.328 0.02 1.000 1 . . . . A 53 GLN H . 30391 1 588 . 1 . 1 53 53 GLN HA H 1 4.190 0.02 0.141 1 . . . . A 53 GLN HA . 30391 1 589 . 1 . 1 53 53 GLN HB2 H 1 1.951 0.02 0.512 2 . . . . A 53 GLN HB2 . 30391 1 590 . 1 . 1 53 53 GLN HB3 H 1 1.951 0.02 0.503 2 . . . . A 53 GLN HB3 . 30391 1 591 . 1 . 1 53 53 GLN HG2 H 1 2.269 0.02 0.478 2 . . . . A 53 GLN HG2 . 30391 1 592 . 1 . 1 53 53 GLN HG3 H 1 2.269 0.02 0.496 2 . . . . A 53 GLN HG3 . 30391 1 593 . 1 . 1 53 53 GLN C C 13 176.333 0.20 1.000 1 . . . . A 53 GLN C . 30391 1 594 . 1 . 1 53 53 GLN CA C 13 56.241 0.20 1.000 1 . . . . A 53 GLN CA . 30391 1 595 . 1 . 1 53 53 GLN CB C 13 29.208 0.20 1.000 1 . . . . A 53 GLN CB . 30391 1 596 . 1 . 1 53 53 GLN CG C 13 33.884 0.20 1.000 1 . . . . A 53 GLN CG . 30391 1 597 . 1 . 1 53 53 GLN N N 15 120.263 0.20 1.000 1 . . . . A 53 GLN N . 30391 1 598 . 1 . 1 54 54 GLU H H 1 8.437 0.02 1.000 1 . . . . A 54 GLU H . 30391 1 599 . 1 . 1 54 54 GLU HA H 1 4.125 0.02 1.000 1 . . . . A 54 GLU HA . 30391 1 600 . 1 . 1 54 54 GLU HB2 H 1 1.867 0.02 0.499 2 . . . . A 54 GLU HB2 . 30391 1 601 . 1 . 1 54 54 GLU HB3 H 1 1.867 0.02 0.499 2 . . . . A 54 GLU HB3 . 30391 1 602 . 1 . 1 54 54 GLU HG2 H 1 2.113 0.02 0.498 2 . . . . A 54 GLU HG2 . 30391 1 603 . 1 . 1 54 54 GLU HG3 H 1 2.113 0.02 0.475 2 . . . . A 54 GLU HG3 . 30391 1 604 . 1 . 1 54 54 GLU C C 13 176.641 0.20 1.000 1 . . . . A 54 GLU C . 30391 1 605 . 1 . 1 54 54 GLU CA C 13 57.266 0.20 1.000 1 . . . . A 54 GLU CA . 30391 1 606 . 1 . 1 54 54 GLU CB C 13 30.259 0.20 1.000 1 . . . . A 54 GLU CB . 30391 1 607 . 1 . 1 54 54 GLU CG C 13 36.269 0.20 1.000 1 . . . . A 54 GLU CG . 30391 1 608 . 1 . 1 54 54 GLU N N 15 121.394 0.20 1.000 1 . . . . A 54 GLU N . 30391 1 609 . 1 . 1 55 55 HIS H H 1 8.358 0.02 1.000 1 . . . . A 55 HIS H . 30391 1 610 . 1 . 1 55 55 HIS HA H 1 4.549 0.02 1.000 1 . . . . A 55 HIS HA . 30391 1 611 . 1 . 1 55 55 HIS HB2 H 1 3.048 0.02 0.555 2 . . . . A 55 HIS HB2 . 30391 1 612 . 1 . 1 55 55 HIS HB3 H 1 3.048 0.02 1.000 2 . . . . A 55 HIS HB3 . 30391 1 613 . 1 . 1 55 55 HIS C C 13 175.429 0.20 1.000 1 . . . . A 55 HIS C . 30391 1 614 . 1 . 1 55 55 HIS CA C 13 56.200 0.20 0.493 1 . . . . A 55 HIS CA . 30391 1 615 . 1 . 1 55 55 HIS CB C 13 30.400 0.20 1.000 1 . . . . A 55 HIS CB . 30391 1 616 . 1 . 1 55 55 HIS N N 15 119.411 0.20 1.000 1 . . . . A 55 HIS N . 30391 1 617 . 1 . 1 56 56 LEU H H 1 8.136 0.02 1.000 1 . . . . A 56 LEU H . 30391 1 618 . 1 . 1 56 56 LEU HA H 1 4.218 0.02 1.000 1 . . . . A 56 LEU HA . 30391 1 619 . 1 . 1 56 56 LEU HB2 H 1 1.526 0.02 0.703 2 . . . . A 56 LEU HB2 . 30391 1 620 . 1 . 1 56 56 LEU HB3 H 1 1.526 0.02 0.436 2 . . . . A 56 LEU HB3 . 30391 1 621 . 1 . 1 56 56 LEU HG H 1 1.526 0.02 0.447 1 . . . . A 56 LEU HG . 