################################### # 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_protein-chemical-shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode protein-chemical-shifts _Assigned_chem_shift_list.Entry_ID 25652 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $40C _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.4 _Assigned_chem_shift_list.Chem_shift_15N_err 0.4 _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 'digital resolution' _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 7 '3D 1H-15N NOESY-HSQC' . . . 25652 1 8 '3D 1H-13C NOESY aliphatic-HSQC' . . . 25652 1 9 '3D 1H-13C NOESY aromatic-HSQC' . . . 25652 1 11 '2D 1H-1H NOESY' . . . 25652 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 25652 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 3 3 ASP H H 1 8.570 0.02 . 1 . . . A 43 ASP H . 25652 1 2 . 1 1 3 3 ASP HA H 1 4.685 0.02 . 1 . . . A 43 ASP HA . 25652 1 3 . 1 1 3 3 ASP HB2 H 1 2.726 0.02 . 2 . . . A 43 ASP HB2 . 25652 1 4 . 1 1 3 3 ASP HB3 H 1 2.726 0.02 . 2 . . . A 43 ASP HB3 . 25652 1 5 . 1 1 3 3 ASP CB C 13 41.399 0.40 . 1 . . . A 43 ASP CB . 25652 1 6 . 1 1 3 3 ASP N N 15 121.087 0.40 . 1 . . . A 43 ASP N . 25652 1 7 . 1 1 4 4 SER HA H 1 4.431 0.02 . 1 . . . A 44 SER HA . 25652 1 8 . 1 1 4 4 SER HB2 H 1 4.000 0.02 . 2 . . . A 44 SER HB2 . 25652 1 9 . 1 1 4 4 SER HB3 H 1 4.000 0.02 . 2 . . . A 44 SER HB3 . 25652 1 10 . 1 1 4 4 SER CA C 13 59.142 0.40 . 1 . . . A 44 SER CA . 25652 1 11 . 1 1 4 4 SER CB C 13 63.641 0.40 . 1 . . . A 44 SER CB . 25652 1 12 . 1 1 5 5 LYS H H 1 8.244 0.02 . 1 . . . A 45 LYS H . 25652 1 13 . 1 1 5 5 LYS HA H 1 4.300 0.02 . 1 . . . A 45 LYS HA . 25652 1 14 . 1 1 5 5 LYS HB2 H 1 1.783 0.02 . 2 . . . A 45 LYS HB2 . 25652 1 15 . 1 1 5 5 LYS HB3 H 1 1.783 0.02 . 2 . . . A 45 LYS HB3 . 25652 1 16 . 1 1 5 5 LYS HG2 H 1 1.421 0.02 . 2 . . . A 45 LYS HG2 . 25652 1 17 . 1 1 5 5 LYS HG3 H 1 1.498 0.02 . 2 . . . A 45 LYS HG3 . 25652 1 18 . 1 1 5 5 LYS HD2 H 1 1.657 0.02 . 2 . . . A 45 LYS HD2 . 25652 1 19 . 1 1 5 5 LYS HD3 H 1 1.721 0.02 . 2 . . . A 45 LYS HD3 . 25652 1 20 . 1 1 5 5 LYS HE2 H 1 3.008 0.02 . 2 . . . A 45 LYS HE2 . 25652 1 21 . 1 1 5 5 LYS HE3 H 1 3.008 0.02 . 2 . . . A 45 LYS HE3 . 25652 1 22 . 1 1 5 5 LYS CA C 13 56.486 0.40 . 1 . . . A 45 LYS CA . 25652 1 23 . 1 1 5 5 LYS CB C 13 33.111 0.40 . 1 . . . A 45 LYS CB . 25652 1 24 . 1 1 5 5 LYS CG C 13 24.875 0.40 . 1 . . . A 45 LYS CG . 25652 1 25 . 1 1 5 5 LYS CD C 13 29.251 0.40 . 1 . . . A 45 LYS CD . 25652 1 26 . 1 1 5 5 LYS CE C 13 42.189 0.40 . 1 . . . A 45 LYS CE . 25652 1 27 . 1 1 5 5 LYS N N 15 122.562 0.40 . 1 . . . A 45 LYS N . 25652 1 28 . 1 1 6 6 LYS H H 1 8.047 0.02 . 1 . . . A 46 LYS H . 25652 1 29 . 1 1 6 6 LYS HA H 1 4.306 0.02 . 1 . . . A 46 LYS HA . 25652 1 30 . 1 1 6 6 LYS HB2 H 1 1.712 0.02 . 2 . . . A 46 LYS HB2 . 25652 1 31 . 1 1 6 6 LYS HB3 H 1 1.712 0.02 . 2 . . . A 46 LYS HB3 . 25652 1 32 . 1 1 6 6 LYS HG2 H 1 1.341 0.02 . 2 . . . A 46 LYS HG2 . 25652 1 33 . 1 1 6 6 LYS HG3 H 1 1.498 0.02 . 2 . . . A 46 LYS HG3 . 25652 1 34 . 1 1 6 6 LYS HD2 H 1 1.846 0.02 . 2 . . . A 46 LYS HD2 . 25652 1 35 . 1 1 6 6 LYS HD3 H 1 1.737 0.02 . 2 . . . A 46 LYS HD3 . 25652 1 36 . 1 1 6 6 LYS HE2 H 1 3.052 0.02 . 2 . . . A 46 LYS HE2 . 25652 1 37 . 1 1 6 6 LYS HE3 H 1 3.052 0.02 . 2 . . . A 46 LYS HE3 . 25652 1 38 . 1 1 6 6 LYS CA C 13 56.900 0.40 . 1 . . . A 46 LYS CA . 25652 1 39 . 1 1 6 6 LYS CB C 13 33.124 0.40 . 1 . . . A 46 LYS CB . 25652 1 40 . 1 1 6 6 LYS CG C 13 24.934 0.40 . 1 . . . A 46 LYS CG . 25652 1 41 . 1 1 6 6 LYS CD C 13 27.628 0.40 . 1 . . . A 46 LYS CD . 25652 1 42 . 1 1 6 6 LYS CE C 13 41.769 0.40 . 1 . . . A 46 LYS CE . 25652 1 43 . 1 1 6 6 LYS N N 15 121.127 0.40 . 1 . . . A 46 LYS N . 25652 1 44 . 1 1 7 7 PHE H H 1 8.164 0.02 . 1 . . . A 47 PHE H . 25652 1 45 . 1 1 7 7 PHE HA H 1 4.654 0.02 . 1 . . . A 47 PHE HA . 25652 1 46 . 1 1 7 7 PHE HB2 H 1 3.063 0.02 . 2 . . . A 47 PHE HB2 . 25652 1 47 . 1 1 7 7 PHE HB3 H 1 3.148 0.02 . 2 . . . A 47 PHE HB3 . 25652 1 48 . 1 1 7 7 PHE HD1 H 1 7.268 0.02 . 1 . . . A 47 PHE HD1 . 25652 1 49 . 1 1 7 7 PHE HD2 H 1 7.268 0.02 . 1 . . . A 47 PHE HD2 . 25652 1 50 . 1 1 7 7 PHE HE1 H 1 7.332 0.02 . 1 . . . A 47 PHE HE1 . 25652 1 51 . 1 1 7 7 PHE HE2 H 1 7.332 0.02 . 1 . . . A 47 PHE HE2 . 25652 1 52 . 1 1 7 7 PHE HZ H 1 7.284 0.02 . 1 . . . A 47 PHE HZ . 25652 1 53 . 1 1 7 7 PHE CA C 13 57.787 0.40 . 1 . . . A 47 PHE CA . 25652 1 54 . 1 1 7 7 PHE CB C 13 39.565 0.40 . 1 . . . A 47 PHE CB . 25652 1 55 . 1 1 7 7 PHE CD1 C 13 132.027 0.40 . 1 . . . A 47 PHE CD1 . 25652 1 56 . 1 1 7 7 PHE CE1 C 13 131.700 0.40 . 1 . . . A 47 PHE CE1 . 25652 1 57 . 1 1 7 7 PHE CZ C 13 129.874 0.40 . 1 . . . A 47 PHE CZ . 25652 1 58 . 1 1 7 7 PHE N N 15 120.886 0.40 . 1 . . . A 47 PHE N . 25652 1 59 . 1 1 8 8 LYS H H 1 8.210 0.02 . 1 . . . A 48 LYS H . 25652 1 60 . 1 1 8 8 LYS HA H 1 4.342 0.02 . 1 . . . A 48 LYS HA . 25652 1 61 . 1 1 8 8 LYS HB2 H 1 1.920 0.02 . 2 . . . A 48 LYS HB2 . 25652 1 62 . 1 1 8 8 LYS HB3 H 1 1.920 0.02 . 2 . . . A 48 LYS HB3 . 25652 1 63 . 1 1 8 8 LYS HG2 H 1 1.444 0.02 . 2 . . . A 48 LYS HG2 . 25652 1 64 . 1 1 8 8 LYS HG3 H 1 1.444 0.02 . 2 . . . A 48 LYS HG3 . 25652 1 65 . 1 1 8 8 LYS HD2 H 1 1.736 0.02 . 2 . . . A 48 LYS HD2 . 25652 1 66 . 1 1 8 8 LYS HD3 H 1 1.736 0.02 . 2 . . . A 48 LYS HD3 . 25652 1 67 . 1 1 8 8 LYS HE2 H 1 2.974 0.02 . 2 . . . A 48 LYS HE2 . 25652 1 68 . 1 1 8 8 LYS HE3 H 1 3.058 0.02 . 2 . . . A 48 LYS HE3 . 25652 1 69 . 1 1 8 8 LYS CA C 13 56.796 0.40 . 1 . . . A 48 LYS CA . 25652 1 70 . 1 1 8 8 LYS CB C 13 32.662 0.40 . 1 . . . A 48 LYS CB . 25652 1 71 . 1 1 8 8 LYS CG C 13 24.770 0.40 . 1 . . . A 48 LYS CG . 25652 1 72 . 1 1 8 8 LYS CD C 13 29.063 0.40 . 1 . . . A 48 LYS CD . 25652 1 73 . 1 1 8 8 LYS CE C 13 42.311 0.40 . 1 . . . A 48 LYS CE . 25652 1 74 . 1 1 8 8 LYS N N 15 123.526 0.40 . 1 . . . A 48 LYS N . 25652 1 75 . 1 1 9 9 GLY H H 1 7.874 0.02 . 1 . . . A 49 GLY H . 25652 1 76 . 1 1 9 9 GLY HA2 H 1 3.926 0.02 . 2 . . . A 49 GLY HA2 . 25652 1 77 . 1 1 9 9 GLY HA3 H 1 3.926 0.02 . 2 . . . A 49 GLY HA3 . 25652 1 78 . 1 1 9 9 GLY CA C 13 45.490 0.40 . 1 . . . A 49 GLY CA . 25652 1 79 . 1 1 9 9 GLY N N 15 109.273 0.40 . 1 . . . A 49 GLY N . 25652 1 80 . 1 1 10 10 ASP H H 1 8.232 0.02 . 1 . . . A 50 ASP H . 25652 1 81 . 1 1 10 10 ASP HA H 1 4.692 0.02 . 1 . . . A 50 ASP HA . 25652 1 82 . 1 1 10 10 ASP HB2 H 1 2.732 0.02 . 2 . . . A 50 ASP HB2 . 25652 1 83 . 1 1 10 10 ASP HB3 H 1 2.753 0.02 . 2 . . . A 50 ASP HB3 . 25652 1 84 . 1 1 10 10 ASP CA C 13 54.661 0.40 . 1 . . . A 50 ASP CA . 25652 1 85 . 1 1 10 10 ASP CB C 13 41.523 0.40 . 1 . . . A 50 ASP CB . 25652 1 86 . 1 1 10 10 ASP N N 15 120.470 0.40 . 1 . . . A 50 ASP N . 25652 1 87 . 1 1 11 11 SER H H 1 8.352 0.02 . 1 . . . A 51 SER H . 25652 1 88 . 1 1 11 11 SER HA H 1 4.469 0.02 . 1 . . . A 51 SER HA . 25652 1 89 . 1 1 11 11 SER HB2 H 1 3.931 0.02 . 2 . . . A 51 SER HB2 . 25652 1 90 . 1 1 11 11 SER HB3 H 1 3.931 0.02 . 2 . . . A 51 SER HB3 . 25652 1 91 . 1 1 11 11 SER CA C 13 58.951 0.40 . 1 . . . A 51 SER CA . 25652 1 92 . 1 1 11 11 SER CB C 13 63.803 0.40 . 1 . . . A 51 SER CB . 25652 1 93 . 1 1 11 11 SER N N 15 116.640 0.40 . 1 . . . A 51 SER N . 25652 1 94 . 1 1 12 12 ARG H H 1 8.365 0.02 . 1 . . . A 52 ARG H . 25652 1 95 . 1 1 12 12 ARG HA H 1 4.484 0.02 . 1 . . . A 52 ARG HA . 25652 1 96 . 1 1 12 12 ARG HB2 H 1 1.899 0.02 . 2 . . . A 52 ARG HB2 . 25652 1 97 . 1 1 12 12 ARG HB3 H 1 1.899 0.02 . 2 . . . A 52 ARG HB3 . 25652 1 98 . 1 1 12 12 ARG HG2 H 1 1.674 0.02 . 2 . . . A 52 ARG HG2 . 25652 1 99 . 1 1 12 12 ARG HG3 H 1 1.674 0.02 . 2 . . . A 52 ARG HG3 . 25652 1 100 . 1 1 12 12 ARG HD2 H 1 3.226 0.02 . 2 . . . A 52 ARG HD2 . 25652 1 101 . 1 1 12 12 ARG HD3 H 1 3.226 0.02 . 2 . . . A 52 ARG HD3 . 25652 1 102 . 1 1 12 12 ARG CB C 13 30.781 0.40 . 1 . . . A 52 ARG CB . 25652 1 103 . 1 1 12 12 ARG CG C 13 27.233 0.40 . 1 . . . A 52 ARG CG . 25652 1 104 . 1 1 12 12 ARG CD C 13 43.771 0.40 . 1 . . . A 52 ARG CD . 25652 1 105 . 1 1 12 12 ARG N N 15 122.697 0.40 . 1 . . . A 52 ARG N . 25652 1 106 . 1 1 13 13 SER H H 1 8.223 0.02 . 1 . . . A 53 SER H . 25652 1 107 . 1 1 13 13 SER HA H 1 4.514 0.02 . 1 . . . A 53 SER HA . 25652 1 108 . 1 1 13 13 SER HB2 H 1 3.931 0.02 . 2 . . . A 53 SER HB2 . 25652 1 109 . 1 1 13 13 SER HB3 H 1 3.931 0.02 . 2 . . . A 53 SER HB3 . 25652 1 110 . 1 1 13 13 SER CA C 13 58.530 0.40 . 1 . . . A 53 SER CA . 25652 1 111 . 1 1 13 13 SER CB C 13 63.965 0.40 . 1 . . . A 53 SER CB . 25652 1 112 . 1 1 13 13 SER N N 15 116.356 0.40 . 1 . . . A 53 SER N . 25652 1 113 . 1 1 14 14 ALA H H 1 8.299 0.02 . 1 . . . A 54 ALA H . 25652 1 114 . 1 1 14 14 ALA HA H 1 4.446 0.02 . 1 . . . A 54 ALA HA . 25652 1 115 . 1 1 14 14 ALA HB1 H 1 1.486 0.02 . 1 . . . A 54 ALA HB1 . 25652 1 116 . 1 1 14 14 ALA HB2 H 1 1.486 0.02 . 1 . . . A 54 ALA HB2 . 25652 1 117 . 1 1 14 14 ALA HB3 H 1 1.486 0.02 . 1 . . . A 54 ALA HB3 . 25652 1 118 . 1 1 14 14 ALA CA C 13 52.866 0.40 . 1 . . . A 54 ALA CA . 25652 1 119 . 1 1 14 14 ALA CB C 13 19.507 0.40 . 1 . . . A 54 ALA CB . 25652 1 120 . 1 1 14 14 ALA N N 15 125.938 0.40 . 1 . . . A 54 ALA N . 25652 1 121 . 1 1 15 15 GLY H H 1 8.288 0.02 . 1 . . . A 55 GLY H . 25652 1 122 . 1 1 15 15 GLY HA2 H 1 4.039 0.02 . 2 . . . A 55 GLY HA2 . 25652 1 123 . 1 1 15 15 GLY HA3 H 1 4.039 0.02 . 2 . . . A 55 GLY HA3 . 25652 1 124 . 1 1 15 15 GLY CA C 13 45.222 0.40 . 1 . . . A 55 GLY CA . 25652 1 125 . 1 1 15 15 GLY N N 15 107.428 0.40 . 1 . . . A 55 GLY N . 25652 1 126 . 1 1 16 16 VAL H H 1 7.907 0.02 . 1 . . . A 56 VAL H . 25652 1 127 . 1 1 16 16 VAL HA H 1 4.325 0.02 . 1 . . . A 56 VAL HA . 25652 1 128 . 1 1 16 16 VAL HB H 1 1.945 0.02 . 1 . . . A 56 VAL HB . 25652 1 129 . 1 1 16 16 VAL HG11 H 1 0.933 0.02 . 2 . . . A 56 VAL HG11 . 25652 1 130 . 1 1 16 16 VAL HG12 H 1 0.933 0.02 . 2 . . . A 56 VAL HG12 . 25652 1 131 . 1 1 16 16 VAL HG13 H 1 0.933 0.02 . 2 . . . A 56 VAL HG13 . 25652 1 132 . 1 1 16 16 VAL HG21 H 1 0.921 0.02 . 2 . . . A 56 VAL HG21 . 25652 1 133 . 1 1 16 16 VAL HG22 H 1 0.921 0.02 . 2 . . . A 56 VAL HG22 . 25652 1 134 . 1 1 16 16 VAL HG23 H 1 0.921 0.02 . 2 . . . A 56 VAL HG23 . 25652 1 135 . 1 1 16 16 VAL CA C 13 59.819 0.40 . 1 . . . A 56 VAL CA . 25652 1 136 . 1 1 16 16 VAL CB C 13 32.706 0.40 . 1 . . . A 56 VAL CB . 25652 1 137 . 1 1 16 16 VAL CG1 C 13 21.082 0.40 . 1 . . . A 56 VAL CG1 . 25652 1 138 . 1 1 16 16 VAL CG2 C 13 20.678 0.40 . 1 . . . A 56 VAL CG2 . 25652 1 139 . 1 1 16 16 VAL N N 15 120.989 0.40 . 1 . . . A 56 VAL N . 25652 1 140 . 1 1 17 17 PRO HA H 1 4.532 0.02 . 1 . . . A 57 PRO HA . 25652 1 141 . 1 1 17 17 PRO HB2 H 1 1.562 0.02 . 2 . . . A 57 PRO HB2 . 25652 1 142 . 1 1 17 17 PRO HB3 H 1 1.759 0.02 . 2 . . . A 57 PRO HB3 . 25652 1 143 . 1 1 17 17 PRO HG2 H 1 1.699 0.02 . 2 . . . A 57 PRO HG2 . 25652 1 144 . 1 1 17 17 PRO HG3 H 1 1.876 0.02 . 2 . . . A 57 PRO HG3 . 25652 1 145 . 1 1 17 17 PRO HD2 H 1 3.371 0.02 . 2 . . . A 57 PRO HD2 . 25652 1 146 . 1 1 17 17 PRO HD3 H 1 3.788 0.02 . 2 . . . A 57 PRO HD3 . 25652 1 147 . 1 1 17 17 PRO CA C 13 64.641 0.40 . 1 . . . A 57 PRO CA . 25652 1 148 . 1 1 17 17 PRO CB C 13 32.303 0.40 . 1 . . . A 57 PRO CB . 25652 1 149 . 1 1 17 17 PRO CG C 13 27.502 0.40 . 1 . . . A 57 PRO CG . 25652 1 150 . 1 1 17 17 PRO CD C 13 50.861 0.40 . 1 . . . A 57 PRO CD . 25652 1 151 . 1 1 18 18 SER H H 1 6.755 0.02 . 1 . . . A 58 SER H . 25652 1 152 . 1 1 18 18 SER HA H 1 4.627 0.02 . 1 . . . A 58 SER HA . 25652 1 153 . 1 1 18 18 SER HB2 H 1 3.974 0.02 . 2 . . . A 58 SER HB2 . 