30391 1 622 . 1 . 1 56 56 LEU HD11 H 1 0.774 0.02 0.254 1 . . . . A 56 LEU HD11 . 30391 1 623 . 1 . 1 56 56 LEU HD12 H 1 0.774 0.02 0.070 1 . . . . A 56 LEU HD12 . 30391 1 624 . 1 . 1 56 56 LEU HD13 H 1 0.774 0.02 0.066 1 . . . . A 56 LEU HD13 . 30391 1 625 . 1 . 1 56 56 LEU C C 13 177.328 0.20 1.000 1 . . . . A 56 LEU C . 30391 1 626 . 1 . 1 56 56 LEU CA C 13 55.436 0.20 1.000 1 . . . . A 56 LEU CA . 30391 1 627 . 1 . 1 56 56 LEU CB C 13 42.159 0.20 1.000 1 . . . . A 56 LEU CB . 30391 1 628 . 1 . 1 56 56 LEU CG C 13 26.744 0.20 1.000 1 . . . . A 56 LEU CG . 30391 1 629 . 1 . 1 56 56 LEU CD1 C 13 23.407 0.20 0.832 2 . . . . A 56 LEU CD1 . 30391 1 630 . 1 . 1 56 56 LEU CD2 C 13 24.800 0.20 0.158 2 . . . . A 56 LEU CD2 . 30391 1 631 . 1 . 1 56 56 LEU N N 15 122.756 0.20 1.000 1 . . . . A 56 LEU N . 30391 1 632 . 1 . 1 57 57 ASN H H 1 8.453 0.02 1.000 1 . . . . A 57 ASN H . 30391 1 633 . 1 . 1 57 57 ASN HA H 1 4.585 0.02 1.000 1 . . . . A 57 ASN HA . 30391 1 634 . 1 . 1 57 57 ASN HB2 H 1 2.757 0.02 0.671 2 . . . . A 57 ASN HB2 . 30391 1 635 . 1 . 1 57 57 ASN HB3 H 1 2.757 0.02 0.070 2 . . . . A 57 ASN HB3 . 30391 1 636 . 1 . 1 57 57 ASN C C 13 176.014 0.20 1.000 1 . . . . A 57 ASN C . 30391 1 637 . 1 . 1 57 57 ASN CA C 13 53.493 0.20 1.000 1 . . . . A 57 ASN CA . 30391 1 638 . 1 . 1 57 57 ASN CB C 13 38.732 0.20 1.000 1 . . . . A 57 ASN CB . 30391 1 639 . 1 . 1 57 57 ASN N N 15 119.024 0.20 1.000 1 . . . . A 57 ASN N . 30391 1 640 . 1 . 1 58 58 GLY H H 1 8.377 0.02 1.000 1 . . . . A 58 GLY H . 30391 1 641 . 1 . 1 58 58 GLY HA2 H 1 3.852 0.02 1.000 2 . . . . A 58 GLY HA2 . 30391 1 642 . 1 . 1 58 58 GLY HA3 H 1 3.852 0.02 0.758 2 . . . . A 58 GLY HA3 . 30391 1 643 . 1 . 1 58 58 GLY C C 13 174.217 0.20 1.000 1 . . . . A 58 GLY C . 30391 1 644 . 1 . 1 58 58 GLY CA C 13 45.821 0.20 1.000 1 . . . . A 58 GLY CA . 30391 1 645 . 1 . 1 58 58 GLY N N 15 109.430 0.20 1.000 1 . . . . A 58 GLY N . 30391 1 646 . 1 . 1 59 59 ALA H H 1 8.076 0.02 1.000 1 . . . . A 59 ALA H . 30391 1 647 . 1 . 1 59 59 ALA HA H 1 4.208 0.02 1.000 1 . . . . A 59 ALA HA . 30391 1 648 . 1 . 1 59 59 ALA HB1 H 1 1.321 0.02 0.664 1 . . . . A 59 ALA HB1 . 30391 1 649 . 1 . 1 59 59 ALA HB2 H 1 1.321 0.02 0.664 1 . . . . A 59 ALA HB2 . 30391 1 650 . 1 . 1 59 59 ALA HB3 H 1 1.321 0.02 0.664 1 . . . . A 59 ALA HB3 . 30391 1 651 . 1 . 1 59 59 ALA C C 13 177.942 0.20 1.000 1 . . . . A 59 ALA C . 30391 1 652 . 1 . 1 59 59 ALA CA C 13 52.776 0.20 1.000 1 . . . . A 59 ALA CA . 30391 1 653 . 1 . 1 59 59 ALA CB C 13 19.101 0.20 1.000 1 . . . . A 59 ALA CB . 30391 1 654 . 1 . 1 59 59 ALA N N 15 123.425 0.20 1.000 1 . . . . A 59 ALA N . 30391 1 655 . 1 . 1 60 60 LEU H H 1 8.053 0.02 1.000 1 . . . . A 60 LEU H . 