25652 1 154 . 1 1 18 18 SER HB3 H 1 4.108 0.02 . 2 . . . A 58 SER HB3 . 25652 1 155 . 1 1 18 18 SER CA C 13 55.867 0.40 . 1 . . . A 58 SER CA . 25652 1 156 . 1 1 18 18 SER CB C 13 65.207 0.40 . 1 . . . A 58 SER CB . 25652 1 157 . 1 1 18 18 SER N N 15 114.115 0.40 . 1 . . . A 58 SER N . 25652 1 158 . 1 1 19 19 ARG H H 1 8.697 0.02 . 1 . . . A 59 ARG H . 25652 1 159 . 1 1 19 19 ARG HA H 1 4.302 0.02 . 1 . . . A 59 ARG HA . 25652 1 160 . 1 1 19 19 ARG HB2 H 1 1.874 0.02 . 2 . . . A 59 ARG HB2 . 25652 1 161 . 1 1 19 19 ARG HB3 H 1 2.147 0.02 . 2 . . . A 59 ARG HB3 . 25652 1 162 . 1 1 19 19 ARG HG2 H 1 1.776 0.02 . 2 . . . A 59 ARG HG2 . 25652 1 163 . 1 1 19 19 ARG HG3 H 1 1.776 0.02 . 2 . . . A 59 ARG HG3 . 25652 1 164 . 1 1 19 19 ARG HD2 H 1 3.284 0.02 . 2 . . . A 59 ARG HD2 . 25652 1 165 . 1 1 19 19 ARG HD3 H 1 3.284 0.02 . 2 . . . A 59 ARG HD3 . 25652 1 166 . 1 1 19 19 ARG HE H 1 7.304 0.02 . 1 . . . A 59 ARG HE . 25652 1 167 . 1 1 19 19 ARG CA C 13 57.805 0.40 . 1 . . . A 59 ARG CA . 25652 1 168 . 1 1 19 19 ARG CB C 13 31.074 0.40 . 1 . . . A 59 ARG CB . 25652 1 169 . 1 1 19 19 ARG CG C 13 28.028 0.40 . 1 . . . A 59 ARG CG . 25652 1 170 . 1 1 19 19 ARG CD C 13 44.005 0.40 . 1 . . . A 59 ARG CD . 25652 1 171 . 1 1 19 19 ARG N N 15 119.824 0.40 . 1 . . . A 59 ARG N . 25652 1 172 . 1 1 19 19 ARG NE N 15 84.404 0.40 . 1 . . . A 59 ARG NE . 25652 1 173 . 1 1 20 20 VAL H H 1 8.803 0.02 . 1 . . . A 60 VAL H . 25652 1 174 . 1 1 20 20 VAL HA H 1 4.869 0.02 . 1 . . . A 60 VAL HA . 25652 1 175 . 1 1 20 20 VAL HB H 1 2.330 0.02 . 1 . . . A 60 VAL HB . 25652 1 176 . 1 1 20 20 VAL HG11 H 1 0.666 0.02 . 2 . . . A 60 VAL HG11 . 25652 1 177 . 1 1 20 20 VAL HG12 H 1 0.666 0.02 . 2 . . . A 60 VAL HG12 . 25652 1 178 . 1 1 20 20 VAL HG13 H 1 0.666 0.02 . 2 . . . A 60 VAL HG13 . 25652 1 179 . 1 1 20 20 VAL HG21 H 1 0.974 0.02 . 2 . . . A 60 VAL HG21 . 25652 1 180 . 1 1 20 20 VAL HG22 H 1 0.974 0.02 . 2 . . . A 60 VAL HG22 . 25652 1 181 . 1 1 20 20 VAL HG23 H 1 0.974 0.02 . 2 . . . A 60 VAL HG23 . 25652 1 182 . 1 1 20 20 VAL CA C 13 61.650 0.40 . 1 . . . A 60 VAL CA . 25652 1 183 . 1 1 20 20 VAL CB C 13 32.124 0.40 . 1 . . . A 60 VAL CB . 25652 1 184 . 1 1 20 20 VAL CG1 C 13 22.261 0.40 . 1 . . . A 60 VAL CG1 . 25652 1 185 . 1 1 20 20 VAL CG2 C 13 23.007 0.40 . 1 . . . A 60 VAL CG2 . 25652 1 186 . 1 1 20 20 VAL N N 15 119.347 0.40 . 1 . . . A 60 VAL N . 25652 1 187 . 1 1 21 21 ILE H H 1 9.495 0.02 . 1 . . . A 61 ILE H . 25652 1 188 . 1 1 21 21 ILE HA H 1 4.588 0.02 . 1 . . . A 61 ILE HA . 25652 1 189 . 1 1 21 21 ILE HB H 1 1.925 0.02 . 1 . . . A 61 ILE HB . 25652 1 190 . 1 1 21 21 ILE HG12 H 1 1.267 0.02 . 2 . . . A 61 ILE HG12 . 25652 1 191 . 1 1 21 21 ILE HG13 H 1 1.576 0.02 . 2 . . . A 61 ILE HG13 . 25652 1 192 . 1 1 21 21 ILE HG21 H 1 0.796 0.02 . 1 . . . A 61 ILE HG21 . 25652 1 193 . 1 1 21 21 ILE HG22 H 1 0.796 0.02 . 1 . . . A 61 ILE HG22 . 25652 1 194 . 1 1 21 21 ILE HG23 H 1 0.796 0.02 . 1 . . . A 61 ILE HG23 . 25652 1 195 . 1 1 21 21 ILE HD11 H 1 0.844 0.02 . 1 . . . A 61 ILE HD11 . 25652 1 196 . 1 1 21 21 ILE HD12 H 1 0.844 0.02 . 1 . . . A 61 ILE HD12 . 25652 1 197 . 1 1 21 21 ILE HD13 H 1 0.844 0.02 . 1 . . . A 61 ILE HD13 . 25652 1 198 . 1 1 21 21 ILE CA C 13 59.142 0.40 . 1 . . . A 61 ILE CA . 25652 1 199 . 1 1 21 21 ILE CB C 13 40.346 0.40 . 1 . . . A 61 ILE CB . 25652 1 200 . 1 1 21 21 ILE CG1 C 13 27.920 0.40 . 1 . . . A 61 ILE CG1 . 25652 1 201 . 1 1 21 21 ILE CG2 C 13 19.045 0.40 . 1 . . . A 61 ILE CG2 . 25652 1 202 . 1 1 21 21 ILE CD1 C 13 14.031 0.40 . 1 . . . A 61 ILE CD1 . 25652 1 203 . 1 1 21 21 ILE N N 15 129.046 0.40 . 1 . . . A 61 ILE N . 25652 1 204 . 1 1 22 22 HIS H H 1 9.304 0.02 . 1 . . . A 62 HIS H . 25652 1 205 . 1 1 22 22 HIS HA H 1 5.024 0.02 . 1 . . . A 62 HIS HA . 25652 1 206 . 1 1 22 22 HIS HB2 H 1 2.848 0.02 . 2 . . . A 62 HIS HB2 . 25652 1 207 . 1 1 22 22 HIS HB3 H 1 2.848 0.02 . 2 . . . A 62 HIS HB3 . 25652 1 208 . 1 1 22 22 HIS HD2 H 1 5.961 0.02 . 1 . . . A 62 HIS HD2 . 25652 1 209 . 1 1 22 22 HIS CB C 13 34.318 0.40 . 1 . . . A 62 HIS CB . 25652 1 210 . 1 1 22 22 HIS CD2 C 13 116.538 0.40 . 1 . . . A 62 HIS CD2 . 25652 1 211 . 1 1 22 22 HIS N N 15 128.103 0.40 . 1 . . . A 62 HIS N . 25652 1 212 . 1 1 23 23 ILE H H 1 8.587 0.02 . 1 . . . A 63 ILE H . 25652 1 213 . 1 1 23 23 ILE HA H 1 4.783 0.02 . 1 . . . A 63 ILE HA . 25652 1 214 . 1 1 23 23 ILE HB H 1 1.365 0.02 . 1 . . . A 63 ILE HB . 25652 1 215 . 1 1 23 23 ILE HG12 H 1 1.254 0.02 . 2 . . . A 63 ILE HG12 . 25652 1 216 . 1 1 23 23 ILE HG13 H 1 1.397 0.02 . 2 . . . A 63 ILE HG13 . 25652 1 217 . 1 1 23 23 ILE HG21 H 1 0.692 0.02 . 1 . . . A 63 ILE HG21 . 25652 1 218 . 1 1 23 23 ILE HG22 H 1 0.692 0.02 . 1 . . . A 63 ILE HG22 . 25652 1 219 . 1 1 23 23 ILE HG23 H 1 0.692 0.02 . 1 . . . A 63 ILE HG23 . 25652 1 220 . 1 1 23 23 ILE HD11 H 1 0.601 0.02 . 1 . . . A 63 ILE HD11 . 25652 1 221 . 1 1 23 23 ILE HD12 H 1 0.601 0.02 . 1 . . . A 63 ILE HD12 . 25652 1 222 . 1 1 23 23 ILE HD13 H 1 0.601 0.02 . 1 . . . A 63 ILE HD13 . 25652 1 223 . 1 1 23 23 ILE CA C 13 59.605 0.40 . 1 . . . A 63 ILE CA . 25652 1 224 . 1 1 23 23 ILE CB C 13 40.247 0.40 . 1 . . . A 63 ILE CB . 25652 1 225 . 1 1 23 23 ILE CG1 C 13 27.572 0.40 . 1 . . . A 63 ILE CG1 . 25652 1 226 . 1 1 23 23 ILE CG2 C 13 19.264 0.40 . 1 . . . A 63 ILE CG2 . 25652 1 227 . 1 1 23 23 ILE CD1 C 13 14.557 0.40 . 1 . . . A 63 ILE CD1 . 25652 1 228 . 1 1 23 23 ILE N N 15 127.360 0.40 . 1 . . . A 63 ILE N . 25652 1 229 . 1 1 24 24 ARG H H 1 8.607 0.02 . 1 . . . A 64 ARG H . 25652 1 230 . 1 1 24 24 ARG HA H 1 4.866 0.02 . 1 . . . A 64 ARG HA . 25652 1 231 . 1 1 24 24 ARG HB2 H 1 1.508 0.02 . 2 . . . A 64 ARG HB2 . 25652 1 232 . 1 1 24 24 ARG HB3 H 1 1.714 0.02 . 2 . . . A 64 ARG HB3 . 25652 1 233 . 1 1 24 24 ARG HG2 H 1 1.118 0.02 . 2 . . . A 64 ARG HG2 . 25652 1 234 . 1 1 24 24 ARG HG3 H 1 1.118 0.02 . 2 . . . A 64 ARG HG3 . 25652 1 235 . 1 1 24 24 ARG HD2 H 1 2.844 0.02 . 2 . . . A 64 ARG HD2 . 25652 1 236 . 1 1 24 24 ARG HD3 H 1 2.960 0.02 . 2 . . . A 64 ARG HD3 . 25652 1 237 . 1 1 24 24 ARG CA C 13 53.976 0.40 . 1 . . . A 64 ARG CA . 25652 1 238 . 1 1 24 24 ARG CB C 13 34.097 0.40 . 1 . . . A 64 ARG CB . 25652 1 239 . 1 1 24 24 ARG CG C 13 27.934 0.40 . 1 . . . A 64 ARG CG . 25652 1 240 . 1 1 24 24 ARG CD C 13 43.468 0.40 . 1 . . . A 64 ARG CD . 25652 1 241 . 1 1 24 24 ARG N N 15 122.183 0.40 . 1 . . . A 64 ARG N . 25652 1 242 . 1 1 25 25 LYS H H 1 8.468 0.02 . 1 . . . A 65 LYS H . 25652 1 243 . 1 1 25 25 LYS HA H 1 3.837 0.02 . 1 . . . A 65 LYS HA . 25652 1 244 . 1 1 25 25 LYS HB2 H 1 2.229 0.02 . 2 . . . A 65 LYS HB2 . 25652 1 245 . 1 1 25 25 LYS HB3 H 1 2.229 0.02 . 2 . . . A 65 LYS HB3 . 25652 1 246 . 1 1 25 25 LYS HG2 H 1 1.425 0.02 . 2 . . . A 65 LYS HG2 . 25652 1 247 . 1 1 25 25 LYS HG3 H 1 1.425 0.02 . 2 . . . A 65 LYS HG3 . 25652 1 248 . 1 1 25 25 LYS HD2 H 1 1.647 0.02 . 2 . . . A 65 LYS HD2 . 25652 1 249 . 1 1 25 25 LYS HD3 H 1 1.783 0.02 . 2 . . . A 65 LYS HD3 . 25652 1 250 . 1 1 25 25 LYS HE2 H 1 2.958 0.02 . 2 . . . A 65 LYS HE2 . 25652 1 251 . 1 1 25 25 LYS HE3 H 1 2.958 0.02 . 2 . . . A 65 LYS HE3 . 25652 1 252 . 1 1 25 25 LYS CA C 13 56.689 0.40 . 1 . . . A 65 LYS CA . 25652 1 253 . 1 1 25 25 LYS CB C 13 29.283 0.40 . 1 . . . A 65 LYS CB . 25652 1 254 . 1 1 25 25 LYS CG C 13 25.756 0.40 . 1 . . . A 65 LYS CG . 25652 1 255 . 1 1 25 25 LYS CD C 13 29.073 0.40 . 1 . . . A 65 LYS CD . 25652 1 256 . 1 1 25 25 LYS CE C 13 41.680 0.40 . 1 . . . A 65 LYS CE . 25652 1 257 . 1 1 25 25 LYS N N 15 114.245 0.40 . 1 . . . A 65 LYS N . 25652 1 258 . 1 1 26 26 LEU H H 1 7.784 0.02 . 1 . . . A 66 LEU H . 25652 1 259 . 1 1 26 26 LEU HA H 1 4.104 0.02 . 1 . . . A 66 LEU HA . 25652 1 260 . 1 1 26 26 LEU HB2 H 1 1.171 0.02 . 2 . . . A 66 LEU HB2 . 25652 1 261 . 1 1 26 26 LEU HB3 H 1 1.171 0.02 . 2 . . . A 66 LEU HB3 . 25652 1 262 . 1 1 26 26 LEU HD11 H 1 0.510 0.02 . 2 . . . A 66 LEU HD11 . 25652 1 263 . 1 1 26 26 LEU HD12 H 1 0.510 0.02 . 2 . . . A 66 LEU HD12 . 25652 1 264 . 1 1 26 26 LEU HD13 H 1 0.510 0.02 . 2 . . . A 66 LEU HD13 . 25652 1 265 . 1 1 26 26 LEU HD21 H 1 0.675 0.02 . 2 . . . A 66 LEU HD21 . 25652 1 266 . 1 1 26 26 LEU HD22 H 1 0.675 0.02 . 2 . . . A 66 LEU HD22 . 25652 1 267 . 1 1 26 26 LEU HD23 H 1 0.675 0.02 . 2 . . . A 66 LEU HD23 . 25652 1 268 . 1 1 26 26 LEU CA C 13 53.570 0.40 . 1 . . . A 66 LEU CA . 25652 1 269 . 1 1 26 26 LEU CB C 13 41.907 0.40 . 1 . . . A 66 LEU CB . 25652 1 270 . 1 1 26 26 LEU CD1 C 13 26.331 0.40 . 1 . . . A 66 LEU CD1 . 25652 1 271 . 1 1 26 26 LEU CD2 C 13 24.873 0.40 . 1 . . . A 66 LEU CD2 . 25652 1 272 . 1 1 26 26 LEU N N 15 115.973 0.40 . 1 . . . A 66 LEU N . 25652 1 273 . 1 1 27 27 PRO HA H 1 4.517 0.02 . 1 . . . A 67 PRO HA . 25652 1 274 . 1 1 27 27 PRO HB2 H 1 1.901 0.02 . 2 . . . A 67 PRO HB2 . 25652 1 275 . 1 1 27 27 PRO HB3 H 1 2.392 0.02 . 2 . . . A 67 PRO HB3 . 25652 1 276 . 1 1 27 27 PRO HG2 H 1 1.744 0.02 . 2 . . . A 67 PRO HG2 . 25652 1 277 . 1 1 27 27 PRO HG3 H 1 1.957 0.02 . 2 . . . A 67 PRO HG3 . 25652 1 278 . 1 1 27 27 PRO HD2 H 1 3.219 0.02 . 2 . . . A 67 PRO HD2 . 25652 1 279 . 1 1 27 27 PRO HD3 H 1 3.718 0.02 . 2 . . . A 67 PRO HD3 . 25652 1 280 . 1 1 27 27 PRO CA C 13 62.355 0.40 . 1 . . . A 67 PRO CA . 25652 1 281 . 1 1 27 27 PRO CG C 13 27.384 0.40 . 1 . . . A 67 PRO CG . 25652 1 282 . 1 1 27 27 PRO CD C 13 49.875 0.40 . 1 . . . A 67 PRO CD . 25652 1 283 . 1 1 28 28 ILE H H 1 8.387 0.02 . 1 . . . A 68 ILE H . 25652 1 284 . 1 1 28 28 ILE HA H 1 3.922 0.02 . 1 . . . A 68 ILE HA . 25652 1 285 . 1 1 28 28 ILE HB H 1 1.903 0.02 . 1 . . . A 68 ILE HB . 25652 1 286 . 1 1 28 28 ILE HG12 H 1 1.328 0.02 . 2 . . . A 68 ILE HG12 . 25652 1 287 . 1 1 28 28 ILE HG13 H 1 1.530 0.02 . 2 . . . A 68 ILE HG13 . 25652 1 288 . 1 1 28 28 ILE HG21 H 1 1.001 0.02 . 1 . . . A 68 ILE HG21 . 25652 1 289 . 1 1 28 28 ILE HG22 H 1 1.001 0.02 . 1 . . . A 68 ILE HG22 . 25652 1 290 . 1 1 28 28 ILE HG23 H 1 1.001 0.02 . 1 . . . A 68 ILE HG23 . 25652 1 291 . 1 1 28 28 ILE HD11 H 1 0.983 0.02 . 1 . . . A 68 ILE HD11 . 25652 1 292 . 1 1 28 28 ILE HD12 H 1 0.983 0.02 . 1 . . . A 68 ILE HD12 . 25652 1 293 . 1 1 28 28 ILE HD13 H 1 0.983 0.02 . 1 . . . A 68 ILE HD13 . 25652 1 294 . 1 1 28 28 ILE CA C 13 63.187 0.40 . 1 . . . A 68 ILE CA . 25652 1 295 . 1 1 28 28 ILE CB C 13 38.439 0.40 . 1 . . . A 68 ILE CB . 25652 1 296 . 1 1 28 28 ILE CG1 C 13 28.035 0.40 . 1 . . . A 68 ILE CG1 . 25652 1 297 . 1 1 28 28 ILE CG2 C 13 17.617 0.40 . 1 . . . A 68 ILE CG2 . 25652 1 298 . 1 1 28 28 ILE CD1 C 13 13.784 0.40 . 1 . . . A 68 ILE CD1 . 25652 1 299 . 1 1 28 28 ILE N N 15 121.007 0.40 . 1 . . . A 68 ILE N . 25652 1 300 . 1 1 29 29 ASP H H 1 8.363 0.02 . 1 . . . A 69 ASP H . 25652 1 301 . 1 1 29 29 ASP HA H 1 4.578 0.02 . 1 . . . A 69 ASP HA . 25652 1 302 . 1 1 29 29 ASP HB2 H 1 2.679 0.02 . 2 . . . A 69 ASP HB2 . 25652 1 303 . 1 1 29 29 ASP HB3 H 1 2.886 0.02 . 2 . . . A 69 ASP HB3 . 25652 1 304 . 1 1 29 29 ASP CA C 13 53.588 0.40 . 1 . . . A 69 ASP CA . 25652 1 305 . 1 1 29 29 ASP CB C 13 39.613 0.40 . 1 . . . A 69 ASP CB . 25652 1 306 . 1 1 29 29 ASP N N 15 117.859 0.40 . 1 . . . A 69 ASP N . 25652 1 307 . 1 1 30 30 VAL H H 1 7.002 0.02 . 1 . . . A 70 VAL H . 25652 1 308 . 1 1 30 30 VAL HA H 1 4.051 0.02 . 1 . . . A 70 VAL HA . 25652 1 309 . 1 1 30 30 VAL HB H 1 2.042 0.02 . 1 . . . A 70 VAL HB . 25652 1 310 . 1 1 30 30 VAL HG11 H 1 0.793 0.02 . 2 . . . A 70 VAL HG11 . 25652 1 311 . 1 1 30 30 VAL HG12 H 1 0.793 0.02 . 2 . . . A 70 VAL HG12 . 25652 1 312 . 1 1 30 30 VAL HG13 H 1 0.793 0.02 . 2 . . . A 70 VAL HG13 . 25652 1 313 . 1 1 30 30 VAL HG21 H 1 1.098 0.02 . 2 . . . A 70 VAL HG21 . 25652 1 314 . 1 1 30 30 VAL HG22 H 1 1.098 0.02 . 2 . . . A 70 VAL HG22 . 25652 1 315 . 1 1 30 30 VAL HG23 H 1 1.098 0.02 . 2 . . . A 70 VAL HG23 . 25652 1 316 . 1 1 30 30 VAL CA C 13 62.118 0.40 . 1 . . . A 70 VAL CA . 25652 1 317 . 1 1 30 30 VAL CB C 13 32.002 0.40 . 1 . . . A 70 VAL CB . 25652 1 318 . 1 1 30 30 VAL CG1 C 13 20.915 0.40 . 1 . . . A 70 VAL CG1 . 25652 1 319 . 1 1 30 30 VAL CG2 C 13 23.257 0.40 . 1 . . . A 70 VAL CG2 . 25652 1 320 . 1 1 30 30 VAL N N 15 117.787 0.40 . 1 . . . A 70 VAL N . 25652 1 321 . 1 1 31 31 THR H H 1 8.138 0.02 . 1 . . . A 71 THR H . 25652 1 322 . 1 1 31 31 THR HA H 1 4.700 0.02 . 1 . . . A 71 THR HA . 25652 1 323 . 1 1 31 31 THR HB H 1 4.623 0.02 . 1 . . . A 71 THR HB . 25652 1 324 . 1 1 31 31 THR HG21 H 1 1.323 0.02 . 1 . . . A 71 THR HG21 . 25652 1 325 . 1 1 31 31 THR HG22 H 1 1.323 0.02 . 1 . . . A 71 THR HG22 . 25652 1 326 . 1 1 31 31 THR HG23 H 1 1.323 0.02 . 1 . . . A 71 THR HG23 . 25652 1 327 . 1 1 31 31 THR CA C 13 60.279 0.40 . 1 . . . A 71 THR CA . 25652 1 328 . 1 1 31 31 THR CB C 13 72.639 0.40 . 1 . . . A 71 THR CB . 25652 1 329 . 1 1 31 31 THR CG2 C 13 21.905 0.40 . 1 . . . A 71 THR CG2 . 25652 1 330 . 1 1 31 31 THR N N 15 115.673 0.40 . 1 . . . A 71 THR N . 25652 1 331 . 1 1 32 32 GLU H H 1 9.653 0.02 . 1 . . . A 72 GLU H . 25652 1 332 . 1 1 32 32 GLU HA H 1 3.951 0.02 . 1 . . . A 72 GLU HA . 25652 1 333 . 1 1 32 32 GLU HB2 H 1 1.718 0.02 . 2 . . . A 72 GLU HB2 . 25652 1 334 . 1 1 32 32 GLU HB3 H 1 2.111 0.02 . 2 . . . A 72 GLU HB3 . 25652 1 335 . 1 1 32 32 GLU HG2 H 1 2.455 0.02 . 2 . . . A 72 GLU HG2 . 25652 1 336 . 1 1 32 32 GLU HG3 H 1 2.363 0.02 . 2 . . . A 72 GLU HG3 . 25652 1 337 . 1 1 32 32 GLU CA C 13 61.505 0.40 . 1 . . . A 72 GLU CA . 25652 1 338 . 1 1 32 32 GLU CB C 13 29.110 0.40 . 1 . . . A 72 GLU CB . 25652 1 339 . 1 1 32 32 GLU CG C 13 37.924 0.40 . 1 . . . A 72 GLU CG . 25652 1 340 . 1 1 32 32 GLU N N 15 121.506 0.40 . 1 . . . A 72 GLU N . 25652 1 341 . 1 1 33 33 GLY H H 1 8.802 0.02 . 1 . . . A 73 GLY H . 25652 1 342 . 1 1 33 33 GLY HA2 H 1 3.756 0.02 . 2 . . . A 73 GLY HA2 . 25652 1 343 . 1 1 33 33 GLY HA3 H 1 3.958 0.02 . 2 . . . A 73 GLY HA3 . 25652 1 344 . 1 1 33 33 GLY CA C 13 47.190 0.40 . 1 . . . A 73 GLY CA . 25652 1 345 . 1 1 33 33 GLY N N 15 104.499 0.40 . 1 . . . A 73 GLY N . 25652 1 346 . 1 1 34 34 GLU H H 1 7.631 0.02 . 1 . . . A 74 GLU H . 25652 1 347 . 1 1 34 34 GLU HA H 1 4.021 0.02 . 1 . . . A 74 GLU HA . 25652 1 348 . 1 1 34 34 GLU HB2 H 1 1.957 0.02 . 2 . . . A 74 GLU HB2 . 25652 1 349 . 1 1 34 34 GLU HB3 H 1 2.416 0.02 . 2 . . . A 74 GLU HB3 . 25652 1 350 . 1 1 34 34 GLU HG2 H 1 2.297 0.02 . 2 . . . A 74 GLU HG2 . 25652 1 351 . 1 1 34 34 GLU HG3 H 1 2.297 0.02 . 2 . . . A 74 GLU HG3 . 25652 1 352 . 1 1 34 34 GLU CA C 13 59.269 0.40 . 1 . . . A 74 GLU CA . 25652 1 353 . 1 1 34 34 GLU CB C 13 30.860 0.40 . 1 . . . A 74 GLU CB . 25652 1 354 . 1 1 34 34 GLU CG C 13 38.339 0.40 . 1 . . . A 74 GLU CG . 25652 1 355 . 1 1 34 34 GLU N N 15 121.341 0.40 . 1 . . . A 74 GLU N . 25652 1 356 . 1 1 35 35 VAL H H 1 7.454 0.02 . 1 . . . A 75 VAL H . 25652 1 357 . 1 1 35 35 VAL HA H 1 3.503 0.02 . 1 . . . A 75 VAL HA . 25652 1 358 . 1 1 35 35 VAL HB H 1 2.127 0.02 . 1 . . . A 75 VAL HB . 25652 1 359 . 1 1 35 35 VAL HG11 H 1 0.706 0.02 . 2 . . . A 75 VAL HG11 . 25652 1 360 . 1 1 35 35 VAL HG12 H 1 0.706 0.02 . 2 . . . A 75 VAL HG12 . 25652 1 361 . 1 1 35 35 VAL HG13 H 1 0.706 0.02 . 2 . . . A 75 VAL HG13 . 25652 1 362 . 1 1 35 35 VAL HG21 H 1 0.876 0.02 . 2 . . . A 75 VAL HG21 . 25652 1 363 . 1 1 35 35 VAL HG22 H 1 0.876 0.02 . 2 . . . A 75 VAL HG22 . 25652 1 364 . 1 1 35 35 VAL HG23 H 1 0.876 0.02 . 2 . . . A 75 VAL HG23 . 25652 1 365 . 1 1 35 35 VAL CA C 13 66.940 0.40 . 1 . . . A 75 VAL CA . 25652 1 366 . 1 1 35 35 VAL CB C 13 31.332 0.40 . 1 . . . A 75 VAL CB . 25652 1 367 . 1 1 35 35 VAL CG1 C 13 22.721 0.40 . 1 . . . A 75 VAL CG1 . 25652 1 368 . 1 1 35 35 VAL CG2 C 13 24.081 0.40 . 1 . . . A 75 VAL CG2 . 25652 1 369 . 1 1 35 35 VAL N N 15 119.029 0.40 . 1 . . . A 75 VAL N . 25652 1 370 . 1 1 36 36 ILE H H 1 8.381 0.02 . 1 . . . A 76 ILE H . 25652 1 371 . 1 1 36 36 ILE HA H 1 3.591 0.02 . 1 . . . A 76 ILE HA . 25652 1 372 . 1 1 36 36 ILE HB H 1 1.894 0.02 . 1 . . . A 76 ILE HB . 25652 1 373 . 1 1 36 36 ILE HG12 H 1 1.867 0.02 . 2 . . . A 76 ILE HG12 . 25652 1 374 . 1 1 36 36 ILE HG13 H 1 0.993 0.02 . 2 . . . A 76 ILE HG13 . 25652 1 375 . 1 1 36 36 ILE HG21 H 1 1.000 0.02 . 1 . . . A 76 ILE HG21 . 25652 1 376 . 1 1 36 36 ILE HG22 H 1 1.000 0.02 . 1 . . . A 76 ILE HG22 . 25652 1 377 . 1 1 36 36 ILE HG23 H 1 1.000 0.02 . 1 . . . A 76 ILE HG23 . 25652 1 378 . 1 1 36 36 ILE HD11 H 1 0.820 0.02 . 1 . . . A 76 ILE HD11 . 25652 1 379 . 1 1 36 36 ILE HD12 H 1 0.820 0.02 . 1 . . . A 76 ILE HD12 . 25652 1 380 . 1 1 36 36 ILE HD13 H 1 0.820 0.02 . 1 . . . A 76 ILE HD13 . 25652 1 381 . 1 1 36 36 ILE CA C 13 66.091 0.40 . 1 . . . A 76 ILE CA . 25652 1 382 . 1 1 36 36 ILE CB C 13 38.465 0.40 . 1 . . . A 76 ILE CB . 25652 1 383 . 1 1 36 36 ILE CG1 C 13 30.694 0.40 . 1 . . . A 76 ILE CG1 . 25652 1 384 . 1 1 36 36 ILE CG2 C 13 17.609 0.40 . 1 . . . A 76 ILE CG2 . 25652 1 385 . 1 1 36 36 ILE CD1 C 13 14.424 0.40 . 1 . . . A 76 ILE CD1 . 25652 1 386 . 1 1 36 36 ILE N N 15 118.098 0.40 . 1 . . . A 76 ILE N . 25652 1 387 . 1 1 37 37 SER H H 1 7.890 0.02 . 1 . . . A 77 SER H . 25652 1 388 . 1 1 37 37 SER HA H 1 4.101 0.02 . 1 . . . A 77 SER HA . 25652 1 389 . 1 1 37 37 SER HB2 H 1 4.083 0.02 . 2 . . . A 77 SER HB2 . 25652 1 390 . 1 1 37 37 SER HB3 H 1 4.083 0.02 . 2 . . . A 77 SER HB3 . 25652 1 391 . 1 1 37 37 SER CA C 13 62.431 0.40 . 1 . . . A 77 SER CA . 25652 1 392 . 1 1 37 37 SER CB C 13 63.006 0.40 . 1 . . . A 77 SER CB . 25652 1 393 . 1 1 37 37 SER N N 15 113.730 0.40 . 1 . . . A 77 SER N . 25652 1 394 . 1 1 38 38 LEU H H 1 7.518 0.02 . 1 . . . A 78 LEU H . 25652 1 395 . 1 1 38 38 LEU HA H 1 4.342 0.02 . 1 . . . A 78 LEU HA . 25652 1 396 . 1 1 38 38 LEU HB2 H 1 1.284 0.02 . 2 . . . A 78 LEU HB2 . 25652 1 397 . 1 1 38 38 LEU HB3 H 1 2.012 0.02 . 2 . . . A 78 LEU HB3 . 25652 1 398 . 1 1 38 38 LEU HG H 1 1.995 0.02 . 1 . . . A 78 LEU HG . 25652 1 399 . 1 1 38 38 LEU HD11 H 1 0.754 0.02 . 2 . . . A 78 LEU HD11 . 25652 1 400 . 1 1 38 38 LEU HD12 H 1 0.754 0.02 . 2 . . . A 78 LEU HD12 . 25652 1 401 . 1 1 38 38 LEU HD13 H 1 0.754 0.02 . 2 . . . A 78 LEU HD13 . 25652 1 402 . 1 1 38 38 LEU HD21 H 1 0.759 0.02 . 2 . . . A 78 LEU HD21 . 25652 1 403 . 1 1 38 38 LEU HD22 H 1 0.759 0.02 . 2 . . . A 78 LEU HD22 . 25652 1 404 . 1 1 38 38 LEU HD23 H 1 0.759 0.02 . 2 . . . A 78 LEU HD23 . 25652 1 405 . 1 1 38 38 LEU CA C 13 56.973 0.40 . 1 . . . A 78 LEU CA . 25652 1 406 . 1 1 38 38 LEU CB C 13 42.811 0.40 . 1 . . . A 78 LEU CB . 25652 1 407 . 1 1 38 38 LEU CG C 13 26.450 0.40 . 1 . . . A 78 LEU CG . 25652 1 408 . 1 1 38 38 LEU CD1 C 13 26.306 0.40 . 1 . . . A 78 LEU CD1 . 25652 1 409 . 1 1 38 38 LEU CD2 C 13 22.229 0.40 . 1 . . . A 78 LEU CD2 . 25652 1 410 . 1 1 38 38 LEU N N 15 119.724 0.40 . 1 . . . A 78 LEU N . 25652 1 411 . 1 1 39 39 GLY H H 1 7.949 0.02 . 1 . . . A 79 GLY H . 25652 1 412 . 1 1 39 39 GLY HA2 H 1 3.482 0.02 . 2 . . . A 79 GLY HA2 . 25652 1 413 . 1 1 39 39 GLY HA3 H 1 5.081 0.02 . 2 . . . A 79 GLY HA3 . 25652 1 414 . 1 1 39 39 GLY CA C 13 46.081 0.40 . 1 . . . A 79 GLY CA . 25652 1 415 . 1 1 39 39 GLY N N 15 102.110 0.40 . 1 . . . A 79 GLY N . 25652 1 416 . 1 1 40 40 LEU H H 1 7.163 0.02 . 1 . . . A 80 LEU H . 25652 1 417 . 1 1 40 40 LEU HA H 1 4.661 0.02 . 1 . . . A 80 LEU HA . 25652 1 418 . 1 1 40 40 LEU HB2 H 1 1.609 0.02 . 2 . . . A 80 LEU HB2 . 25652 1 419 . 1 1 40 40 LEU HB3 H 1 1.872 0.02 . 2 . . . A 80 LEU HB3 . 25652 1 420 . 1 1 40 40 LEU HG H 1 1.949 0.02 . 1 . . . A 80 LEU HG . 25652 1 421 . 1 1 40 40 LEU HD11 H 1 1.006 0.02 . 2 . . . A 80 LEU HD11 . 25652 1 422 . 1 1 40 40 LEU HD12 H 1 1.006 0.02 . 2 . . . A 80 LEU HD12 . 25652 1 423 . 1 1 40 40 LEU HD13 H 1 1.006 0.02 . 2 . . . A 80 LEU HD13 . 25652 1 424 . 1 1 40 40 LEU HD21 H 1 0.989 0.02 . 2 . . . A 80 LEU HD21 . 25652 1 425 . 1 1 40 40 LEU HD22 H 1 0.989 0.02 . 2 . . . A 80 LEU HD22 . 25652 1 426 . 1 1 40 40 LEU HD23 H 1 0.989 0.02 . 2 . . . A 80 LEU HD23 . 25652 1 427 . 1 1 40 40 LEU CA C 13 57.847 0.40 . 1 . . . A 80 LEU CA . 25652 1 428 . 1 1 40 40 LEU CB C 13 40.388 0.40 . 1 . . . A 80 LEU CB . 25652 1 429 . 1 1 40 40 LEU CG C 13 26.184 0.40 . 1 . . . A 80 LEU CG . 25652 1 430 . 1 1 40 40 LEU CD1 C 13 25.483 0.40 . 1 . . . A 80 LEU CD1 . 25652 1 431 . 1 1 40 40 LEU CD2 C 13 22.637 0.40 . 1 . . . A 80 LEU CD2 . 25652 1 432 . 1 1 40 40 LEU N N 15 119.851 0.40 . 1 . . . A 80 LEU N . 25652 1 433 . 1 1 41 41 PRO HA H 1 4.127 0.02 . 1 . . . A 81 PRO HA . 25652 1 434 . 1 1 41 41 PRO HB2 H 1 -0.001 0.02 . 2 . . . A 81 PRO HB2 . 25652 1 435 . 1 1 41 41 PRO HB3 H 1 1.805 0.02 . 2 . . . A 81 PRO HB3 . 25652 1 436 . 1 1 41 41 PRO HG2 H 1 2.229 0.02 . 2 . . . A 81 PRO HG2 . 25652 1 437 . 1 1 41 41 PRO HG3 H 1 1.731 0.02 . 2 . . . A 81 PRO HG3 . 25652 1 438 . 1 1 41 41 PRO HD2 H 1 3.159 0.02 . 2 . . . A 81 PRO HD2 . 25652 1 439 . 1 1 41 41 PRO HD3 H 1 3.833 0.02 . 2 . . . A 81 PRO HD3 . 25652 1 440 . 1 1 41 41 PRO CA C 13 64.817 0.40 . 1 . . . A 81 PRO CA . 25652 1 441 . 1 1 41 41 PRO CB C 13 30.745 0.40 . 1 . . . A 81 PRO CB . 25652 1 442 . 1 1 41 41 PRO CG C 13 28.928 0.40 . 1 . . . A 81 PRO CG . 25652 1 443 . 1 1 41 41 PRO CD C 13 51.309 0.40 . 1 . . . A 81 PRO CD . 25652 1 444 . 1 1 42 42 PHE H H 1 7.780 0.02 . 1 . . . A 82 PHE H . 25652 1 445 . 1 1 42 42 PHE HA H 1 4.491 0.02 . 1 . . . A 82 PHE HA . 25652 1 446 . 1 1 42 42 PHE HB2 H 1 3.529 0.02 . 2 . . . A 82 PHE HB2 . 25652 1 447 . 1 1 42 42 PHE HB3 H 1 2.790 0.02 . 2 . . . A 82 PHE HB3 . 25652 1 448 . 1 1 42 42 PHE HD1 H 1 7.305 0.02 . 1 . . . A 82 PHE HD1 . 25652 1 449 . 1 1 42 42 PHE HD2 H 1 7.305 0.02 . 1 . . . A 82 PHE HD2 . 25652 1 450 . 1 1 42 42 PHE HE1 H 1 7.150 0.02 . 1 . . . A 82 PHE HE1 . 25652 1 451 . 1 1 42 42 PHE HE2 H 1 7.150 0.02 . 1 . . . A 82 PHE HE2 . 25652 1 452 . 1 1 42 42 PHE HZ H 1 6.169 0.02 . 1 . . . A 82 PHE HZ . 25652 1 453 . 1 1 42 42 PHE CA C 13 58.225 0.40 . 1 . . . A 82 PHE CA . 25652 1 454 . 1 1 42 42 PHE CB C 13 40.814 0.40 . 1 . . . A 82 PHE CB . 25652 1 455 . 1 1 42 42 PHE CD2 C 13 131.864 0.40 . 1 . . . A 82 PHE CD2 . 25652 1 456 . 1 1 42 42 PHE CE2 C 13 131.430 0.40 . 1 . . . A 82 PHE CE2 . 25652 1 457 . 1 1 42 42 PHE CZ C 13 129.709 0.40 . 1 . . . A 82 PHE CZ . 25652 1 458 . 1 1 42 42 PHE N N 15 112.312 0.40 . 1 . . . A 82 PHE N . 25652 1 459 . 1 1 43 43 GLY H H 1 7.619 0.02 . 1 . . . A 83 GLY H . 25652 1 460 . 1 1 43 43 GLY HA2 H 1 4.027 0.02 . 2 . . . A 83 GLY HA2 . 25652 1 461 . 1 1 43 43 GLY HA3 H 1 4.053 0.02 . 2 . . . A 83 GLY HA3 . 25652 1 462 . 1 1 43 43 GLY CA C 13 45.626 0.40 . 1 . . . A 83 GLY CA . 25652 1 463 . 1 1 43 43 GLY N N 15 106.373 0.40 . 1 . . . A 83 GLY N . 25652 1 464 . 1 1 44 44 LYS H H 1 7.477 0.02 . 1 . . . A 84 LYS H . 25652 1 465 . 1 1 44 44 LYS HA H 1 4.495 0.02 . 1 . . . A 84 LYS HA . 25652 1 466 . 1 1 44 44 LYS HB2 H 1 1.592 0.02 . 2 . . . A 84 LYS HB2 . 25652 1 467 . 1 1 44 44 LYS HB3 H 1 1.673 0.02 . 2 . . . A 84 LYS HB3 . 25652 1 468 . 1 1 44 44 LYS HG2 H 1 1.289 0.02 . 2 . . . A 84 LYS HG2 . 25652 1 469 . 1 1 44 44 LYS HG3 H 1 1.486 0.02 . 2 . . . A 84 LYS HG3 . 25652 1 470 . 1 1 44 44 LYS HD2 H 1 1.641 0.02 . 2 . . . A 84 LYS HD2 . 25652 1 471 . 1 1 44 44 LYS HD3 H 1 1.641 0.02 . 2 . . . A 84 LYS HD3 . 