30391 1 656 . 1 . 1 60 60 LEU HA H 1 4.181 0.02 1.000 1 . . . . A 60 LEU HA . 30391 1 657 . 1 . 1 60 60 LEU HB2 H 1 1.527 0.02 0.459 2 . . . . A 60 LEU HB2 . 30391 1 658 . 1 . 1 60 60 LEU HB3 H 1 1.527 0.02 0.501 2 . . . . A 60 LEU HB3 . 30391 1 659 . 1 . 1 60 60 LEU HG H 1 1.440 0.02 0.467 1 . . . . A 60 LEU HG . 30391 1 660 . 1 . 1 60 60 LEU HD11 H 1 0.797 0.02 0.797 2 . . . . A 60 LEU HD11 . 30391 1 661 . 1 . 1 60 60 LEU HD12 H 1 0.797 0.02 0.797 2 . . . . A 60 LEU HD12 . 30391 1 662 . 1 . 1 60 60 LEU HD13 H 1 0.797 0.02 0.797 2 . . . . A 60 LEU HD13 . 30391 1 663 . 1 . 1 60 60 LEU HD21 H 1 0.797 0.02 0.863 2 . . . . A 60 LEU HD21 . 30391 1 664 . 1 . 1 60 60 LEU HD22 H 1 0.797 0.02 0.863 2 . . . . A 60 LEU HD22 . 30391 1 665 . 1 . 1 60 60 LEU HD23 H 1 0.797 0.02 0.863 2 . . . . A 60 LEU HD23 . 30391 1 666 . 1 . 1 60 60 LEU C C 13 177.239 0.20 1.000 1 . . . . A 60 LEU C . 30391 1 667 . 1 . 1 60 60 LEU CA C 13 55.200 0.20 0.876 1 . . . . A 60 LEU CA . 30391 1 668 . 1 . 1 60 60 LEU CB C 13 42.041 0.20 0.842 1 . . . . A 60 LEU CB . 30391 1 669 . 1 . 1 60 60 LEU CD1 C 13 23.558 0.20 0.588 2 . . . . A 60 LEU CD1 . 30391 1 670 . 1 . 1 60 60 LEU CD2 C 13 23.558 0.20 0.409 2 . . . . A 60 LEU CD2 . 30391 1 671 . 1 . 1 60 60 LEU N N 15 120.201 0.20 1.000 1 . . . . A 60 LEU N . 30391 1 672 . 1 . 1 61 61 ARG H H 1 8.055 0.02 1.000 1 . . . . A 61 ARG H . 30391 1 673 . 1 . 1 61 61 ARG HA H 1 4.152 0.02 1.000 1 . . . . A 61 ARG HA . 30391 1 674 . 1 . 1 61 61 ARG HB2 H 1 1.604 0.02 0.480 2 . . . . A 61 ARG HB2 . 30391 1 675 . 1 . 1 61 61 ARG HB3 H 1 1.604 0.02 0.487 2 . . . . A 61 ARG HB3 . 30391 1 676 . 1 . 1 61 61 ARG HG2 H 1 1.381 0.02 0.473 2 . . . . A 61 ARG HG2 . 30391 1 677 . 1 . 1 61 61 ARG HG3 H 1 1.381 0.02 0.498 2 . . . . A 61 ARG HG3 . 30391 1 678 . 1 . 1 61 61 ARG HD2 H 1 3.051 0.02 0.449 2 . . . . A 61 ARG HD2 . 30391 1 679 . 1 . 1 61 61 ARG HD3 H 1 3.050 0.02 0.353 2 . . . . A 61 ARG HD3 . 30391 1 680 . 1 . 1 61 61 ARG C C 13 175.926 0.20 1.000 1 . . . . A 61 ARG C . 30391 1 681 . 1 . 1 61 61 ARG CA C 13 56.384 0.20 1.000 1 . . . . A 61 ARG CA . 30391 1 682 . 1 . 1 61 61 ARG CB C 13 30.766 0.20 1.000 1 . . . . A 61 ARG CB . 30391 1 683 . 1 . 1 61 61 ARG CG C 13 26.905 0.20 1.000 1 . . . . A 61 ARG CG . 30391 1 684 . 1 . 1 61 61 ARG N N 15 120.969 0.20 1.000 1 . . . . A 61 ARG N . 30391 1 685 . 1 . 1 62 62 TYR H H 1 8.130 0.02 1.000 1 . . . . A 62 TYR H . 30391 1 686 . 1 . 1 62 62 TYR HA H 1 4.507 0.02 1.000 1 . . . . A 62 TYR HA . 30391 1 687 . 1 . 1 62 62 TYR HB2 H 1 2.974 0.02 0.643 2 . . . . A 62 TYR HB2 . 30391 1 688 . 1 . 1 62 62 TYR HB3 H 1 2.844 0.02 0.636 2 . . . . A 62 TYR HB3 . 30391 1 689 . 1 . 1 62 62 TYR C C 13 175.745 0.20 1.000 1 . . . . A 62 TYR C . 