25652 1 472 . 1 1 44 44 LYS HE2 H 1 3.009 0.02 . 2 . . . A 84 LYS HE2 . 25652 1 473 . 1 1 44 44 LYS HE3 H 1 3.009 0.02 . 2 . . . A 84 LYS HE3 . 25652 1 474 . 1 1 44 44 LYS CA C 13 55.108 0.40 . 1 . . . A 84 LYS CA . 25652 1 475 . 1 1 44 44 LYS CB C 13 34.061 0.40 . 1 . . . A 84 LYS CB . 25652 1 476 . 1 1 44 44 LYS CG C 13 24.950 0.40 . 1 . . . A 84 LYS CG . 25652 1 477 . 1 1 44 44 LYS CD C 13 29.270 0.40 . 1 . . . A 84 LYS CD . 25652 1 478 . 1 1 44 44 LYS CE C 13 42.313 0.40 . 1 . . . A 84 LYS CE . 25652 1 479 . 1 1 44 44 LYS N N 15 118.665 0.40 . 1 . . . A 84 LYS N . 25652 1 480 . 1 1 45 45 VAL H H 1 8.229 0.02 . 1 . . . A 85 VAL H . 25652 1 481 . 1 1 45 45 VAL HA H 1 4.669 0.02 . 1 . . . A 85 VAL HA . 25652 1 482 . 1 1 45 45 VAL HB H 1 2.038 0.02 . 1 . . . A 85 VAL HB . 25652 1 483 . 1 1 45 45 VAL HG11 H 1 1.038 0.02 . 2 . . . A 85 VAL HG11 . 25652 1 484 . 1 1 45 45 VAL HG12 H 1 1.038 0.02 . 2 . . . A 85 VAL HG12 . 25652 1 485 . 1 1 45 45 VAL HG13 H 1 1.038 0.02 . 2 . . . A 85 VAL HG13 . 25652 1 486 . 1 1 45 45 VAL HG21 H 1 1.163 0.02 . 2 . . . A 85 VAL HG21 . 25652 1 487 . 1 1 45 45 VAL HG22 H 1 1.163 0.02 . 2 . . . A 85 VAL HG22 . 25652 1 488 . 1 1 45 45 VAL HG23 H 1 1.163 0.02 . 2 . . . A 85 VAL HG23 . 25652 1 489 . 1 1 45 45 VAL CA C 13 61.950 0.40 . 1 . . . A 85 VAL CA . 25652 1 490 . 1 1 45 45 VAL CB C 13 32.297 0.40 . 1 . . . A 85 VAL CB . 25652 1 491 . 1 1 45 45 VAL CG1 C 13 22.353 0.40 . 1 . . . A 85 VAL CG1 . 25652 1 492 . 1 1 45 45 VAL CG2 C 13 21.002 0.40 . 1 . . . A 85 VAL CG2 . 25652 1 493 . 1 1 45 45 VAL N N 15 126.117 0.40 . 1 . . . A 85 VAL N . 25652 1 494 . 1 1 46 46 THR H H 1 9.217 0.02 . 1 . . . A 86 THR H . 25652 1 495 . 1 1 46 46 THR HA H 1 4.322 0.02 . 1 . . . A 86 THR HA . 25652 1 496 . 1 1 46 46 THR HB H 1 4.254 0.02 . 1 . . . A 86 THR HB . 25652 1 497 . 1 1 46 46 THR HG21 H 1 1.087 0.02 . 1 . . . A 86 THR HG21 . 25652 1 498 . 1 1 46 46 THR HG22 H 1 1.087 0.02 . 1 . . . A 86 THR HG22 . 25652 1 499 . 1 1 46 46 THR HG23 H 1 1.087 0.02 . 1 . . . A 86 THR HG23 . 25652 1 500 . 1 1 46 46 THR CA C 13 62.949 0.40 . 1 . . . A 86 THR CA . 25652 1 501 . 1 1 46 46 THR CB C 13 68.640 0.40 . 1 . . . A 86 THR CB . 25652 1 502 . 1 1 46 46 THR CG2 C 13 22.589 0.40 . 1 . . . A 86 THR CG2 . 25652 1 503 . 1 1 46 46 THR N N 15 119.090 0.40 . 1 . . . A 86 THR N . 25652 1 504 . 1 1 47 47 ASN H H 1 7.933 0.02 . 1 . . . A 87 ASN H . 25652 1 505 . 1 1 47 47 ASN HA H 1 4.837 0.02 . 1 . . . A 87 ASN HA . 25652 1 506 . 1 1 47 47 ASN HB2 H 1 2.420 0.02 . 2 . . . A 87 ASN HB2 . 25652 1 507 . 1 1 47 47 ASN HB3 H 1 2.990 0.02 . 2 . . . A 87 ASN HB3 . 25652 1 508 . 1 1 47 47 ASN HD21 H 1 6.969 0.02 . 2 . . . A 87 ASN HD21 . 25652 1 509 . 1 1 47 47 ASN HD22 H 1 7.888 0.02 . 2 . . . A 87 ASN HD22 . 25652 1 510 . 1 1 47 47 ASN CA C 13 52.570 0.40 . 1 . . . A 87 ASN CA . 25652 1 511 . 1 1 47 47 ASN CB C 13 41.273 0.40 . 1 . . . A 87 ASN CB . 25652 1 512 . 1 1 47 47 ASN N N 15 117.616 0.40 . 1 . . . A 87 ASN N . 25652 1 513 . 1 1 47 47 ASN ND2 N 15 111.538 0.40 . 1 . . . A 87 ASN ND2 . 25652 1 514 . 1 1 48 48 LEU H H 1 8.571 0.02 . 1 . . . A 88 LEU H . 25652 1 515 . 1 1 48 48 LEU HA H 1 4.994 0.02 . 1 . . . A 88 LEU HA . 25652 1 516 . 1 1 48 48 LEU HB2 H 1 1.493 0.02 . 2 . . . A 88 LEU HB2 . 25652 1 517 . 1 1 48 48 LEU HB3 H 1 1.637 0.02 . 2 . . . A 88 LEU HB3 . 25652 1 518 . 1 1 48 48 LEU HG H 1 1.488 0.02 . 1 . . . A 88 LEU HG . 25652 1 519 . 1 1 48 48 LEU HD11 H 1 0.925 0.02 . 2 . . . A 88 LEU HD11 . 25652 1 520 . 1 1 48 48 LEU HD12 H 1 0.925 0.02 . 2 . . . A 88 LEU HD12 . 25652 1 521 . 1 1 48 48 LEU HD13 H 1 0.925 0.02 . 2 . . . A 88 LEU HD13 . 25652 1 522 . 1 1 48 48 LEU HD21 H 1 0.933 0.02 . 2 . . . A 88 LEU HD21 . 25652 1 523 . 1 1 48 48 LEU HD22 H 1 0.933 0.02 . 2 . . . A 88 LEU HD22 . 25652 1 524 . 1 1 48 48 LEU HD23 H 1 0.933 0.02 . 2 . . . A 88 LEU HD23 . 25652 1 525 . 1 1 48 48 LEU CA C 13 54.684 0.40 . 1 . . . A 88 LEU CA . 25652 1 526 . 1 1 48 48 LEU CB C 13 46.206 0.40 . 1 . . . A 88 LEU CB . 25652 1 527 . 1 1 48 48 LEU CG C 13 27.686 0.40 . 1 . . . A 88 LEU CG . 25652 1 528 . 1 1 48 48 LEU CD1 C 13 25.331 0.40 . 1 . . . A 88 LEU CD1 . 25652 1 529 . 1 1 48 48 LEU CD2 C 13 26.858 0.40 . 1 . . . A 88 LEU CD2 . 25652 1 530 . 1 1 48 48 LEU N N 15 121.922 0.40 . 1 . . . A 88 LEU N . 25652 1 531 . 1 1 49 49 LEU H H 1 8.868 0.02 . 1 . . . A 89 LEU H . 25652 1 532 . 1 1 49 49 LEU HA H 1 4.831 0.02 . 1 . . . A 89 LEU HA . 25652 1 533 . 1 1 49 49 LEU HB2 H 1 1.286 0.02 . 2 . . . A 89 LEU HB2 . 25652 1 534 . 1 1 49 49 LEU HB3 H 1 1.801 0.02 . 2 . . . A 89 LEU HB3 . 25652 1 535 . 1 1 49 49 LEU HG H 1 1.461 0.02 . 1 . . . A 89 LEU HG . 25652 1 536 . 1 1 49 49 LEU HD11 H 1 0.593 0.02 . 2 . . . A 89 LEU HD11 . 25652 1 537 . 1 1 49 49 LEU HD12 H 1 0.593 0.02 . 2 . . . A 89 LEU HD12 . 25652 1 538 . 1 1 49 49 LEU HD13 H 1 0.593 0.02 . 2 . . . A 89 LEU HD13 . 25652 1 539 . 1 1 49 49 LEU HD21 H 1 0.905 0.02 . 2 . . . A 89 LEU HD21 . 25652 1 540 . 1 1 49 49 LEU HD22 H 1 0.905 0.02 . 2 . . . A 89 LEU HD22 . 25652 1 541 . 1 1 49 49 LEU HD23 H 1 0.905 0.02 . 2 . . . A 89 LEU HD23 . 25652 1 542 . 1 1 49 49 LEU CA C 13 54.525 0.40 . 1 . . . A 89 LEU CA . 25652 1 543 . 1 1 49 49 LEU CB C 13 45.934 0.40 . 1 . . . A 89 LEU CB . 25652 1 544 . 1 1 49 49 LEU CG C 13 27.884 0.40 . 1 . . . A 89 LEU CG . 25652 1 545 . 1 1 49 49 LEU CD1 C 13 25.293 0.40 . 1 . . . A 89 LEU CD1 . 25652 1 546 . 1 1 49 49 LEU CD2 C 13 23.709 0.40 . 1 . . . A 89 LEU CD2 . 25652 1 547 . 1 1 49 49 LEU N N 15 125.206 0.40 . 1 . . . A 89 LEU N . 25652 1 548 . 1 1 50 50 MET H H 1 9.340 0.02 . 1 . . . A 90 MET H . 25652 1 549 . 1 1 50 50 MET HA H 1 4.774 0.02 . 1 . . . A 90 MET HA . 25652 1 550 . 1 1 50 50 MET HB2 H 1 2.093 0.02 . 2 . . . A 90 MET HB2 . 25652 1 551 . 1 1 50 50 MET HB3 H 1 2.093 0.02 . 2 . . . A 90 MET HB3 . 25652 1 552 . 1 1 50 50 MET HG2 H 1 2.445 0.02 . 2 . . . A 90 MET HG2 . 25652 1 553 . 1 1 50 50 MET HG3 H 1 2.683 0.02 . 2 . . . A 90 MET HG3 . 25652 1 554 . 1 1 50 50 MET HE1 H 1 1.845 0.02 . 1 . . . A 90 MET HE1 . 25652 1 555 . 1 1 50 50 MET HE2 H 1 1.845 0.02 . 1 . . . A 90 MET HE2 . 25652 1 556 . 1 1 50 50 MET HE3 H 1 1.845 0.02 . 1 . . . A 90 MET HE3 . 25652 1 557 . 1 1 50 50 MET CA C 13 54.733 0.40 . 1 . . . A 90 MET CA . 25652 1 558 . 1 1 50 50 MET CB C 13 33.348 0.40 . 1 . . . A 90 MET CB . 25652 1 559 . 1 1 50 50 MET CG C 13 32.165 0.40 . 1 . . . A 90 MET CG . 25652 1 560 . 1 1 50 50 MET CE C 13 17.057 0.40 . 1 . . . A 90 MET CE . 25652 1 561 . 1 1 50 50 MET N N 15 126.444 0.40 . 1 . . . A 90 MET N . 25652 1 562 . 1 1 51 51 LEU H H 1 8.395 0.02 . 1 . . . A 91 LEU H . 25652 1 563 . 1 1 51 51 LEU HA H 1 4.759 0.02 . 1 . . . A 91 LEU HA . 25652 1 564 . 1 1 51 51 LEU HB2 H 1 1.315 0.02 . 2 . . . A 91 LEU HB2 . 25652 1 565 . 1 1 51 51 LEU HB3 H 1 1.631 0.02 . 2 . . . A 91 LEU HB3 . 25652 1 566 . 1 1 51 51 LEU HG H 1 1.460 0.02 . 1 . . . A 91 LEU HG . 25652 1 567 . 1 1 51 51 LEU HD11 H 1 0.851 0.02 . 2 . . . A 91 LEU HD11 . 25652 1 568 . 1 1 51 51 LEU HD12 H 1 0.851 0.02 . 2 . . . A 91 LEU HD12 . 25652 1 569 . 1 1 51 51 LEU HD13 H 1 0.851 0.02 . 2 . . . A 91 LEU HD13 . 25652 1 570 . 1 1 51 51 LEU HD21 H 1 0.849 0.02 . 2 . . . A 91 LEU HD21 . 25652 1 571 . 1 1 51 51 LEU HD22 H 1 0.849 0.02 . 2 . . . A 91 LEU HD22 . 25652 1 572 . 1 1 51 51 LEU HD23 H 1 0.849 0.02 . 2 . . . A 91 LEU HD23 . 25652 1 573 . 1 1 51 51 LEU CA C 13 52.898 0.40 . 1 . . . A 91 LEU CA . 25652 1 574 . 1 1 51 51 LEU CB C 13 40.799 0.40 . 1 . . . A 91 LEU CB . 25652 1 575 . 1 1 51 51 LEU CG C 13 27.377 0.40 . 1 . . . A 91 LEU CG . 25652 1 576 . 1 1 51 51 LEU CD1 C 13 25.712 0.40 . 1 . . . A 91 LEU CD1 . 25652 1 577 . 1 1 51 51 LEU CD2 C 13 23.734 0.40 . 1 . . . A 91 LEU CD2 . 25652 1 578 . 1 1 51 51 LEU N N 15 126.055 0.40 . 1 . . . A 91 LEU N . 25652 1 579 . 1 1 52 52 LYS H H 1 8.366 0.02 . 1 . . . A 92 LYS H . 25652 1 580 . 1 1 52 52 LYS HA H 1 4.109 0.02 . 1 . . . A 92 LYS HA . 25652 1 581 . 1 1 52 52 LYS HB2 H 1 1.896 0.02 . 2 . . . A 92 LYS HB2 . 25652 1 582 . 1 1 52 52 LYS HB3 H 1 1.896 0.02 . 2 . . . A 92 LYS HB3 . 25652 1 583 . 1 1 52 52 LYS HG2 H 1 1.484 0.02 . 2 . . . A 92 LYS HG2 . 25652 1 584 . 1 1 52 52 LYS HG3 H 1 1.620 0.02 . 2 . . . A 92 LYS HG3 . 25652 1 585 . 1 1 52 52 LYS HD2 H 1 1.845 0.02 . 2 . . . A 92 LYS HD2 . 25652 1 586 . 1 1 52 52 LYS HD3 H 1 1.845 0.02 . 2 . . . A 92 LYS HD3 . 25652 1 587 . 1 1 52 52 LYS HE2 H 1 3.039 0.02 . 2 . . . A 92 LYS HE2 . 25652 1 588 . 1 1 52 52 LYS HE3 H 1 3.039 0.02 . 2 . . . A 92 LYS HE3 . 25652 1 589 . 1 1 52 52 LYS CA C 13 59.587 0.40 . 1 . . . A 92 LYS CA . 25652 1 590 . 1 1 52 52 LYS CB C 13 32.239 0.40 . 1 . . . A 92 LYS CB . 25652 1 591 . 1 1 52 52 LYS CG C 13 25.392 0.40 . 1 . . . A 92 LYS CG . 25652 1 592 . 1 1 52 52 LYS CD C 13 29.252 0.40 . 1 . . . A 92 LYS CD . 25652 1 593 . 1 1 52 52 LYS CE C 13 42.219 0.40 . 1 . . . A 92 LYS CE . 25652 1 594 . 1 1 52 52 LYS N N 15 124.396 0.40 . 1 . . . A 92 LYS N . 25652 1 595 . 1 1 53 53 GLY H H 1 8.939 0.02 . 1 . . . A 93 GLY H . 25652 1 596 . 1 1 53 53 GLY HA2 H 1 4.077 0.02 . 2 . . . A 93 GLY HA2 . 25652 1 597 . 1 1 53 53 GLY HA3 H 1 3.909 0.02 . 2 . . . A 93 GLY HA3 . 25652 1 598 . 1 1 53 53 GLY CA C 13 45.968 0.40 . 1 . . . A 93 GLY CA . 25652 1 599 . 1 1 53 53 GLY N N 15 108.853 0.40 . 1 . . . A 93 GLY N . 25652 1 600 . 1 1 54 54 LYS H H 1 7.354 0.02 . 1 . . . A 94 LYS H . 25652 1 601 . 1 1 54 54 LYS HA H 1 4.499 0.02 . 1 . . . A 94 LYS HA . 25652 1 602 . 1 1 54 54 LYS HB2 H 1 1.492 0.02 . 2 . . . A 94 LYS HB2 . 25652 1 603 . 1 1 54 54 LYS HB3 H 1 1.985 0.02 . 2 . . . A 94 LYS HB3 . 25652 1 604 . 1 1 54 54 LYS HG2 H 1 1.397 0.02 . 2 . . . A 94 LYS HG2 . 25652 1 605 . 1 1 54 54 LYS HG3 H 1 1.397 0.02 . 2 . . . A 94 LYS HG3 . 25652 1 606 . 1 1 54 54 LYS HD2 H 1 1.621 0.02 . 2 . . . A 94 LYS HD2 . 25652 1 607 . 1 1 54 54 LYS HD3 H 1 1.621 0.02 . 2 . . . A 94 LYS HD3 . 25652 1 608 . 1 1 54 54 LYS HE2 H 1 2.997 0.02 . 2 . . . A 94 LYS HE2 . 25652 1 609 . 1 1 54 54 LYS HE3 H 1 2.997 0.02 . 2 . . . A 94 LYS HE3 . 25652 1 610 . 1 1 54 54 LYS CA C 13 54.376 0.40 . 1 . . . A 94 LYS CA . 25652 1 611 . 1 1 54 54 LYS CB C 13 33.466 0.40 . 1 . . . A 94 LYS CB . 25652 1 612 . 1 1 54 54 LYS CG C 13 24.833 0.40 . 1 . . . A 94 LYS CG . 25652 1 613 . 1 1 54 54 LYS CD C 13 28.740 0.40 . 1 . . . A 94 LYS CD . 25652 1 614 . 1 1 54 54 LYS CE C 13 42.245 0.40 . 1 . . . A 94 LYS CE . 25652 1 615 . 1 1 54 54 LYS N N 15 115.629 0.40 . 1 . . . A 94 LYS N . 25652 1 616 . 1 1 55 55 ASN H H 1 8.106 0.02 . 1 . . . A 95 ASN H . 25652 1 617 . 1 1 55 55 ASN HA H 1 4.482 0.02 . 1 . . . A 95 ASN HA . 25652 1 618 . 1 1 55 55 ASN HB2 H 1 3.075 0.02 . 2 . . . A 95 ASN HB2 . 25652 1 619 . 1 1 55 55 ASN HB3 H 1 3.279 0.02 . 2 . . . A 95 ASN HB3 . 25652 1 620 . 1 1 55 55 ASN CA C 13 54.504 0.40 . 1 . . . A 95 ASN CA . 25652 1 621 . 1 1 55 55 ASN CB C 13 37.098 0.40 . 1 . . . A 95 ASN CB . 25652 1 622 . 1 1 55 55 ASN N N 15 115.799 0.40 . 1 . . . A 95 ASN N . 25652 1 623 . 1 1 56 56 GLN H H 1 7.354 0.02 . 1 . . . A 96 GLN H . 25652 1 624 . 1 1 56 56 GLN HA H 1 5.210 0.02 . 1 . . . A 96 GLN HA . 25652 1 625 . 1 1 56 56 GLN HB2 H 1 1.599 0.02 . 2 . . . A 96 GLN HB2 . 25652 1 626 . 1 1 56 56 GLN HB3 H 1 1.985 0.02 . 2 . . . A 96 GLN HB3 . 25652 1 627 . 1 1 56 56 GLN HG2 H 1 2.272 0.02 . 2 . . . A 96 GLN HG2 . 25652 1 628 . 1 1 56 56 GLN HG3 H 1 2.513 0.02 . 2 . . . A 96 GLN HG3 . 25652 1 629 . 1 1 56 56 GLN CB C 13 35.874 0.40 . 1 . . . A 96 GLN CB . 25652 1 630 . 1 1 56 56 GLN CG C 13 34.380 0.40 . 1 . . . A 96 GLN CG . 25652 1 631 . 