30391 1 690 . 1 . 1 62 62 TYR CA C 13 58.135 0.20 1.000 1 . . . . A 62 TYR CA . 30391 1 691 . 1 . 1 62 62 TYR CB C 13 38.658 0.20 1.000 1 . . . . A 62 TYR CB . 30391 1 692 . 1 . 1 62 62 TYR N N 15 120.720 0.20 1.000 1 . . . . A 62 TYR N . 30391 1 693 . 1 . 1 63 63 ILE H H 1 7.966 0.02 1.000 1 . . . . A 63 ILE H . 30391 1 694 . 1 . 1 63 63 ILE HA H 1 3.974 0.02 1.000 1 . . . . A 63 ILE HA . 30391 1 695 . 1 . 1 63 63 ILE HB H 1 1.732 0.02 1.000 1 . . . . A 63 ILE HB . 30391 1 696 . 1 . 1 63 63 ILE HG12 H 1 1.355 0.02 0.133 2 . . . . A 63 ILE HG12 . 30391 1 697 . 1 . 1 63 63 ILE HG13 H 1 1.355 0.02 0.420 2 . . . . A 63 ILE HG13 . 30391 1 698 . 1 . 1 63 63 ILE HG21 H 1 0.780 0.02 0.466 1 . . . . A 63 ILE HG21 . 30391 1 699 . 1 . 1 63 63 ILE HG22 H 1 0.780 0.02 0.466 1 . . . . A 63 ILE HG22 . 30391 1 700 . 1 . 1 63 63 ILE HG23 H 1 0.780 0.02 0.466 1 . . . . A 63 ILE HG23 . 30391 1 701 . 1 . 1 63 63 ILE HD11 H 1 1.050 0.02 0.453 1 . . . . A 63 ILE HD11 . 30391 1 702 . 1 . 1 63 63 ILE HD12 H 1 1.050 0.02 0.453 1 . . . . A 63 ILE HD12 . 30391 1 703 . 1 . 1 63 63 ILE HD13 H 1 1.050 0.02 0.453 1 . . . . A 63 ILE HD13 . 30391 1 704 . 1 . 1 63 63 ILE C C 13 175.686 0.20 1.000 1 . . . . A 63 ILE C . 30391 1 705 . 1 . 1 63 63 ILE CA C 13 61.400 0.20 1.000 1 . . . . A 63 ILE CA . 30391 1 706 . 1 . 1 63 63 ILE CB C 13 38.766 0.20 0.888 1 . . . . A 63 ILE CB . 30391 1 707 . 1 . 1 63 63 ILE CG1 C 13 27.621 0.20 1.000 1 . . . . A 63 ILE CG1 . 30391 1 708 . 1 . 1 63 63 ILE CG2 C 13 17.499 0.20 1.000 1 . . . . A 63 ILE CG2 . 30391 1 709 . 1 . 1 63 63 ILE N N 15 122.419 0.20 1.000 1 . . . . A 63 ILE N . 30391 1 710 . 1 . 1 64 64 ASN H H 1 8.388 0.02 1.000 1 . . . . A 64 ASN H . 30391 1 711 . 1 . 1 64 64 ASN HA H 1 4.574 0.02 1.000 1 . . . . A 64 ASN HA . 30391 1 712 . 1 . 1 64 64 ASN HB2 H 1 2.776 0.02 0.627 2 . . . . A 64 ASN HB2 . 30391 1 713 . 1 . 1 64 64 ASN HB3 H 1 2.690 0.02 0.345 2 . . . . A 64 ASN HB3 . 30391 1 714 . 1 . 1 64 64 ASN C C 13 175.491 0.20 1.000 1 . . . . A 64 ASN C . 30391 1 715 . 1 . 1 64 64 ASN CA C 13 53.294 0.20 1.000 1 . . . . A 64 ASN CA . 30391 1 716 . 1 . 1 64 64 ASN CB C 13 38.731 0.20 1.000 1 . . . . A 64 ASN CB . 30391 1 717 . 1 . 1 64 64 ASN N N 15 121.968 0.20 1.000 1 . . . . A 64 ASN N . 30391 1 718 . 1 . 1 65 65 GLU H H 1 8.481 0.02 1.000 1 . . . . A 65 GLU H . 30391 1 719 . 1 . 1 65 65 GLU HA H 1 4.135 0.02 0.656 1 . . . . A 65 GLU HA . 30391 1 720 . 1 . 1 65 65 GLU HB2 H 1 1.925 0.02 0.542 2 . . . . A 65 GLU HB2 . 30391 1 721 . 1 . 1 65 65 GLU HB3 H 1 1.925 0.02 0.093 2 . . . . A 65 GLU HB3 . 30391 1 722 . 1 . 1 65 65 GLU HG2 H 1 2.197 0.02 0.348 2 . . . . A 65 GLU HG2 . 30391 1 723 . 1 . 