1 1 56 56 GLN N N 15 113.336 0.40 . 1 . . . A 96 GLN N . 25652 1 632 . 1 1 57 57 ALA H H 1 8.647 0.02 . 1 . . . A 97 ALA H . 25652 1 633 . 1 1 57 57 ALA HA H 1 4.925 0.02 . 1 . . . A 97 ALA HA . 25652 1 634 . 1 1 57 57 ALA HB1 H 1 1.288 0.02 . 1 . . . A 97 ALA HB1 . 25652 1 635 . 1 1 57 57 ALA HB2 H 1 1.288 0.02 . 1 . . . A 97 ALA HB2 . 25652 1 636 . 1 1 57 57 ALA HB3 H 1 1.288 0.02 . 1 . . . A 97 ALA HB3 . 25652 1 637 . 1 1 57 57 ALA CA C 13 51.566 0.40 . 1 . . . A 97 ALA CA . 25652 1 638 . 1 1 57 57 ALA CB C 13 24.215 0.40 . 1 . . . A 97 ALA CB . 25652 1 639 . 1 1 57 57 ALA N N 15 119.398 0.40 . 1 . . . A 97 ALA N . 25652 1 640 . 1 1 58 58 PHE H H 1 9.084 0.02 . 1 . . . A 98 PHE H . 25652 1 641 . 1 1 58 58 PHE HA H 1 5.837 0.02 . 1 . . . A 98 PHE HA . 25652 1 642 . 1 1 58 58 PHE HB2 H 1 2.782 0.02 . 2 . . . A 98 PHE HB2 . 25652 1 643 . 1 1 58 58 PHE HB3 H 1 2.786 0.02 . 2 . . . A 98 PHE HB3 . 25652 1 644 . 1 1 58 58 PHE HD1 H 1 7.079 0.02 . 1 . . . A 98 PHE HD1 . 25652 1 645 . 1 1 58 58 PHE HD2 H 1 7.079 0.02 . 1 . . . A 98 PHE HD2 . 25652 1 646 . 1 1 58 58 PHE HE1 H 1 7.410 0.02 . 1 . . . A 98 PHE HE1 . 25652 1 647 . 1 1 58 58 PHE HE2 H 1 7.410 0.02 . 1 . . . A 98 PHE HE2 . 25652 1 648 . 1 1 58 58 PHE HZ H 1 7.256 0.02 . 1 . . . A 98 PHE HZ . 25652 1 649 . 1 1 58 58 PHE CA C 13 55.795 0.40 . 1 . . . A 98 PHE CA . 25652 1 650 . 1 1 58 58 PHE CB C 13 43.495 0.40 . 1 . . . A 98 PHE CB . 25652 1 651 . 1 1 58 58 PHE CD1 C 13 131.394 0.40 . 1 . . . A 98 PHE CD1 . 25652 1 652 . 1 1 58 58 PHE CE1 C 13 131.772 0.40 . 1 . . . A 98 PHE CE1 . 25652 1 653 . 1 1 58 58 PHE CZ C 13 128.584 0.40 . 1 . . . A 98 PHE CZ . 25652 1 654 . 1 1 58 58 PHE N N 15 116.037 0.40 . 1 . . . A 98 PHE N . 25652 1 655 . 1 1 59 59 ILE H H 1 9.122 0.02 . 1 . . . A 99 ILE H . 25652 1 656 . 1 1 59 59 ILE HA H 1 4.764 0.02 . 1 . . . A 99 ILE HA . 25652 1 657 . 1 1 59 59 ILE HB H 1 1.674 0.02 . 1 . . . A 99 ILE HB . 25652 1 658 . 1 1 59 59 ILE HG12 H 1 1.591 0.02 . 2 . . . A 99 ILE HG12 . 25652 1 659 . 1 1 59 59 ILE HG13 H 1 0.964 0.02 . 2 . . . A 99 ILE HG13 . 25652 1 660 . 1 1 59 59 ILE HG21 H 1 0.911 0.02 . 1 . . . A 99 ILE HG21 . 25652 1 661 . 1 1 59 59 ILE HG22 H 1 0.911 0.02 . 1 . . . A 99 ILE HG22 . 25652 1 662 . 1 1 59 59 ILE HG23 H 1 0.911 0.02 . 1 . . . A 99 ILE HG23 . 25652 1 663 . 1 1 59 59 ILE HD11 H 1 0.734 0.02 . 1 . . . A 99 ILE HD11 . 25652 1 664 . 1 1 59 59 ILE HD12 H 1 0.734 0.02 . 1 . . . A 99 ILE HD12 . 25652 1 665 . 1 1 59 59 ILE HD13 H 1 0.734 0.02 . 1 . . . A 99 ILE HD13 . 25652 1 666 . 1 1 59 59 ILE CA C 13 60.096 0.40 . 1 . . . A 99 ILE CA . 25652 1 667 . 1 1 59 59 ILE CB C 13 42.405 0.40 . 1 . . . A 99 ILE CB . 25652 1 668 . 1 1 59 59 ILE CG1 C 13 27.457 0.40 . 1 . . . A 99 ILE CG1 . 25652 1 669 . 1 1 59 59 ILE CG2 C 13 18.468 0.40 . 1 . . . A 99 ILE CG2 . 25652 1 670 . 1 1 59 59 ILE CD1 C 13 14.321 0.40 . 1 . . . A 99 ILE CD1 . 25652 1 671 . 1 1 59 59 ILE N N 15 118.305 0.40 . 1 . . . A 99 ILE N . 25652 1 672 . 1 1 60 60 GLU H H 1 8.492 0.02 . 1 . . . A 100 GLU H . 25652 1 673 . 1 1 60 60 GLU HA H 1 5.036 0.02 . 1 . . . A 100 GLU HA . 25652 1 674 . 1 1 60 60 GLU HB2 H 1 2.103 0.02 . 2 . . . A 100 GLU HB2 . 25652 1 675 . 1 1 60 60 GLU HB3 H 1 1.653 0.02 . 2 . . . A 100 GLU HB3 . 25652 1 676 . 1 1 60 60 GLU HG2 H 1 1.944 0.02 . 2 . . . A 100 GLU HG2 . 25652 1 677 . 1 1 60 60 GLU HG3 H 1 2.289 0.02 . 2 . . . A 100 GLU HG3 . 25652 1 678 . 1 1 60 60 GLU CA C 13 54.651 0.40 . 1 . . . A 100 GLU CA . 25652 1 679 . 1 1 60 60 GLU CB C 13 33.823 0.40 . 1 . . . A 100 GLU CB . 25652 1 680 . 1 1 60 60 GLU CG C 13 37.585 0.40 . 1 . . . A 100 GLU CG . 25652 1 681 . 1 1 60 60 GLU N N 15 127.259 0.40 . 1 . . . A 100 GLU N . 25652 1 682 . 1 1 61 61 MET H H 1 8.879 0.02 . 1 . . . A 101 MET H . 25652 1 683 . 1 1 61 61 MET HA H 1 5.744 0.02 . 1 . . . A 101 MET HA . 25652 1 684 . 1 1 61 61 MET HB2 H 1 2.407 0.02 . 2 . . . A 101 MET HB2 . 25652 1 685 . 1 1 61 61 MET HB3 H 1 2.671 0.02 . 2 . . . A 101 MET HB3 . 25652 1 686 . 1 1 61 61 MET HG2 H 1 2.303 0.02 . 2 . . . A 101 MET HG2 . 25652 1 687 . 1 1 61 61 MET HG3 H 1 2.303 0.02 . 2 . . . A 101 MET HG3 . 25652 1 688 . 1 1 61 61 MET HE1 H 1 1.938 0.02 . 1 . . . A 101 MET HE1 . 25652 1 689 . 1 1 61 61 MET HE2 H 1 1.938 0.02 . 1 . . . A 101 MET HE2 . 25652 1 690 . 1 1 61 61 MET HE3 H 1 1.938 0.02 . 1 . . . A 101 MET HE3 . 25652 1 691 . 1 1 61 61 MET CA C 13 52.032 0.40 . 1 . . . A 101 MET CA . 25652 1 692 . 1 1 61 61 MET CB C 13 32.623 0.40 . 1 . . . A 101 MET CB . 25652 1 693 . 1 1 61 61 MET CG C 13 32.131 0.40 . 1 . . . A 101 MET CG . 25652 1 694 . 1 1 61 61 MET CE C 13 16.125 0.40 . 1 . . . A 101 MET CE . 25652 1 695 . 1 1 61 61 MET N N 15 123.186 0.40 . 1 . . . A 101 MET N . 25652 1 696 . 1 1 62 62 ASN H H 1 9.131 0.02 . 1 . . . A 102 ASN H . 25652 1 697 . 1 1 62 62 ASN HA H 1 4.392 0.02 . 1 . . . A 102 ASN HA . 25652 1 698 . 1 1 62 62 ASN HB2 H 1 2.864 0.02 . 2 . . . A 102 ASN HB2 . 25652 1 699 . 1 1 62 62 ASN HB3 H 1 3.017 0.02 . 2 . . . A 102 ASN HB3 . 25652 1 700 . 1 1 62 62 ASN HD21 H 1 7.883 0.02 . 2 . . . A 102 ASN HD21 . 25652 1 701 . 1 1 62 62 ASN HD22 H 1 7.230 0.02 . 2 . . . A 102 ASN HD22 . 25652 1 702 . 1 1 62 62 ASN CA C 13 56.592 0.40 . 1 . . . A 102 ASN CA . 25652 1 703 . 1 1 62 62 ASN CB C 13 37.748 0.40 . 1 . . . A 102 ASN CB . 25652 1 704 . 1 1 62 62 ASN N N 15 116.695 0.40 . 1 . . . A 102 ASN N . 25652 1 705 . 1 1 62 62 ASN ND2 N 15 115.030 0.40 . 1 . . . A 102 ASN ND2 . 25652 1 706 . 1 1 63 63 THR H H 1 7.326 0.02 . 1 . . . A 103 THR H . 25652 1 707 . 1 1 63 63 THR HA H 1 4.817 0.02 . 1 . . . A 103 THR HA . 25652 1 708 . 1 1 63 63 THR HB H 1 4.811 0.02 . 1 . . . A 103 THR HB . 25652 1 709 . 1 1 63 63 THR HG21 H 1 1.346 0.02 . 1 . . . A 103 THR HG21 . 25652 1 710 . 1 1 63 63 THR HG22 H 1 1.346 0.02 . 1 . . . A 103 THR HG22 . 25652 1 711 . 1 1 63 63 THR HG23 H 1 1.346 0.02 . 1 . . . A 103 THR HG23 . 25652 1 712 . 1 1 63 63 THR CA C 13 58.908 0.40 . 1 . . . A 103 THR CA . 25652 1 713 . 1 1 63 63 THR CB C 13 72.994 0.40 . 1 . . . A 103 THR CB . 25652 1 714 . 1 1 63 63 THR CG2 C 13 21.969 0.40 . 1 . . . A 103 THR CG2 . 25652 1 715 . 1 1 63 63 THR N N 15 104.623 0.40 . 1 . . . A 103 THR N . 25652 1 716 . 1 1 64 64 GLU H H 1 9.370 0.02 . 1 . . . A 104 GLU H . 25652 1 717 . 1 1 64 64 GLU HA H 1 3.933 0.02 . 1 . . . A 104 GLU HA . 25652 1 718 . 1 1 64 64 GLU HB2 H 1 1.980 0.02 . 2 . . . A 104 GLU HB2 . 25652 1 719 . 1 1 64 64 GLU HB3 H 1 2.106 0.02 . 2 . . . A 104 GLU HB3 . 25652 1 720 . 1 1 64 64 GLU HG2 H 1 2.253 0.02 . 2 . . . A 104 GLU HG2 . 25652 1 721 . 1 1 64 64 GLU HG3 H 1 2.411 0.02 . 2 . . . A 104 GLU HG3 . 25652 1 722 . 1 1 64 64 GLU CA C 13 60.193 0.40 . 1 . . . A 104 GLU CA . 25652 1 723 . 1 1 64 64 GLU CB C 13 29.434 0.40 . 1 . . . A 104 GLU CB . 25652 1 724 . 1 1 64 64 GLU CG C 13 37.301 0.40 . 1 . . . A 104 GLU CG . 25652 1 725 . 1 1 64 64 GLU N N 15 122.574 0.40 . 1 . . . A 104 GLU N . 25652 1 726 . 1 1 65 65 GLU H H 1 8.726 0.02 . 1 . . . A 105 GLU H . 25652 1 727 . 1 1 65 65 GLU HA H 1 4.203 0.02 . 1 . . . A 105 GLU HA . 25652 1 728 . 1 1 65 65 GLU HB2 H 1 2.093 0.02 . 2 . . . A 105 GLU HB2 . 25652 1 729 . 1 1 65 65 GLU HB3 H 1 2.228 0.02 . 2 . . . A 105 GLU HB3 . 25652 1 730 . 1 1 65 65 GLU HG2 H 1 2.414 0.02 . 2 . . . A 105 GLU HG2 . 25652 1 731 . 1 1 65 65 GLU HG3 H 1 2.438 0.02 . 2 . . . A 105 GLU HG3 . 25652 1 732 . 1 1 65 65 GLU CA C 13 60.277 0.40 . 1 . . . A 105 GLU CA . 25652 1 733 . 1 1 65 65 GLU CB C 13 29.233 0.40 . 1 . . . A 105 GLU CB . 25652 1 734 . 1 1 65 65 GLU CG C 13 36.703 0.40 . 1 . . . A 105 GLU CG . 25652 1 735 . 1 1 65 65 GLU N N 15 120.124 0.40 . 1 . . . A 105 GLU N . 25652 1 736 . 1 1 66 66 ALA H H 1 8.367 0.02 . 1 . . . A 106 ALA H . 25652 1 737 . 1 1 66 66 ALA HA H 1 4.282 0.02 . 1 . . . A 106 ALA HA . 25652 1 738 . 1 1 66 66 ALA HB1 H 1 1.649 0.02 . 1 . . . A 106 ALA HB1 . 25652 1 739 . 1 1 66 66 ALA HB2 H 1 1.649 0.02 . 1 . . . A 106 ALA HB2 . 25652 1 740 . 1 1 66 66 ALA HB3 H 1 1.649 0.02 . 1 . . . A 106 ALA HB3 . 25652 1 741 . 1 1 66 66 ALA CA C 13 55.261 0.40 . 1 . . . A 106 ALA CA . 25652 1 742 . 1 1 66 66 ALA CB C 13 19.789 0.40 . 1 . . . A 106 ALA CB . 25652 1 743 . 1 1 66 66 ALA N N 15 124.279 0.40 . 1 . . . A 106 ALA N . 25652 1 744 . 1 1 67 67 ALA H H 1 7.457 0.02 . 1 . . . A 107 ALA H . 25652 1 745 . 1 1 67 67 ALA HA H 1 4.071 0.02 . 1 . . . A 107 ALA HA . 25652 1 746 . 1 1 67 67 ALA HB1 H 1 1.839 0.02 . 1 . . . A 107 ALA HB1 . 25652 1 747 . 1 1 67 67 ALA HB2 H 1 1.839 0.02 . 1 . . . A 107 ALA HB2 . 25652 1 748 . 1 1 67 67 ALA HB3 H 1 1.839 0.02 . 1 . . . A 107 ALA HB3 . 25652 1 749 . 1 1 67 67 ALA CA C 13 55.747 0.40 . 1 . . . A 107 ALA CA . 25652 1 750 . 1 1 67 67 ALA CB C 13 19.544 0.40 . 1 . . . A 107 ALA CB . 25652 1 751 . 1 1 67 67 ALA N N 15 118.758 0.40 . 1 . . . A 107 ALA N . 25652 1 752 . 1 1 68 68 ASN H H 1 8.988 0.02 . 1 . . . A 108 ASN H . 25652 1 753 . 1 1 68 68 ASN HA H 1 4.725 0.02 . 1 . . . A 108 ASN HA . 25652 1 754 . 1 1 68 68 ASN HB2 H 1 3.030 0.02 . 2 . . . A 108 ASN HB2 . 25652 1 755 . 1 1 68 68 ASN HB3 H 1 3.033 0.02 . 2 . . . A 108 ASN HB3 . 25652 1 756 . 1 1 68 68 ASN HD21 H 1 7.707 0.02 . 2 . . . A 108 ASN HD21 . 25652 1 757 . 1 1 68 68 ASN HD22 H 1 6.959 0.02 . 2 . . . A 108 ASN HD22 . 25652 1 758 . 1 1 68 68 ASN CB C 13 39.644 0.40 . 1 . . . A 108 ASN CB . 25652 1 759 . 1 1 68 68 ASN N N 15 116.774 0.40 . 1 . . . A 108 ASN N . 25652 1 760 . 1 1 68 68 ASN ND2 N 15 112.801 0.40 . 1 . . . A 108 ASN ND2 . 25652 1 761 . 1 1 69 69 THR H H 1 8.602 0.02 . 1 . . . A 109 THR H . 25652 1 762 . 1 1 69 69 THR HA H 1 3.959 0.02 . 1 . . . A 109 THR HA . 25652 1 763 . 1 1 69 69 THR HB H 1 4.486 0.02 . 1 . . . A 109 THR HB . 25652 1 764 . 1 1 69 69 THR HG21 H 1 1.518 0.02 . 1 . . . A 109 THR HG21 . 25652 1 765 . 1 1 69 69 THR HG22 H 1 1.518 0.02 . 1 . . . A 109 THR HG22 . 25652 1 766 . 1 1 69 69 THR HG23 H 1 1.518 0.02 . 1 . . . A 109 THR HG23 . 25652 1 767 . 1 1 69 69 THR CA C 13 66.836 0.40 . 1 . . . A 109 THR CA . 25652 1 768 . 1 1 69 69 THR CB C 13 68.762 0.40 . 1 . . . A 109 THR CB . 25652 1 769 . 1 1 69 69 THR CG2 C 13 22.473 0.40 . 1 . . . A 109 THR CG2 . 25652 1 770 . 1 1 69 69 THR N N 15 116.907 0.40 . 1 . . . A 109 THR N . 25652 1 771 . 1 1 70 70 MET H H 1 7.807 0.02 . 1 . . . A 110 MET H . 25652 1 772 . 1 1 70 70 MET HA H 1 2.229 0.02 . 1 . . . A 110 MET HA . 25652 1 773 . 1 1 70 70 MET HB2 H 1 1.502 0.02 . 2 . . . A 110 MET HB2 . 25652 1 774 . 1 1 70 70 MET HB3 H 1 2.157 0.02 . 2 . . . A 110 MET HB3 . 25652 1 775 . 1 1 70 70 MET HG2 H 1 2.080 0.02 . 2 . . . A 110 MET HG2 . 25652 1 776 . 1 1 70 70 MET HG3 H 1 2.474 0.02 . 2 . . . A 110 MET HG3 . 25652 1 777 . 1 1 70 70 MET HE1 H 1 1.971 0.02 . 1 . . . A 110 MET HE1 . 25652 1 778 . 1 1 70 70 MET HE2 H 1 1.971 0.02 . 1 . . . A 110 MET HE2 . 25652 1 779 . 1 1 70 70 MET HE3 H 1 1.971 0.02 . 1 . . . A 110 MET HE3 . 25652 1 780 . 1 1 70 70 MET CA C 13 59.188 0.40 . 1 . . . A 110 MET CA . 25652 1 781 . 1 1 70 70 MET CB C 13 32.869 0.40 . 1 . . . A 110 MET CB . 25652 1 782 . 1 1 70 70 MET CG C 13 33.031 0.40 . 1 . . . A 110 MET CG . 25652 1 783 . 1 1 70 70 MET CE C 13 18.167 0.40 . 1 . . . A 110 MET CE . 25652 1 784 . 1 1 70 70 MET N N 15 123.180 0.40 . 1 . . . A 110 MET N . 25652 1 785 . 1 1 71 71 VAL H H 1 8.292 0.02 . 1 . . . A 111 VAL H . 25652 1 786 . 1 1 71 71 VAL HA H 1 3.315 0.02 . 1 . . . A 111 VAL HA . 25652 1 787 . 1 1 71 71 VAL HB H 1 1.609 0.02 . 1 . . . A 111 VAL HB . 25652 1 788 . 1 1 71 71 VAL HG11 H 1 0.184 0.02 . 2 . . . A 111 VAL HG11 . 25652 1 789 . 