1 65 65 GLU HG3 H 1 2.197 0.02 0.127 2 . . . . A 65 GLU HG3 . 30391 1 724 . 1 . 1 65 65 GLU C C 13 176.882 0.20 1.000 1 . . . . A 65 GLU C . 30391 1 725 . 1 . 1 65 65 GLU CA C 13 57.584 0.20 1.000 1 . . . . A 65 GLU CA . 30391 1 726 . 1 . 1 65 65 GLU CB C 13 30.100 0.20 0.056 1 . . . . A 65 GLU CB . 30391 1 727 . 1 . 1 65 65 GLU CG C 13 36.300 0.20 1.000 1 . . . . A 65 GLU CG . 30391 1 728 . 1 . 1 65 65 GLU N N 15 122.221 0.20 1.000 1 . . . . A 65 GLU N . 30391 1 729 . 1 . 1 66 66 LYS H H 1 8.253 0.02 1.000 1 . . . . A 66 LYS H . 30391 1 730 . 1 . 1 66 66 LYS HA H 1 4.096 0.02 1.000 1 . . . . A 66 LYS HA . 30391 1 731 . 1 . 1 66 66 LYS HB2 H 1 1.781 0.02 0.119 2 . . . . A 66 LYS HB2 . 30391 1 732 . 1 . 1 66 66 LYS HB3 H 1 1.781 0.02 0.082 2 . . . . A 66 LYS HB3 . 30391 1 733 . 1 . 1 66 66 LYS HG2 H 1 1.394 0.02 0.262 2 . . . . A 66 LYS HG2 . 30391 1 734 . 1 . 1 66 66 LYS HG3 H 1 1.394 0.02 0.133 2 . . . . A 66 LYS HG3 . 30391 1 735 . 1 . 1 66 66 LYS HD2 H 1 1.745 0.02 0.495 2 . . . . A 66 LYS HD2 . 30391 1 736 . 1 . 1 66 66 LYS HD3 H 1 1.745 0.02 0.495 2 . . . . A 66 LYS HD3 . 30391 1 737 . 1 . 1 66 66 LYS C C 13 177.277 0.20 1.000 1 . . . . A 66 LYS C . 30391 1 738 . 1 . 1 66 66 LYS CA C 13 56.942 0.20 1.000 1 . . . . A 66 LYS CA . 30391 1 739 . 1 . 1 66 66 LYS CB C 13 32.649 0.20 1.000 1 . . . . A 66 LYS CB . 30391 1 740 . 1 . 1 66 66 LYS CG C 13 24.781 0.20 1.000 1 . . . . A 66 LYS CG . 30391 1 741 . 1 . 1 66 66 LYS N N 15 121.032 0.20 1.000 1 . . . . A 66 LYS N . 30391 1 742 . 1 . 1 67 67 GLU H H 1 8.254 0.02 1.000 1 . . . . A 67 GLU H . 30391 1 743 . 1 . 1 67 67 GLU HA H 1 4.111 0.02 1.000 1 . . . . A 67 GLU HA . 30391 1 744 . 1 . 1 67 67 GLU HB2 H 1 1.918 0.02 0.503 2 . . . . A 67 GLU HB2 . 30391 1 745 . 1 . 1 67 67 GLU HB3 H 1 1.918 0.02 0.504 2 . . . . A 67 GLU HB3 . 30391 1 746 . 1 . 1 67 67 GLU HG2 H 1 2.190 0.02 0.121 2 . . . . A 67 GLU HG2 . 30391 1 747 . 1 . 1 67 67 GLU HG3 H 1 2.190 0.02 0.054 2 . . . . A 67 GLU HG3 . 30391 1 748 . 1 . 1 67 67 GLU C C 13 176.773 0.20 1.000 1 . . . . A 67 GLU C . 30391 1 749 . 1 . 1 67 67 GLU CA C 13 57.229 0.20 1.000 1 . . . . A 67 GLU CA . 30391 1 750 . 1 . 1 67 67 GLU CB C 13 30.052 0.20 1.000 1 . . . . A 67 GLU CB . 30391 1 751 . 1 . 1 67 67 GLU CG C 13 36.297 0.20 1.000 1 . . . . A 67 GLU CG . 30391 1 752 . 1 . 1 67 67 GLU N N 15 121.526 0.20 1.000 1 . . . . A 67 GLU N . 30391 1 753 . 1 . 1 68 68 ALA H H 1 8.179 0.02 1.000 1 . . . . A 68 ALA H . 30391 1 754 . 1 . 1 68 68 ALA HA H 1 4.123 0.02 0.808 1 . . . . A 68 ALA HA . 30391 1 755 . 1 . 1 68 68 ALA HB1 H 1 1.389 0.02 0.147 1 . . . . A 68 ALA HB1 . 30391 1 756 . 1 . 1 68 68 ALA HB2 H 1 1.389 0.02 0.147 1 . . . . A 68 ALA HB2 . 30391 1 757 . 1 . 1 68 68 ALA HB3 H 1 1.389 0.02 0.147 1 . . . . A 68 ALA HB3 . 