1 1 71 71 VAL HG12 H 1 0.184 0.02 . 2 . . . A 111 VAL HG12 . 25652 1 790 . 1 1 71 71 VAL HG13 H 1 0.184 0.02 . 2 . . . A 111 VAL HG13 . 25652 1 791 . 1 1 71 71 VAL HG21 H 1 0.494 0.02 . 2 . . . A 111 VAL HG21 . 25652 1 792 . 1 1 71 71 VAL HG22 H 1 0.494 0.02 . 2 . . . A 111 VAL HG22 . 25652 1 793 . 1 1 71 71 VAL HG23 H 1 0.494 0.02 . 2 . . . A 111 VAL HG23 . 25652 1 794 . 1 1 71 71 VAL CA C 13 67.388 0.40 . 1 . . . A 111 VAL CA . 25652 1 795 . 1 1 71 71 VAL CB C 13 31.339 0.40 . 1 . . . A 111 VAL CB . 25652 1 796 . 1 1 71 71 VAL CG1 C 13 23.646 0.40 . 1 . . . A 111 VAL CG1 . 25652 1 797 . 1 1 71 71 VAL CG2 C 13 20.938 0.40 . 1 . . . A 111 VAL CG2 . 25652 1 798 . 1 1 71 71 VAL N N 15 118.497 0.40 . 1 . . . A 111 VAL N . 25652 1 799 . 1 1 72 72 ASN H H 1 8.346 0.02 . 1 . . . A 112 ASN H . 25652 1 800 . 1 1 72 72 ASN HA H 1 4.395 0.02 . 1 . . . A 112 ASN HA . 25652 1 801 . 1 1 72 72 ASN HB2 H 1 2.796 0.02 . 2 . . . A 112 ASN HB2 . 25652 1 802 . 1 1 72 72 ASN HB3 H 1 2.966 0.02 . 2 . . . A 112 ASN HB3 . 25652 1 803 . 1 1 72 72 ASN HD21 H 1 7.609 0.02 . 2 . . . A 112 ASN HD21 . 25652 1 804 . 1 1 72 72 ASN HD22 H 1 6.905 0.02 . 2 . . . A 112 ASN HD22 . 25652 1 805 . 1 1 72 72 ASN CA C 13 56.745 0.40 . 1 . . . A 112 ASN CA . 25652 1 806 . 1 1 72 72 ASN CB C 13 38.347 0.40 . 1 . . . A 112 ASN CB . 25652 1 807 . 1 1 72 72 ASN N N 15 118.524 0.40 . 1 . . . A 112 ASN N . 25652 1 808 . 1 1 72 72 ASN ND2 N 15 112.255 0.40 . 1 . . . A 112 ASN ND2 . 25652 1 809 . 1 1 73 73 TYR H H 1 8.316 0.02 . 1 . . . A 113 TYR H . 25652 1 810 . 1 1 73 73 TYR HA H 1 4.102 0.02 . 1 . . . A 113 TYR HA . 25652 1 811 . 1 1 73 73 TYR HB2 H 1 2.617 0.02 . 2 . . . A 113 TYR HB2 . 25652 1 812 . 1 1 73 73 TYR HB3 H 1 3.009 0.02 . 2 . . . A 113 TYR HB3 . 25652 1 813 . 1 1 73 73 TYR HD1 H 1 6.370 0.02 . 1 . . . A 113 TYR HD1 . 25652 1 814 . 1 1 73 73 TYR HD2 H 1 6.370 0.02 . 1 . . . A 113 TYR HD2 . 25652 1 815 . 1 1 73 73 TYR HE1 H 1 6.713 0.02 . 1 . . . A 113 TYR HE1 . 25652 1 816 . 1 1 73 73 TYR HE2 H 1 6.713 0.02 . 1 . . . A 113 TYR HE2 . 25652 1 817 . 1 1 73 73 TYR CA C 13 62.422 0.40 . 1 . . . A 113 TYR CA . 25652 1 818 . 1 1 73 73 TYR CB C 13 38.682 0.40 . 1 . . . A 113 TYR CB . 25652 1 819 . 1 1 73 73 TYR CD2 C 13 133.509 0.40 . 1 . . . A 113 TYR CD2 . 25652 1 820 . 1 1 73 73 TYR CE2 C 13 117.935 0.40 . 1 . . . A 113 TYR CE2 . 25652 1 821 . 1 1 73 73 TYR N N 15 123.463 0.40 . 1 . . . A 113 TYR N . 25652 1 822 . 1 1 74 74 TYR H H 1 7.899 0.02 . 1 . . . A 114 TYR H . 25652 1 823 . 1 1 74 74 TYR HA H 1 5.264 0.02 . 1 . . . A 114 TYR HA . 25652 1 824 . 1 1 74 74 TYR HB2 H 1 2.662 0.02 . 2 . . . A 114 TYR HB2 . 25652 1 825 . 1 1 74 74 TYR HB3 H 1 3.461 0.02 . 2 . . . A 114 TYR HB3 . 25652 1 826 . 1 1 74 74 TYR HD1 H 1 7.255 0.02 . 1 . . . A 114 TYR HD1 . 25652 1 827 . 1 1 74 74 TYR HD2 H 1 7.255 0.02 . 1 . . . A 114 TYR HD2 . 25652 1 828 . 1 1 74 74 TYR HE1 H 1 7.047 0.02 . 1 . . . A 114 TYR HE1 . 25652 1 829 . 1 1 74 74 TYR HE2 H 1 7.047 0.02 . 1 . . . A 114 TYR HE2 . 25652 1 830 . 1 1 74 74 TYR CA C 13 59.510 0.40 . 1 . . . A 114 TYR CA . 25652 1 831 . 1 1 74 74 TYR CB C 13 37.319 0.40 . 1 . . . A 114 TYR CB . 25652 1 832 . 1 1 74 74 TYR CD1 C 13 133.642 0.40 . 1 . . . A 114 TYR CD1 . 25652 1 833 . 1 1 74 74 TYR CE1 C 13 117.493 0.40 . 1 . . . A 114 TYR CE1 . 25652 1 834 . 1 1 74 74 TYR N N 15 116.024 0.40 . 1 . . . A 114 TYR N . 25652 1 835 . 1 1 75 75 THR H H 1 7.654 0.02 . 1 . . . A 115 THR H . 25652 1 836 . 1 1 75 75 THR HA H 1 4.379 0.02 . 1 . . . A 115 THR HA . 25652 1 837 . 1 1 75 75 THR HB H 1 4.408 0.02 . 1 . . . A 115 THR HB . 25652 1 838 . 1 1 75 75 THR HG21 H 1 1.375 0.02 . 1 . . . A 115 THR HG21 . 25652 1 839 . 1 1 75 75 THR HG22 H 1 1.375 0.02 . 1 . . . A 115 THR HG22 . 25652 1 840 . 1 1 75 75 THR HG23 H 1 1.375 0.02 . 1 . . . A 115 THR HG23 . 25652 1 841 . 1 1 75 75 THR CA C 13 65.104 0.40 . 1 . . . A 115 THR CA . 25652 1 842 . 1 1 75 75 THR CB C 13 69.450 0.40 . 1 . . . A 115 THR CB . 25652 1 843 . 1 1 75 75 THR CG2 C 13 21.332 0.40 . 1 . . . A 115 THR CG2 . 25652 1 844 . 1 1 75 75 THR N N 15 113.313 0.40 . 1 . . . A 115 THR N . 25652 1 845 . 1 1 76 76 SER H H 1 7.377 0.02 . 1 . . . A 116 SER H . 25652 1 846 . 1 1 76 76 SER HA H 1 4.577 0.02 . 1 . . . A 116 SER HA . 25652 1 847 . 1 1 76 76 SER HB2 H 1 3.901 0.02 . 2 . . . A 116 SER HB2 . 25652 1 848 . 1 1 76 76 SER HB3 H 1 3.922 0.02 . 2 . . . A 116 SER HB3 . 25652 1 849 . 1 1 76 76 SER CA C 13 59.658 0.40 . 1 . . . A 116 SER CA . 25652 1 850 . 1 1 76 76 SER CB C 13 64.422 0.40 . 1 . . . A 116 SER CB . 25652 1 851 . 1 1 76 76 SER N N 15 116.083 0.40 . 1 . . . A 116 SER N . 25652 1 852 . 1 1 77 77 VAL H H 1 7.710 0.02 . 1 . . . A 117 VAL H . 25652 1 853 . 1 1 77 77 VAL HA H 1 4.154 0.02 . 1 . . . A 117 VAL HA . 25652 1 854 . 1 1 77 77 VAL HB H 1 1.598 0.02 . 1 . . . A 117 VAL HB . 25652 1 855 . 1 1 77 77 VAL HG11 H 1 0.585 0.02 . 2 . . . A 117 VAL HG11 . 25652 1 856 . 1 1 77 77 VAL HG12 H 1 0.585 0.02 . 2 . . . A 117 VAL HG12 . 25652 1 857 . 1 1 77 77 VAL HG13 H 1 0.585 0.02 . 2 . . . A 117 VAL HG13 . 25652 1 858 . 1 1 77 77 VAL HG21 H 1 0.861 0.02 . 2 . . . A 117 VAL HG21 . 25652 1 859 . 1 1 77 77 VAL HG22 H 1 0.861 0.02 . 2 . . . A 117 VAL HG22 . 25652 1 860 . 1 1 77 77 VAL HG23 H 1 0.861 0.02 . 2 . . . A 117 VAL HG23 . 25652 1 861 . 1 1 77 77 VAL CA C 13 61.222 0.40 . 1 . . . A 117 VAL CA . 25652 1 862 . 1 1 77 77 VAL CB C 13 33.310 0.40 . 1 . . . A 117 VAL CB . 25652 1 863 . 1 1 77 77 VAL CG1 C 13 20.407 0.40 . 1 . . . A 117 VAL CG1 . 25652 1 864 . 1 1 77 77 VAL CG2 C 13 20.949 0.40 . 1 . . . A 117 VAL CG2 . 25652 1 865 . 1 1 77 77 VAL N N 15 123.276 0.40 . 1 . . . A 117 VAL N . 25652 1 866 . 1 1 78 78 THR H H 1 8.060 0.02 . 1 . . . A 118 THR H . 25652 1 867 . 1 1 78 78 THR HA H 1 4.572 0.02 . 1 . . . A 118 THR HA . 25652 1 868 . 1 1 78 78 THR HB H 1 4.014 0.02 . 1 . . . A 118 THR HB . 25652 1 869 . 1 1 78 78 THR HG21 H 1 1.079 0.02 . 1 . . . A 118 THR HG21 . 25652 1 870 . 1 1 78 78 THR HG22 H 1 1.079 0.02 . 1 . . . A 118 THR HG22 . 25652 1 871 . 1 1 78 78 THR HG23 H 1 1.079 0.02 . 1 . . . A 118 THR HG23 . 25652 1 872 . 1 1 78 78 THR CA C 13 60.999 0.40 . 1 . . . A 118 THR CA . 25652 1 873 . 1 1 78 78 THR CB C 13 70.259 0.40 . 1 . . . A 118 THR CB . 25652 1 874 . 1 1 78 78 THR CG2 C 13 21.365 0.40 . 1 . . . A 118 THR CG2 . 25652 1 875 . 1 1 78 78 THR N N 15 121.250 0.40 . 1 . . . A 118 THR N . 25652 1 876 . 1 1 79 79 PRO HA H 1 4.550 0.02 . 1 . . . A 119 PRO HA . 25652 1 877 . 1 1 79 79 PRO HB2 H 1 1.309 0.02 . 2 . . . A 119 PRO HB2 . 25652 1 878 . 1 1 79 79 PRO HB3 H 1 1.433 0.02 . 2 . . . A 119 PRO HB3 . 25652 1 879 . 1 1 79 79 PRO HG2 H 1 2.138 0.02 . 2 . . . A 119 PRO HG2 . 25652 1 880 . 1 1 79 79 PRO HG3 H 1 1.510 0.02 . 2 . . . A 119 PRO HG3 . 25652 1 881 . 1 1 79 79 PRO HD2 H 1 4.085 0.02 . 2 . . . A 119 PRO HD2 . 25652 1 882 . 1 1 79 79 PRO HD3 H 1 4.349 0.02 . 2 . . . A 119 PRO HD3 . 25652 1 883 . 1 1 79 79 PRO CA C 13 62.447 0.40 . 1 . . . A 119 PRO CA . 25652 1 884 . 1 1 79 79 PRO CB C 13 30.587 0.40 . 1 . . . A 119 PRO CB . 25652 1 885 . 1 1 79 79 PRO CG C 13 26.514 0.40 . 1 . . . A 119 PRO CG . 25652 1 886 . 1 1 79 79 PRO CD C 13 50.828 0.40 . 1 . . . A 119 PRO CD . 25652 1 887 . 1 1 80 80 VAL H H 1 7.678 0.02 . 1 . . . A 120 VAL H . 25652 1 888 . 1 1 80 80 VAL HA H 1 4.792 0.02 . 1 . . . A 120 VAL HA . 25652 1 889 . 1 1 80 80 VAL HB H 1 1.659 0.02 . 1 . . . A 120 VAL HB . 25652 1 890 . 1 1 80 80 VAL HG11 H 1 0.640 0.02 . 2 . . . A 120 VAL HG11 . 25652 1 891 . 1 1 80 80 VAL HG12 H 1 0.640 0.02 . 2 . . . A 120 VAL HG12 . 25652 1 892 . 1 1 80 80 VAL HG13 H 1 0.640 0.02 . 2 . . . A 120 VAL HG13 . 25652 1 893 . 1 1 80 80 VAL HG21 H 1 0.782 0.02 . 2 . . . A 120 VAL HG21 . 25652 1 894 . 1 1 80 80 VAL HG22 H 1 0.782 0.02 . 2 . . . A 120 VAL HG22 . 25652 1 895 . 1 1 80 80 VAL HG23 H 1 0.782 0.02 . 2 . . . A 120 VAL HG23 . 25652 1 896 . 1 1 80 80 VAL CA C 13 59.893 0.40 . 1 . . . A 120 VAL CA . 25652 1 897 . 1 1 80 80 VAL CB C 13 36.046 0.40 . 1 . . . A 120 VAL CB . 25652 1 898 . 1 1 80 80 VAL CG1 C 13 21.114 0.40 . 1 . . . A 120 VAL CG1 . 25652 1 899 . 1 1 80 80 VAL CG2 C 13 20.173 0.40 . 1 . . . A 120 VAL CG2 . 25652 1 900 . 1 1 80 80 VAL N N 15 117.709 0.40 . 1 . . . A 120 VAL N . 25652 1 901 . 1 1 81 81 LEU H H 1 8.483 0.02 . 1 . . . A 121 LEU H . 25652 1 902 . 1 1 81 81 LEU HA H 1 4.614 0.02 . 1 . . . A 121 LEU HA . 25652 1 903 . 1 1 81 81 LEU HB2 H 1 1.295 0.02 . 2 . . . A 121 LEU HB2 . 25652 1 904 . 1 1 81 81 LEU HB3 H 1 1.354 0.02 . 2 . . . A 121 LEU HB3 . 25652 1 905 . 1 1 81 81 LEU HG H 1 1.526 0.02 . 1 . . . A 121 LEU HG . 25652 1 906 . 1 1 81 81 LEU HD11 H 1 0.887 0.02 . 2 . . . A 121 LEU HD11 . 25652 1 907 . 1 1 81 81 LEU HD12 H 1 0.887 0.02 . 2 . . . A 121 LEU HD12 . 25652 1 908 . 1 1 81 81 LEU HD13 H 1 0.887 0.02 . 2 . . . A 121 LEU HD13 . 25652 1 909 . 1 1 81 81 LEU HD21 H 1 0.796 0.02 . 2 . . . A 121 LEU HD21 . 25652 1 910 . 1 1 81 81 LEU HD22 H 1 0.796 0.02 . 2 . . . A 121 LEU HD22 . 25652 1 911 . 1 1 81 81 LEU HD23 H 1 0.796 0.02 . 2 . . . A 121 LEU HD23 . 25652 1 912 . 1 1 81 81 LEU CA C 13 54.193 0.40 . 1 . . . A 121 LEU CA . 25652 1 913 . 1 1 81 81 LEU CB C 13 46.727 0.40 . 1 . . . A 121 LEU CB . 25652 1 914 . 1 1 81 81 LEU CG C 13 27.524 0.40 . 1 . . . A 121 LEU CG . 25652 1 915 . 1 1 81 81 LEU CD1 C 13 24.537 0.40 . 1 . . . A 121 LEU CD1 . 25652 1 916 . 1 1 81 81 LEU CD2 C 13 25.930 0.40 . 1 . . . A 121 LEU CD2 . 25652 1 917 . 1 1 81 81 LEU N N 15 123.961 0.40 . 1 . . . A 121 LEU N . 25652 1 918 . 1 1 82 82 ARG H H 1 9.418 0.02 . 1 . . . A 122 ARG H . 25652 1 919 . 1 1 82 82 ARG HA H 1 3.911 0.02 . 1 . . . A 122 ARG HA . 25652 1 920 . 1 1 82 82 ARG HB2 H 1 1.553 0.02 . 2 . . . A 122 ARG HB2 . 25652 1 921 . 1 1 82 82 ARG HB3 H 1 1.553 0.02 . 2 . . . A 122 ARG HB3 . 25652 1 922 . 1 1 82 82 ARG HD2 H 1 3.242 0.02 . 2 . . . A 122 ARG HD2 . 25652 1 923 . 1 1 82 82 ARG HD3 H 1 3.033 0.02 . 2 . . . A 122 ARG HD3 . 25652 1 924 . 1 1 82 82 ARG HE H 1 8.899 0.02 . 1 . . . A 122 ARG HE . 25652 1 925 . 1 1 82 82 ARG CA C 13 56.814 0.40 . 1 . . . A 122 ARG CA . 25652 1 926 . 1 1 82 82 ARG CB C 13 27.992 0.40 . 1 . . . A 122 ARG CB . 25652 1 927 . 1 1 82 82 ARG CD C 13 43.892 0.40 . 1 . . . A 122 ARG CD . 25652 1 928 . 1 1 82 82 ARG N N 15 121.964 0.40 . 1 . . . A 122 ARG N . 25652 1 929 . 1 1 82 82 ARG NE N 15 86.364 0.40 . 1 . . . A 122 ARG NE . 25652 1 930 . 1 1 83 83 GLY H H 1 8.303 0.02 . 1 . . . A 123 GLY H . 25652 1 931 . 1 1 83 83 GLY HA2 H 1 4.162 0.02 . 2 . . . A 123 GLY HA2 . 25652 1 932 . 1 1 83 83 GLY HA3 H 1 3.532 0.02 . 2 . . . A 123 GLY HA3 . 25652 1 933 . 1 1 83 83 GLY CA C 13 45.564 0.40 . 1 . . . A 123 GLY CA . 25652 1 934 . 1 1 83 83 GLY N N 15 102.866 0.40 . 1 . . . A 123 GLY N . 25652 1 935 . 1 1 84 84 GLN H H 1 8.005 0.02 . 1 . . . A 124 GLN H . 25652 1 936 . 1 1 84 84 GLN HA H 1 4.998 0.02 . 1 . . . A 124 GLN HA . 25652 1 937 . 1 1 84 84 GLN HB2 H 1 2.038 0.02 . 2 . . . A 124 GLN HB2 . 25652 1 938 . 1 1 84 84 GLN HB3 H 1 2.224 0.02 . 2 . . . A 124 GLN HB3 . 25652 1 939 . 1 1 84 84 GLN HG2 H 1 2.389 0.02 . 2 . . . A 124 GLN HG2 . 25652 1 940 . 1 1 84 84 GLN HG3 H 1 2.389 0.02 . 2 . . . A 124 GLN HG3 . 25652 1 941 . 1 1 84 84 GLN HE21 H 1 6.879 0.02 . 2 . . . A 124 GLN HE21 . 25652 1 942 . 1 1 84 84 GLN HE22 H 1 7.569 0.02 . 2 . . . A 124 GLN HE22 . 25652 1 943 . 1 1 84 84 GLN CA C 13 52.147 0.40 . 1 . . . A 124 GLN CA . 25652 1 944 . 1 1 84 84 GLN CB C 13 30.878 0.40 . 1 . . . A 124 GLN CB . 25652 1 945 . 1 1 84 84 GLN CG C 13 33.391 0.40 . 1 . . . A 124 GLN CG . 25652 1 946 . 1 1 84 84 GLN N N 15 122.073 0.40 . 1 . . . A 124 GLN N . 25652 1 947 . 1 1 84 84 GLN NE2 N 15 112.968 0.40 . 1 . . . A 124 GLN NE2 . 25652 1 948 . 1 1 85 85 PRO HA H 1 4.862 0.02 . 1 . . . A 125 PRO HA . 25652 1 949 . 1 1 85 85 PRO HB2 H 1 1.780 0.02 . 2 . . . A 125 PRO HB2 . 25652 1 950 . 1 1 85 85 PRO HB3 H 1 2.117 0.02 . 2 . . . A 125 PRO HB3 . 25652 1 951 . 1 1 85 85 PRO HG2 H 1 1.954 0.02 . 2 . . . A 125 PRO HG2 . 25652 1 952 . 1 1 85 85 PRO HG3 H 1 2.149 0.02 . 2 . . . A 125 PRO HG3 . 25652 1 953 . 1 1 85 85 PRO HD2 H 1 3.796 0.02 . 2 . . . A 125 PRO HD2 . 25652 1 954 . 1 1 85 85 PRO HD3 H 1 3.899 0.02 . 2 . . . A 125 PRO HD3 . 25652 1 955 . 1 1 85 85 PRO CA C 13 62.867 0.40 . 1 . . . A 125 PRO CA . 25652 1 956 . 1 1 85 85 PRO CB C 13 32.185 0.40 . 1 . . . A 125 PRO CB . 25652 1 957 . 1 1 85 85 PRO CG C 13 27.536 0.40 . 1 . . . A 125 PRO CG . 25652 1 958 . 1 1 85 85 PRO CD C 13 51.044 0.40 . 1 . . . A 125 PRO CD . 25652 1 959 . 1 1 86 86 ILE H H 1 7.609 0.02 . 1 . . . A 126 ILE H . 25652 1 960 . 1 1 86 86 ILE HA H 1 4.572 0.02 . 1 . . . A 126 ILE HA . 25652 1 961 . 1 1 86 86 ILE HB H 1 1.796 0.02 . 1 . . . A 126 ILE HB . 25652 1 962 . 1 1 86 86 ILE HG12 H 1 1.516 0.02 . 2 . . . A 126 ILE HG12 . 25652 1 963 . 1 1 86 86 ILE HG13 H 1 1.302 0.02 . 2 . . . A 126 ILE HG13 . 25652 1 964 . 1 1 86 86 ILE HG21 H 1 0.859 0.02 . 1 . . . A 126 ILE HG21 . 25652 1 965 . 1 1 86 86 ILE HG22 H 1 0.859 0.02 . 1 . . . A 126 ILE HG22 . 25652 1 966 . 1 1 86 86 ILE HG23 H 1 0.859 0.02 . 1 . . . A 126 ILE HG23 . 25652 1 967 . 1 1 86 86 ILE HD11 H 1 0.555 0.02 . 1 . . . A 126 ILE HD11 . 25652 1 968 . 1 1 86 86 ILE HD12 H 1 0.555 0.02 . 1 . . . A 126 ILE HD12 . 25652 1 969 . 1 1 86 86 ILE HD13 H 1 0.555 0.02 . 1 . . . A 126 ILE HD13 . 25652 1 970 . 1 1 86 86 ILE CA C 13 59.106 0.40 . 1 . . . A 126 ILE CA . 25652 1 971 . 1 1 86 86 ILE CB C 13 39.955 0.40 . 1 . . . A 126 ILE CB . 25652 1 972 . 1 1 86 86 ILE CG1 C 13 28.064 0.40 . 1 . . . A 126 ILE CG1 . 25652 1 973 . 1 1 86 86 ILE CG2 C 13 18.244 0.40 . 1 . . . A 126 ILE CG2 . 25652 1 974 . 1 1 86 86 ILE CD1 C 13 14.798 0.40 . 1 . . . A 126 ILE CD1 . 25652 1 975 . 1 1 86 86 ILE N N 15 116.469 0.40 . 1 . . . A 126 ILE N . 25652 1 976 . 1 1 87 87 TYR H H 1 7.580 0.02 . 1 . . . A 127 TYR H . 25652 1 977 . 1 1 87 87 TYR HA H 1 4.856 0.02 . 1 . . . A 127 TYR HA . 25652 1 978 . 1 1 87 87 TYR HB2 H 1 2.522 0.02 . 2 . . . A 127 TYR HB2 . 25652 1 979 . 1 1 87 87 TYR HB3 H 1 2.806 0.02 . 2 . . . A 127 TYR HB3 . 25652 1 980 . 1 1 87 87 TYR HD1 H 1 6.924 0.02 . 1 . . . A 127 TYR HD1 . 25652 1 981 . 1 1 87 87 TYR HD2 H 1 6.924 0.02 . 1 . . . A 127 TYR HD2 . 25652 1 982 . 1 1 87 87 TYR HE1 H 1 6.723 0.02 . 1 . . . A 127 TYR HE1 . 25652 1 983 . 1 1 87 87 TYR HE2 H 1 6.723 0.02 . 1 . . . A 127 TYR HE2 . 25652 1 984 . 1 1 87 87 TYR CA C 13 56.912 0.40 . 1 . . . A 127 TYR CA . 25652 1 985 . 1 1 87 87 TYR CB C 13 41.047 0.40 . 1 . . . A 127 TYR CB . 25652 1 986 . 1 1 87 87 TYR CD2 C 13 132.867 0.40 . 1 . . . A 127 TYR CD2 . 25652 1 987 . 1 1 87 87 TYR CE2 C 13 117.951 0.40 . 1 . . . A 127 TYR CE2 . 25652 1 988 . 1 1 87 87 TYR N N 15 117.550 0.40 . 1 . . . A 127 TYR N . 25652 1 989 . 1 1 88 88 ILE H H 1 8.358 0.02 . 1 . . . A 128 ILE H . 25652 1 990 . 1 1 88 88 ILE HA H 1 4.807 0.02 . 1 . . . A 128 ILE HA . 25652 1 991 . 1 1 88 88 ILE HB H 1 1.542 0.02 . 1 . . . A 128 ILE HB . 25652 1 992 . 1 1 88 88 ILE HG12 H 1 0.858 0.02 . 2 . . . A 128 ILE HG12 . 25652 1 993 . 1 1 88 88 ILE HG13 H 1 1.272 0.02 . 2 . . . A 128 ILE HG13 . 25652 1 994 . 1 1 88 88 ILE HG21 H 1 0.659 0.02 . 1 . . . A 128 ILE HG21 . 25652 1 995 . 1 1 88 88 ILE HG22 H 1 0.659 0.02 . 1 . . . A 128 ILE HG22 . 25652 1 996 . 1 1 88 88 ILE HG23 H 1 0.659 0.02 . 1 . . . A 128 ILE HG23 . 25652 1 997 . 1 1 88 88 ILE HD11 H 1 0.468 0.02 . 1 . . . A 128 ILE HD11 . 25652 1 998 . 1 1 88 88 ILE HD12 H 1 0.468 0.02 . 1 . . . A 128 ILE HD12 . 25652 1 999 . 1 1 88 88 ILE HD13 H 1 0.468 0.02 . 1 . . . A 128 ILE HD13 . 25652 1 1000 . 1 1 88 88 ILE CA C 13 59.873 0.40 . 1 . . . A 128 ILE CA . 25652 1 1001 . 1 1 88 88 ILE CB C 13 40.955 0.40 . 1 . . . A 128 ILE CB . 25652 1 1002 . 1 1 88 88 ILE CG1 C 13 27.956 0.40 . 1 . . . A 128 ILE CG1 . 25652 1 1003 . 1 1 88 88 ILE CG2 C 13 18.167 0.40 . 1 . . . A 128 ILE CG2 . 25652 1 1004 . 1 1 88 88 ILE CD1 C 13 14.819 0.40 . 1 . . . A 128 ILE CD1 . 25652 1 1005 . 1 1 88 88 ILE N N 15 122.996 0.40 . 1 . . . A 128 ILE N . 25652 1 1006 . 1 1 89 89 GLN HA H 1 4.633 0.02 . 1 . . . A 129 GLN HA . 25652 1 1007 . 1 1 89 89 GLN CA C 13 54.028 0.40 . 1 . . . A 129 GLN CA . 25652 1 1008 . 1 1 90 90 PHE H H 1 8.854 0.02 . 1 . . . A 130 PHE H . 25652 1 1009 . 1 1 90 90 PHE HA H 1 4.729 0.02 . 1 . . . A 130 PHE HA . 25652 1 1010 . 1 1 90 90 PHE HB2 H 1 2.909 0.02 . 2 . . . A 130 PHE HB2 . 25652 1 1011 . 1 1 90 90 PHE HB3 H 1 3.288 0.02 . 2 . . . A 130 PHE HB3 . 25652 1 1012 . 1 1 90 90 PHE HD1 H 1 7.454 0.02 . 1 . . . A 130 PHE HD1 . 25652 1 1013 . 1 1 90 90 PHE HD2 H 1 7.454 0.02 . 1 . . . A 130 PHE HD2 . 25652 1 1014 . 1 1 90 90 PHE HE1 H 1 7.407 0.02 . 1 . . . A 130 PHE HE1 . 25652 1 1015 . 1 1 90 90 PHE HE2 H 1 7.407 0.02 . 1 . . . A 130 PHE HE2 . 25652 1 1016 . 1 1 90 90 PHE HZ H 1 7.626 0.02 . 1 . . . A 130 PHE HZ . 25652 1 1017 . 1 1 90 90 PHE CA C 13 60.078 0.40 . 1 . . . A 130 PHE CA . 25652 1 1018 . 1 1 90 90 PHE CB C 13 39.959 0.40 . 1 . . . A 130 PHE CB . 25652 1 1019 . 1 1 90 90 PHE CD1 C 13 132.153 0.40 . 1 . . . A 130 PHE CD1 . 25652 1 1020 . 1 1 90 90 PHE CE1 C 13 131.938 0.40 . 1 . . . A 130 PHE CE1 . 25652 1 1021 . 1 1 90 90 PHE CZ C 13 130.565 0.40 . 1 . . . A 130 PHE CZ . 25652 1 1022 . 1 1 90 90 PHE N N 15 119.970 0.40 . 1 . . . A 130 PHE N . 25652 1 1023 . 1 1 91 91 SER H H 1 9.125 0.02 . 1 . . . A 131 SER H . 25652 1 1024 . 1 1 91 91 SER HA H 1 4.665 0.02 . 1 . . . A 131 SER HA . 25652 1 1025 . 1 1 91 91 SER HB2 H 1 4.073 0.02 . 2 . . . A 131 SER HB2 . 25652 1 1026 . 1 1 91 91 SER HB3 H 1 4.073 0.02 . 2 . . . A 131 SER HB3 . 25652 1 1027 . 1 1 91 91 SER CA C 13 55.140 0.40 . 1 . . . A 131 SER CA . 25652 1 1028 . 1 1 91 91 SER N N 15 116.736 0.40 . 1 . . . A 131 SER N . 25652 1 1029 . 1 1 92 92 ASN H H 1 8.756 0.02 . 1 . . . A 132 ASN H . 25652 1 1030 . 1 1 92 92 ASN HA H 1 4.565 0.02 . 1 . . . A 132 ASN HA . 25652 1 1031 . 1 1 92 92 ASN HB2 H 1 2.640 0.02 . 2 . . . A 132 ASN HB2 . 25652 1 1032 . 1 1 92 92 ASN HB3 H 1 2.640 0.02 . 2 . . . A 132 ASN HB3 . 25652 1 1033 . 1 1 92 92 ASN CB C 13 38.317 0.40 . 1 . . . A 132 ASN CB . 25652 1 1034 . 1 1 92 92 ASN N N 15 123.064 0.40 . 1 . . . A 132 ASN N . 25652 1 1035 . 1 1 93 93 HIS H H 1 8.692 0.02 . 1 . . . A 133 HIS H . 25652 1 1036 . 1 1 93 93 HIS HA H 1 4.416 0.02 . 1 . . . A 133 HIS HA . 25652 1 1037 . 1 1 93 93 HIS HB2 H 1 2.982 0.02 . 2 . . . A 133 HIS HB2 . 25652 1 1038 . 1 1 93 93 HIS HB3 H 1 2.982 0.02 . 2 . . . A 133 HIS HB3 . 25652 1 1039 . 1 1 93 93 HIS HD2 H 1 7.046 0.02 . 1 . . . A 133 HIS HD2 . 25652 1 1040 . 1 1 93 93 HIS HE1 H 1 7.947 0.02 . 1 . . . A 133 HIS HE1 . 25652 1 1041 . 1 1 93 93 HIS CB C 13 29.742 0.40 . 1 . . . A 133 HIS CB . 25652 1 1042 . 1 1 93 93 HIS CD2 C 13 119.148 0.40 . 1 . . . A 133 HIS CD2 . 25652 1 1043 . 1 1 93 93 HIS CE1 C 13 138.077 0.40 . 1 . . . A 133 HIS CE1 . 25652 1 1044 . 1 1 94 94 LYS H H 1 8.768 0.02 . 1 . . . A 134 LYS H . 25652 1 1045 . 1 1 94 94 LYS HA H 1 4.469 0.02 . 1 . . . A 134 LYS HA . 25652 1 1046 . 1 1 94 94 LYS HB2 H 1 2.003 0.02 . 2 . . . A 134 LYS HB2 . 25652 1 1047 . 1 1 94 94 LYS HB3 H 1 1.860 0.02 . 2 . . . A 134 LYS HB3 . 25652 1 1048 . 1 1 94 94 LYS HG2 H 1 1.519 0.02 . 2 . . . A 134 LYS HG2 . 25652 1 1049 . 1 1 94 94 LYS HG3 H 1 1.579 0.02 . 2 . . . A 134 LYS HG3 . 25652 1 1050 . 1 1 94 94 LYS HD2 H 1 1.724 0.02 . 2 . . . A 134 LYS HD2 . 25652 1 1051 . 1 1 94 94 LYS HD3 H 1 1.724 0.02 . 2 . . . A 134 LYS HD3 . 25652 1 1052 . 1 1 94 94 LYS HE2 H 1 3.030 0.02 . 2 . . . A 134 LYS HE2 . 25652 1 1053 . 1 1 94 94 LYS HE3 H 1 3.030 0.02 . 2 . . . A 134 LYS HE3 . 25652 1 1054 . 1 1 94 94 LYS CA C 13 56.623 0.40 . 1 . . . A 134 LYS CA . 25652 1 1055 . 1 1 94 94 LYS CB C 13 33.037 0.40 . 1 . . . A 134 LYS CB . 25652 1 1056 . 1 1 94 94 LYS CG C 13 24.838 0.40 . 1 . . . A 134 LYS CG . 25652 1 1057 . 1 1 94 94 LYS CD C 13 28.783 0.40 . 1 . . . A 134 LYS CD . 25652 1 1058 . 1 1 94 94 LYS CE C 13 42.191 0.40 . 1 . . . A 134 LYS CE . 25652 1 1059 . 1 1 94 94 LYS N N 15 121.215 0.40 . 1 . . . A 134 LYS N . 25652 1 1060 . 1 1 95 95 GLU H H 1 7.691 0.02 . 1 . . . A 135 GLU H . 25652 1 1061 . 1 1 95 95 GLU HA H 1 4.308 0.02 . 1 . . . A 135 GLU HA . 25652 1 1062 . 1 1 95 95 GLU HB2 H 1 2.054 0.02 . 2 . . . A 135 GLU HB2 . 25652 1 1063 . 1 1 95 95 GLU HB3 H 1 1.912 0.02 . 2 . . . A 135 GLU HB3 . 25652 1 1064 . 1 1 95 95 GLU HG2 H 1 2.085 0.02 . 2 . . . A 135 GLU HG2 . 25652 1 1065 . 1 1 95 95 GLU HG3 H 1 2.085 0.02 . 2 . . . A 135 GLU HG3 . 25652 1 1066 . 1 1 95 95 GLU CA C 13 54.859 0.40 . 1 . . . A 135 GLU CA . 25652 1 1067 . 1 1 95 95 GLU CB C 13 32.466 0.40 . 1 . . . A 135 GLU CB . 25652 1 1068 . 1 1 95 95 GLU CG C 13 35.436 0.40 . 1 . . . A 135 GLU CG . 25652 1 1069 . 1 1 95 95 GLU N N 15 114.817 0.40 . 1 . . . A 135 GLU N . 25652 1 1070 . 1 1 96 96 LEU H H 1 8.687 0.02 . 1 . . . A 136 LEU H . 25652 1 1071 . 1 1 96 96 LEU HA H 1 4.625 0.02 . 1 . . . A 136 LEU HA . 25652 1 1072 . 1 1 96 96 LEU HB2 H 1 1.317 0.02 . 2 . . . A 136 LEU HB2 . 25652 1 1073 . 1 1 96 96 LEU HB3 H 1 1.317 0.02 . 2 . . . A 136 LEU HB3 . 25652 1 1074 . 1 1 96 96 LEU HG H 1 1.313 0.02 . 1 . . . A 136 LEU HG . 25652 1 1075 . 1 1 96 96 LEU HD11 H 1 0.434 0.02 . 2 . . . A 136 LEU HD11 . 25652 1 1076 . 1 1 96 96 LEU HD12 H 1 0.434 0.02 . 2 . . . A 136 LEU HD12 . 25652 1 1077 . 1 1 96 96 LEU HD13 H 1 0.434 0.02 . 2 . . . A 136 LEU HD13 . 25652 1 1078 . 1 1 96 96 LEU HD21 H 1 0.454 0.02 . 2 . . . A 136 LEU HD21 . 25652 1 1079 . 1 1 96 96 LEU HD22 H 1 0.454 0.02 . 2 . . . A 136 LEU HD22 . 25652 1 1080 . 1 1 96 96 LEU HD23 H 1 0.454 0.02 . 2 . . . A 136 LEU HD23 . 25652 1 1081 . 1 1 96 96 LEU CA C 13 53.906 0.40 . 1 . . . A 136 LEU CA . 25652 1 1082 . 1 1 96 96 LEU CB C 13 43.531 0.40 . 1 . . . A 136 LEU CB . 25652 1 1083 . 1 1 96 96 LEU CG C 13 27.026 0.40 . 1 . . . A 136 LEU CG . 25652 1 1084 . 1 1 96 96 LEU CD1 C 13 24.125 0.40 . 1 . . . A 136 LEU CD1 . 25652 1 1085 . 1 1 96 96 LEU CD2 C 13 24.685 0.40 . 1 . . . A 136 LEU CD2 . 25652 1 1086 . 1 1 96 96 LEU N N 15 122.603 0.40 . 1 . . . A 136 LEU N . 25652 1 1087 . 1 1 97 97 LYS H H 1 9.159 0.02 . 1 . . . A 137 LYS H . 25652 1 1088 . 1 1 97 97 LYS HA H 1 4.553 0.02 . 1 . . . A 137 LYS HA . 25652 1 1089 . 1 1 97 97 LYS HB2 H 1 1.863 0.02 . 2 . . . A 137 LYS HB2 . 25652 1 1090 . 1 1 97 97 LYS HB3 H 1 1.722 0.02 . 2 . . . A 137 LYS HB3 . 25652 1 1091 . 1 1 97 97 LYS HG2 H 1 1.333 0.02 . 2 . . . A 137 LYS HG2 . 25652 1 1092 . 1 1 97 97 LYS HG3 H 1 1.439 0.02 . 2 . . . A 137 LYS HG3 . 25652 1 1093 . 1 1 97 97 LYS HD2 H 1 1.683 0.02 . 2 . . . A 137 LYS HD2 . 25652 1 1094 . 1 1 97 97 LYS HD3 H 1 1.683 0.02 . 2 . . . A 137 LYS HD3 . 25652 1 1095 . 1 1 97 97 LYS HE2 H 1 3.013 0.02 . 2 . . . A 137 LYS HE2 . 25652 1 1096 . 1 1 97 97 LYS HE3 H 1 3.013 0.02 . 2 . . . A 137 LYS HE3 . 25652 1 1097 . 1 1 97 97 LYS CB C 13 33.109 0.40 . 1 . . . A 137 LYS CB . 25652 1 1098 . 1 1 97 97 LYS CG C 13 24.663 0.40 . 1 . . . A 137 LYS CG . 25652 1 1099 . 1 1 97 97 LYS CD C 13 29.450 0.40 . 1 . . . A 137 LYS CD . 25652 1 1100 . 1 1 97 97 LYS CE C 13 42.406 0.40 . 1 . . . A 137 LYS CE . 25652 1 1101 . 1 1 97 97 LYS N N 15 126.409 0.40 . 1 . . . A 137 LYS N . 