30391 1 758 . 1 . 1 68 68 ALA C C 13 178.175 0.20 1.000 1 . . . . A 68 ALA C . 30391 1 759 . 1 . 1 68 68 ALA CA C 13 53.009 0.20 1.000 1 . . . . A 68 ALA CA . 30391 1 760 . 1 . 1 68 68 ALA CB C 13 19.500 0.20 1.000 1 . . . . A 68 ALA CB . 30391 1 761 . 1 . 1 68 68 ALA N N 15 123.949 0.20 1.000 1 . . . . A 68 ALA N . 30391 1 762 . 1 . 1 69 69 GLU H H 1 8.174 0.02 1.000 1 . . . . A 69 GLU H . 30391 1 763 . 1 . 1 69 69 GLU HA H 1 4.115 0.02 0.543 1 . . . . A 69 GLU HA . 30391 1 764 . 1 . 1 69 69 GLU HB2 H 1 1.929 0.02 0.499 2 . . . . A 69 GLU HB2 . 30391 1 765 . 1 . 1 69 69 GLU HB3 H 1 1.929 0.02 0.499 2 . . . . A 69 GLU HB3 . 30391 1 766 . 1 . 1 69 69 GLU HG2 H 1 2.186 0.02 0.498 2 . . . . A 69 GLU HG2 . 30391 1 767 . 1 . 1 69 69 GLU HG3 H 1 2.186 0.02 0.429 2 . . . . A 69 GLU HG3 . 30391 1 768 . 1 . 1 69 69 GLU C C 13 176.735 0.20 1.000 1 . . . . A 69 GLU C . 30391 1 769 . 1 . 1 69 69 GLU CA C 13 57.007 0.20 1.000 1 . . . . A 69 GLU CA . 30391 1 770 . 1 . 1 69 69 GLU CB C 13 30.306 0.20 1.000 1 . . . . A 69 GLU CB . 30391 1 771 . 1 . 1 69 69 GLU CG C 13 36.348 0.20 1.000 1 . . . . A 69 GLU CG . 30391 1 772 . 1 . 1 69 69 GLU N N 15 119.487 0.20 1.000 1 . . . . A 69 GLU N . 30391 1 773 . 1 . 1 70 70 ARG H H 1 8.207 0.02 1.000 1 . . . . A 70 ARG H . 30391 1 774 . 1 . 1 70 70 ARG HA H 1 4.188 0.02 0.582 1 . . . . A 70 ARG HA . 30391 1 775 . 1 . 1 70 70 ARG HB2 H 1 1.750 0.02 0.270 2 . . . . A 70 ARG HB2 . 30391 1 776 . 1 . 1 70 70 ARG HB3 H 1 1.750 0.02 0.270 2 . . . . A 70 ARG HB3 . 30391 1 777 . 1 . 1 70 70 ARG HG2 H 1 1.549 0.02 0.490 2 . . . . A 70 ARG HG2 . 30391 1 778 . 1 . 1 70 70 ARG HG3 H 1 1.549 0.02 0.056 2 . . . . A 70 ARG HG3 . 30391 1 779 . 1 . 1 70 70 ARG HD2 H 1 3.130 0.02 0.720 2 . . . . A 70 ARG HD2 . 30391 1 780 . 1 . 1 70 70 ARG HD3 H 1 3.130 0.02 0.850 2 . . . . A 70 ARG HD3 . 30391 1 781 . 1 . 1 70 70 ARG C C 13 176.431 0.20 1.000 1 . . . . A 70 ARG C . 30391 1 782 . 1 . 1 70 70 ARG CA C 13 56.800 0.20 0.112 1 . . . . A 70 ARG CA . 30391 1 783 . 1 . 1 70 70 ARG CB C 13 30.300 0.20 0.138 1 . . . . A 70 ARG CB . 30391 1 784 . 1 . 1 70 70 ARG CG C 13 27.090 0.20 1.000 1 . . . . A 70 ARG CG . 30391 1 785 . 1 . 1 70 70 ARG CD C 13 43.334 0.20 1.000 1 . . . . A 70 ARG CD . 30391 1 786 . 1 . 1 70 70 ARG N N 15 122.146 0.20 1.000 1 . . . . A 70 ARG N . 30391 1 787 . 1 . 1 71 71 LYS H H 1 8.333 0.02 1.000 1 . . . . A 71 LYS H . 30391 1 788 . 1 . 1 71 71 LYS HA H 1 4.097 0.02 0.808 1 . . . . A 71 LYS HA . 30391 1 789 . 1 . 1 71 71 LYS C C 13 176.896 0.20 1.000 1 . . . . A 71 LYS C . 30391 1 790 . 1 . 1 71 71 LYS CA C 13 56.482 0.20 1.000 1 . . . . A 71 LYS CA . 30391 1 791 . 1 . 1 71 71 LYS CB C 13 32.946 0.20 1.000 1 . . . . A 71 LYS CB . 30391 1 792 . 1 . 1 71 71 LYS CG C 13 24.651 0.20 1.000 1 . . . . A 71 LYS CG . 30391 1 793 . 1 . 1 71 71 LYS CD C 13 29.246 0.20 1.000 1 . . . . A 71 LYS CD . 30391 1 794 . 1 . 1 71 71 LYS N N 15 122.780 0.20 1.000 1 . . . . A 71 LYS N . 30391 1 795 . 1 . 1 72 72 GLU H H 1 8.418 0.02 1.000 1 . . . . A 72 GLU H . 30391 1 796 . 1 . 1 72 72 GLU HA H 1 4.154 0.02 1.000 1 . . . . A 72 GLU HA . 30391 1 797 . 1 . 1 72 72 GLU HB2 H 1 1.966 0.02 0.570 2 . . . . A 72 GLU HB2 . 30391 1 798 . 1 . 1 72 72 GLU HB3 H 1 1.966 0.02 0.423 2 . . . . A 72 GLU HB3 . 30391 1 799 . 1 . 1 72 72 GLU HG2 H 1 2.146 0.02 0.382 2 . . . . A 72 GLU HG2 . 30391 1 800 . 1 . 1 72 72 GLU HG3 H 1 2.290 0.02 0.101 2 . . . . A 72 GLU HG3 . 30391 1 801 . 1 . 1 72 72 GLU C C 13 177.351 0.20 1.000 1 . . . . A 72 GLU C . 30391 1 802 . 1 . 1 72 72 GLU CA C 13 57.656 0.20 1.000 1 . . . . A 72 GLU CA . 30391 1 803 . 1 . 1 72 72 GLU CB C 13 30.766 0.20 0.589 1 . . . . A 72 GLU CB . 30391 1 804 . 1 . 1 72 72 GLU CG C 13 36.400 0.20 1.000 1 . . . . A 72 GLU CG . 30391 1 805 . 1 . 1 72 72 GLU N N 15 121.781 0.20 1.000 1 . . . . A 72 GLU N . 30391 1 806 . 1 . 1 73 73 LYS H H 1 8.114 0.02 1.000 1 . . . . A 73 LYS H . 30391 1 807 . 1 . 1 73 73 LYS HA H 1 4.196 0.02 1.000 1 . . . . A 73 LYS HA . 30391 1 808 . 1 . 1 73 73 LYS HB2 H 1 1.736 0.02 0.476 2 . . . . A 73 LYS HB2 . 30391 1 809 . 1 . 1 73 73 LYS HB3 H 1 1.736 0.02 0.052 2 . . . . A 73 LYS HB3 . 30391 1 810 . 1 . 1 73 73 LYS HG2 H 1 1.371 0.02 0.319 2 . . . . A 73 LYS HG2 . 30391 1 811 . 1 . 1 73 73 LYS HG3 H 1 1.371 0.02 0.083 2 . . . . A 73 LYS HG3 . 30391 1 812 . 1 . 1 73 73 LYS C C 13 176.781 0.20 1.000 1 . . . . A 73 LYS C . 30391 1 813 . 1 . 1 73 73 LYS CA C 13 56.560 0.20 1.000 1 . . . . A 73 LYS CA . 30391 1 814 . 1 . 1 73 73 LYS CB C 13 33.069 0.20 1.000 1 . . . . A 73 LYS CB . 30391 1 815 . 1 . 1 73 73 LYS CG C 13 24.617 0.20 1.000 1 . . . . A 73 LYS CG . 30391 1 816 . 1 . 1 73 73 LYS CD C 13 28.980 0.20 1.000 1 . . . . A 73 LYS CD . 30391 1 817 . 1 . 1 73 73 LYS N N 15 120.687 0.20 1.000 1 . . . . A 73 LYS N . 30391 1 818 . 1 . 1 74 74 GLU H H 1 8.426 0.02 1.000 1 . . . . A 74 GLU H . 30391 1 819 . 1 . 1 74 74 GLU HA H 1 4.151 0.02 1.000 1 . . . . A 74 GLU HA . 30391 1 820 . 1 . 1 74 74 GLU HB2 H 1 1.987 0.02 0.438 2 . . . . A 74 GLU HB2 . 30391 1 821 . 1 . 1 74 74 GLU HB3 H 1 1.860 0.02 0.416 2 . . . . A 74 GLU HB3 . 30391 1 822 . 1 . 1 74 74 GLU HG2 H 1 2.219 0.02 0.225 2 . . . . A 74 GLU HG2 . 30391 1 823 . 1 . 1 74 74 GLU HG3 H 1 2.219 0.02 0.065 2 . . . . A 74 GLU HG3 . 30391 1 824 . 1 . 1 74 74 GLU C C 13 176.248 0.20 1.000 1 . . . . A 74 GLU C . 30391 1 825 . 1 . 1 74 74 GLU CA C 13 56.797 0.20 0.779 1 . . . . A 74 GLU CA . 30391 1 826 . 1 . 1 74 74 GLU CB C 13 30.230 0.20 1.000 1 . . . . A 74 GLU CB . 30391 1 827 . 1 . 1 74 74 GLU CG C 13 36.414 0.20 1.000 1 . . . . A 74 GLU CG . 30391 1 828 . 1 . 1 74 74 GLU N N 15 122.178 0.20 1.000 1 . . . . A 74 GLU N . 30391 1 829 . 1 . 1 75 75 ALA H H 1 8.242 0.02 1.000 1 . . . . A 75 ALA H . 30391 1 830 . 1 . 1 75 75 ALA HA H 1 4.220 0.02 0.211 1 . . . . A 75 ALA HA . 30391 1 831 . 1 . 1 75 75 ALA HB1 H 1 1.332 0.02 0.665 1 . . . . A 75 ALA HB1 . 30391 1 832 . 1 . 1 75 75 ALA HB2 H 1 1.332 0.02 0.665 1 . . . . A 75 ALA HB2 . 30391 1 833 . 1 . 1 75 75 ALA HB3 H 1 1.332 0.02 0.665 1 . . . . A 75 ALA HB3 . 30391 1 834 . 1 . 1 75 75 ALA C C 13 177.661 0.20 1.000 1 . . . . A 75 ALA C . 30391 1 835 . 1 . 1 75 75 ALA CA C 13 52.518 0.20 1.000 1 . . . . A 75 ALA CA . 30391 1 836 . 1 . 1 75 75 ALA CB C 13 19.362 0.20 1.000 1 . . . . A 75 ALA CB . 30391 1 837 . 1 . 1 75 75 ALA N N 15 124.344 0.20 1.000 1 . . . . A 75 ALA N . 30391 1 838 . 1 . 1 76 76 GLU H H 1 8.332 0.02 1.000 1 . . . . A 76 GLU H . 30391 1 839 . 1 . 1 76 76 GLU HA H 1 4.185 0.02 1.000 1 . . . . A 76 GLU HA . 30391 1 840 . 1 . 1 76 76 GLU HB2 H 1 2.023 0.02 0.433 2 . . . . A 76 GLU HB2 . 30391 1 841 . 1 . 1 76 76 GLU HB3 H 1 1.858 0.02 0.386 2 . . . . A 76 GLU HB3 . 30391 1 842 . 1 . 1 76 76 GLU HG2 H 1 2.217 0.02 0.536 2 . . . . A 76 GLU HG2 . 30391 1 843 . 1 . 1 76 76 GLU HG3 H 1 2.217 0.02 0.061 2 . . . . A 76 GLU HG3 . 30391 1 844 . 1 . 1 76 76 GLU C C 13 175.702 0.20 1.000 1 . . . . A 76 GLU C . 30391 1 845 . 1 . 1 76 76 GLU CA C 13 56.708 0.20 1.000 1 . . . . A 76 GLU CA . 30391 1 846 . 1 . 1 76 76 GLU CB C 13 30.382 0.20 1.000 1 . . . . A 76 GLU CB . 30391 1 847 . 1 . 1 76 76 GLU CG C 13 36.398 0.20 1.000 1 . . . . A 76 GLU CG . 30391 1 848 . 1 . 1 76 76 GLU N N 15 120.588 0.20 1.000 1 . . . . A 76 GLU N . 30391 1 849 . 1 . 1 77 77 GLN H H 1 7.954 0.02 1.000 1 . . . . A 77 GLN H . 30391 1 850 . 1 . 1 77 77 GLN HA H 1 4.190 0.02 0.141 1 . . . . A 77 GLN HA . 30391 1 851 . 1 . 1 77 77 GLN HB2 H 1 1.951 0.02 0.512 2 . . . . A 77 GLN HB2 . 30391 1 852 . 1 . 1 77 77 GLN HB3 H 1 1.951 0.02 0.503 2 . . . . A 77 GLN HB3 . 30391 1 853 . 1 . 1 77 77 GLN HG2 H 1 2.269 0.02 0.478 2 . . . . A 77 GLN HG2 . 30391 1 854 . 1 . 1 77 77 GLN HG3 H 1 2.269 0.02 0.496 2 . . . . A 77 GLN HG3 . 30391 1 855 . 1 . 1 77 77 GLN C C 13 180.500 0.20 1.000 1 . . . . A 77 GLN C . 30391 1 856 . 1 . 1 77 77 GLN CA C 13 57.350 0.20 1.000 1 . . . . A 77 GLN CA . 30391 1 857 . 1 . 1 77 77 GLN CB C 13 29.008 0.20 1.000 1 . . . . A 77 GLN CB . 30391 1 858 . 1 . 1 77 77 GLN CG C 13 33.884 0.20 1.000 1 . . . . A 77 GLN CG . 30391 1 859 . 1 . 1 77 77 GLN N N 15 125.920 0.20 1.000 1 . . . . A 77 GLN N . 30391 1 stop_ save_