25652 1 1102 . 1 1 98 98 THR H H 1 8.675 0.02 . 1 . . . A 138 THR H . 25652 1 1103 . 1 1 98 98 THR HA H 1 4.788 0.02 . 1 . . . A 138 THR HA . 25652 1 1104 . 1 1 98 98 THR HB H 1 4.517 0.02 . 1 . . . A 138 THR HB . 25652 1 1105 . 1 1 98 98 THR HG21 H 1 1.056 0.02 . 1 . . . A 138 THR HG21 . 25652 1 1106 . 1 1 98 98 THR HG22 H 1 1.056 0.02 . 1 . . . A 138 THR HG22 . 25652 1 1107 . 1 1 98 98 THR HG23 H 1 1.056 0.02 . 1 . . . A 138 THR HG23 . 25652 1 1108 . 1 1 98 98 THR CA C 13 60.386 0.40 . 1 . . . A 138 THR CA . 25652 1 1109 . 1 1 98 98 THR CB C 13 70.443 0.40 . 1 . . . A 138 THR CB . 25652 1 1110 . 1 1 98 98 THR CG2 C 13 21.784 0.40 . 1 . . . A 138 THR CG2 . 25652 1 1111 . 1 1 99 99 ASP H H 1 8.405 0.02 . 1 . . . A 139 ASP H . 25652 1 1112 . 1 1 99 99 ASP HA H 1 4.670 0.02 . 1 . . . A 139 ASP HA . 25652 1 1113 . 1 1 99 99 ASP HB2 H 1 2.755 0.02 . 2 . . . A 139 ASP HB2 . 25652 1 1114 . 1 1 99 99 ASP HB3 H 1 2.805 0.02 . 2 . . . A 139 ASP HB3 . 25652 1 1115 . 1 1 99 99 ASP CA C 13 54.715 0.40 . 1 . . . A 139 ASP CA . 25652 1 1116 . 1 1 99 99 ASP CB C 13 41.346 0.40 . 1 . . . A 139 ASP CB . 25652 1 1117 . 1 1 99 99 ASP N N 15 122.044 0.40 . 1 . . . A 139 ASP N . 25652 1 1118 . 1 1 100 100 SER H H 1 8.279 0.02 . 1 . . . A 140 SER H . 25652 1 1119 . 1 1 100 100 SER HA H 1 4.489 0.02 . 1 . . . A 140 SER HA . 25652 1 1120 . 1 1 100 100 SER HB2 H 1 3.940 0.02 . 2 . . . A 140 SER HB2 . 25652 1 1121 . 1 1 100 100 SER HB3 H 1 3.960 0.02 . 2 . . . A 140 SER HB3 . 25652 1 1122 . 1 1 100 100 SER CA C 13 58.300 0.40 . 1 . . . A 140 SER CA . 25652 1 1123 . 1 1 100 100 SER CB C 13 63.512 0.40 . 1 . . . A 140 SER CB . 25652 1 1124 . 1 1 100 100 SER N N 15 114.360 0.40 . 1 . . . A 140 SER N . 25652 1 1125 . 1 1 101 101 SER H H 1 8.106 0.02 . 1 . . . A 141 SER H . 25652 1 1126 . 1 1 101 101 SER HA H 1 4.500 0.02 . 1 . . . A 141 SER HA . 25652 1 1127 . 1 1 101 101 SER HB2 H 1 4.011 0.02 . 2 . . . A 141 SER HB2 . 25652 1 1128 . 1 1 101 101 SER HB3 H 1 4.042 0.02 . 2 . . . A 141 SER HB3 . 25652 1 1129 . 1 1 101 101 SER CA C 13 58.710 0.40 . 1 . . . A 141 SER CA . 25652 1 1130 . 1 1 101 101 SER CB C 13 63.828 0.40 . 1 . . . A 141 SER CB . 25652 1 1131 . 1 1 101 101 SER N N 15 115.696 0.40 . 1 . . . A 141 SER N . 25652 1 1132 . 1 1 102 102 PRO HA H 1 4.543 0.02 . 1 . . . A 142 PRO HA . 25652 1 1133 . 1 1 102 102 PRO HB2 H 1 2.074 0.02 . 2 . . . A 142 PRO HB2 . 25652 1 1134 . 1 1 102 102 PRO HB3 H 1 2.429 0.02 . 2 . . . A 142 PRO HB3 . 25652 1 1135 . 1 1 102 102 PRO HG2 H 1 2.143 0.02 . 2 . . . A 142 PRO HG2 . 25652 1 1136 . 1 1 102 102 PRO HG3 H 1 2.083 0.02 . 2 . . . A 142 PRO HG3 . 25652 1 1137 . 1 1 102 102 PRO HD2 H 1 3.891 0.02 . 2 . . . A 142 PRO HD2 . 25652 1 1138 . 1 1 102 102 PRO HD3 H 1 3.924 0.02 . 2 . . . A 142 PRO HD3 . 25652 1 1139 . 1 1 102 102 PRO CA C 13 64.847 0.40 . 1 . . . A 142 PRO CA . 25652 1 1140 . 1 1 102 102 PRO CB C 13 32.064 0.40 . 1 . . . A 142 PRO CB . 25652 1 1141 . 1 1 102 102 PRO CG C 13 27.524 0.40 . 1 . . . A 142 PRO CG . 25652 1 1142 . 1 1 102 102 PRO CD C 13 50.895 0.40 . 1 . . . A 142 PRO CD . 25652 1 1143 . 1 1 103 103 ASN H H 1 8.381 0.02 . 1 . . . A 143 ASN H . 25652 1 1144 . 1 1 103 103 ASN HA H 1 4.681 0.02 . 1 . . . A 143 ASN HA . 25652 1 1145 . 1 1 103 103 ASN HB2 H 1 2.995 0.02 . 2 . . . A 143 ASN HB2 . 25652 1 1146 . 1 1 103 103 ASN HB3 H 1 2.894 0.02 . 2 . . . A 143 ASN HB3 . 25652 1 1147 . 1 1 103 103 ASN HD21 H 1 7.753 0.02 . 2 . . . A 143 ASN HD21 . 25652 1 1148 . 1 1 103 103 ASN CA C 13 54.616 0.40 . 1 . . . A 143 ASN CA . 25652 1 1149 . 1 1 103 103 ASN CB C 13 38.645 0.40 . 1 . . . A 143 ASN CB . 25652 1 1150 . 1 1 103 103 ASN N N 15 116.422 0.40 . 1 . . . A 143 ASN N . 25652 1 1151 . 1 1 103 103 ASN ND2 N 15 113.450 0.40 . 1 . . . A 143 ASN ND2 . 25652 1 1152 . 1 1 104 104 GLN H H 1 8.129 0.02 . 1 . . . A 144 GLN H . 25652 1 1153 . 1 1 104 104 GLN HA H 1 4.402 0.02 . 1 . . . A 144 GLN HA . 25652 1 1154 . 1 1 104 104 GLN HB2 H 1 2.214 0.02 . 2 . . . A 144 GLN HB2 . 25652 1 1155 . 1 1 104 104 GLN HB3 H 1 2.314 0.02 . 2 . . . A 144 GLN HB3 . 25652 1 1156 . 1 1 104 104 GLN HG2 H 1 2.559 0.02 . 2 . . . A 144 GLN HG2 . 25652 1 1157 . 1 1 104 104 GLN HG3 H 1 2.590 0.02 . 2 . . . A 144 GLN HG3 . 25652 1 1158 . 1 1 104 104 GLN HE21 H 1 7.237 0.02 . 2 . . . A 144 GLN HE21 . 25652 1 1159 . 1 1 104 104 GLN HE22 H 1 7.624 0.02 . 2 . . . A 144 GLN HE22 . 25652 1 1160 . 1 1 104 104 GLN CA C 13 57.559 0.40 . 1 . . . A 144 GLN CA . 25652 1 1161 . 1 1 104 104 GLN CB C 13 28.900 0.40 . 1 . . . A 144 GLN CB . 25652 1 1162 . 1 1 104 104 GLN CG C 13 34.066 0.40 . 1 . . . A 144 GLN CG . 25652 1 1163 . 1 1 104 104 GLN N N 15 121.280 0.40 . 1 . . . A 144 GLN N . 25652 1 1164 . 1 1 104 104 GLN NE2 N 15 112.463 0.40 . 1 . . . A 144 GLN NE2 . 25652 1 1165 . 1 1 105 105 ALA H H 1 8.333 0.02 . 1 . . . A 145 ALA H . 25652 1 1166 . 1 1 105 105 ALA HA H 1 4.277 0.02 . 1 . . . A 145 ALA HA . 25652 1 1167 . 1 1 105 105 ALA HB1 H 1 1.542 0.02 . 1 . . . A 145 ALA HB1 . 25652 1 1168 . 1 1 105 105 ALA HB2 H 1 1.542 0.02 . 1 . . . A 145 ALA HB2 . 25652 1 1169 . 1 1 105 105 ALA HB3 H 1 1.542 0.02 . 1 . . . A 145 ALA HB3 . 25652 1 1170 . 1 1 105 105 ALA CA C 13 55.183 0.40 . 1 . . . A 145 ALA CA . 25652 1 1171 . 1 1 105 105 ALA CB C 13 18.350 0.40 . 1 . . . A 145 ALA CB . 25652 1 1172 . 1 1 105 105 ALA N N 15 123.393 0.40 . 1 . . . A 145 ALA N . 25652 1 1173 . 1 1 106 106 ARG H H 1 8.039 0.02 . 1 . . . A 146 ARG H . 25652 1 1174 . 1 1 106 106 ARG HA H 1 4.246 0.02 . 1 . . . A 146 ARG HA . 25652 1 1175 . 1 1 106 106 ARG HB2 H 1 1.922 0.02 . 2 . . . A 146 ARG HB2 . 25652 1 1176 . 1 1 106 106 ARG HB3 H 1 1.922 0.02 . 2 . . . A 146 ARG HB3 . 25652 1 1177 . 1 1 106 106 ARG HG2 H 1 1.826 0.02 . 2 . . . A 146 ARG HG2 . 25652 1 1178 . 1 1 106 106 ARG HG3 H 1 1.672 0.02 . 2 . . . A 146 ARG HG3 . 25652 1 1179 . 1 1 106 106 ARG HD2 H 1 3.327 0.02 . 2 . . . A 146 ARG HD2 . 25652 1 1180 . 1 1 106 106 ARG HD3 H 1 3.327 0.02 . 2 . . . A 146 ARG HD3 . 25652 1 1181 . 1 1 106 106 ARG CA C 13 58.458 0.40 . 1 . . . A 146 ARG CA . 25652 1 1182 . 1 1 106 106 ARG CB C 13 30.577 0.40 . 1 . . . A 146 ARG CB . 25652 1 1183 . 1 1 106 106 ARG CG C 13 27.542 0.40 . 1 . . . A 146 ARG CG . 25652 1 1184 . 1 1 106 106 ARG CD C 13 43.584 0.40 . 1 . . . A 146 ARG CD . 25652 1 1185 . 1 1 106 106 ARG N N 15 118.694 0.40 . 1 . . . A 146 ARG N . 25652 1 1186 . 1 1 107 107 ALA H H 1 7.927 0.02 . 1 . . . A 147 ALA H . 25652 1 1187 . 1 1 107 107 ALA HA H 1 4.115 0.02 . 1 . . . A 147 ALA HA . 25652 1 1188 . 1 1 107 107 ALA HB1 H 1 1.617 0.02 . 1 . . . A 147 ALA HB1 . 25652 1 1189 . 1 1 107 107 ALA HB2 H 1 1.617 0.02 . 1 . . . A 147 ALA HB2 . 25652 1 1190 . 1 1 107 107 ALA HB3 H 1 1.617 0.02 . 1 . . . A 147 ALA HB3 . 25652 1 1191 . 1 1 107 107 ALA CA C 13 55.076 0.40 . 1 . . . A 147 ALA CA . 25652 1 1192 . 1 1 107 107 ALA CB C 13 18.646 0.40 . 1 . . . A 147 ALA CB . 25652 1 1193 . 1 1 107 107 ALA N N 15 123.975 0.40 . 1 . . . A 147 ALA N . 25652 1 1194 . 1 1 108 108 GLN H H 1 8.468 0.02 . 1 . . . A 148 GLN H . 25652 1 1195 . 1 1 108 108 GLN HA H 1 4.150 0.02 . 1 . . . A 148 GLN HA . 25652 1 1196 . 1 1 108 108 GLN HB2 H 1 2.199 0.02 . 2 . . . A 148 GLN HB2 . 25652 1 1197 . 1 1 108 108 GLN HB3 H 1 2.199 0.02 . 2 . . . A 148 GLN HB3 . 25652 1 1198 . 1 1 108 108 GLN HG2 H 1 2.535 0.02 . 2 . . . A 148 GLN HG2 . 25652 1 1199 . 1 1 108 108 GLN HG3 H 1 2.535 0.02 . 2 . . . A 148 GLN HG3 . 25652 1 1200 . 1 1 108 108 GLN CA C 13 58.152 0.40 . 1 . . . A 148 GLN CA . 25652 1 1201 . 1 1 108 108 GLN CB C 13 28.690 0.40 . 1 . . . A 148 GLN CB . 25652 1 1202 . 1 1 108 108 GLN CG C 13 34.165 0.40 . 1 . . . A 148 GLN CG . 25652 1 1203 . 1 1 108 108 GLN N N 15 117.223 0.40 . 1 . . . A 148 GLN N . 25652 1 1204 . 1 1 109 109 ALA H H 1 8.126 0.02 . 1 . . . A 149 ALA H . 25652 1 1205 . 1 1 109 109 ALA HA H 1 4.261 0.02 . 1 . . . A 149 ALA HA . 25652 1 1206 . 1 1 109 109 ALA HB1 H 1 1.528 0.02 . 1 . . . A 149 ALA HB1 . 25652 1 1207 . 1 1 109 109 ALA HB2 H 1 1.528 0.02 . 1 . . . A 149 ALA HB2 . 25652 1 1208 . 1 1 109 109 ALA HB3 H 1 1.528 0.02 . 1 . . . A 149 ALA HB3 . 25652 1 1209 . 1 1 109 109 ALA CA C 13 54.230 0.40 . 1 . . . A 149 ALA CA . 25652 1 1210 . 1 1 109 109 ALA CB C 13 18.509 0.40 . 1 . . . A 149 ALA CB . 25652 1 1211 . 1 1 109 109 ALA N N 15 122.546 0.40 . 1 . . . A 149 ALA N . 25652 1 1212 . 1 1 110 110 ALA H H 1 7.871 0.02 . 1 . . . A 150 ALA H . 25652 1 1213 . 1 1 110 110 ALA HA H 1 4.273 0.02 . 1 . . . A 150 ALA HA . 25652 1 1214 . 1 1 110 110 ALA HB1 H 1 1.460 0.02 . 1 . . . A 150 ALA HB1 . 25652 1 1215 . 1 1 110 110 ALA HB2 H 1 1.460 0.02 . 1 . . . A 150 ALA HB2 . 25652 1 1216 . 1 1 110 110 ALA HB3 H 1 1.460 0.02 . 1 . . . A 150 ALA HB3 . 25652 1 1217 . 1 1 110 110 ALA CA C 13 54.206 0.40 . 1 . . . A 150 ALA CA . 25652 1 1218 . 1 1 110 110 ALA CB C 13 18.731 0.40 . 1 . . . A 150 ALA CB . 25652 1 1219 . 1 1 110 110 ALA N N 15 122.015 0.40 . 1 . . . A 150 ALA N . 25652 1 1220 . 1 1 111 111 LEU H H 1 8.117 0.02 . 1 . . . A 151 LEU H . 25652 1 1221 . 1 1 111 111 LEU HA H 1 4.164 0.02 . 1 . . . A 151 LEU HA . 25652 1 1222 . 1 1 111 111 LEU HB2 H 1 1.625 0.02 . 2 . . . A 151 LEU HB2 . 25652 1 1223 . 1 1 111 111 LEU HB3 H 1 1.853 0.02 . 2 . . . A 151 LEU HB3 . 25652 1 1224 . 1 1 111 111 LEU HG H 1 1.744 0.02 . 1 . . . A 151 LEU HG . 25652 1 1225 . 1 1 111 111 LEU HD11 H 1 0.811 0.02 . 2 . . . A 151 LEU HD11 . 25652 1 1226 . 1 1 111 111 LEU HD12 H 1 0.811 0.02 . 2 . . . A 151 LEU HD12 . 25652 1 1227 . 1 1 111 111 LEU HD13 H 1 0.811 0.02 . 2 . . . A 151 LEU HD13 . 25652 1 1228 . 1 1 111 111 LEU HD21 H 1 0.929 0.02 . 2 . . . A 151 LEU HD21 . 25652 1 1229 . 1 1 111 111 LEU HD22 H 1 0.929 0.02 . 2 . . . A 151 LEU HD22 . 25652 1 1230 . 1 1 111 111 LEU HD23 H 1 0.929 0.02 . 2 . . . A 151 LEU HD23 . 25652 1 1231 . 1 1 111 111 LEU CA C 13 57.144 0.40 . 1 . . . A 151 LEU CA . 25652 1 1232 . 1 1 111 111 LEU CB C 13 42.148 0.40 . 1 . . . A 151 LEU CB . 25652 1 1233 . 1 1 111 111 LEU CG C 13 26.924 0.40 . 1 . . . A 151 LEU CG . 25652 1 1234 . 1 1 111 111 LEU CD1 C 13 23.823 0.40 . 1 . . . A 151 LEU CD1 . 25652 1 1235 . 1 1 111 111 LEU CD2 C 13 25.487 0.40 . 1 . . . A 151 LEU CD2 . 25652 1 1236 . 1 1 111 111 LEU N N 15 119.651 0.40 . 1 . . . A 151 LEU N . 25652 1 1237 . 1 1 112 112 GLN H H 1 8.149 0.02 . 1 . . . A 152 GLN H . 25652 1 1238 . 1 1 112 112 GLN HA H 1 4.237 0.02 . 1 . . . A 152 GLN HA . 25652 1 1239 . 1 1 112 112 GLN HB2 H 1 2.178 0.02 . 2 . . . A 152 GLN HB2 . 25652 1 1240 . 1 1 112 112 GLN HB3 H 1 2.178 0.02 . 2 . . . A 152 GLN HB3 . 25652 1 1241 . 1 1 112 112 GLN HG2 H 1 2.542 0.02 . 2 . . . A 152 GLN HG2 . 25652 1 1242 . 1 1 112 112 GLN HG3 H 1 2.507 0.02 . 2 . . . A 152 GLN HG3 . 25652 1 1243 . 1 1 112 112 GLN CA C 13 57.487 0.40 . 1 . . . A 152 GLN CA . 25652 1 1244 . 1 1 112 112 GLN CB C 13 28.802 0.40 . 1 . . . A 152 GLN CB . 25652 1 1245 . 1 1 112 112 GLN CG C 13 34.028 0.40 . 1 . . . A 152 GLN CG . 25652 1 1246 . 1 1 112 112 GLN N N 15 118.911 0.40 . 1 . . . A 152 GLN N . 25652 1 1247 . 1 1 113 113 ALA H H 1 7.879 0.02 . 1 . . . A 153 ALA H . 25652 1 1248 . 1 1 113 113 ALA HA H 1 4.295 0.02 . 1 . . . A 153 ALA HA . 25652 1 1249 . 1 1 113 113 ALA HB1 H 1 1.534 0.02 . 1 . . . A 153 ALA HB1 . 25652 1 1250 . 1 1 113 113 ALA HB2 H 1 1.534 0.02 . 1 . . . A 153 ALA HB2 . 25652 1 1251 . 1 1 113 113 ALA HB3 H 1 1.534 0.02 . 1 . . . A 153 ALA HB3 . 25652 1 1252 . 1 1 113 113 ALA CA C 13 53.784 0.40 . 1 . . . A 153 ALA CA . 25652 1 1253 . 1 1 113 113 ALA CB C 13 18.635 0.40 . 1 . . . A 153 ALA CB . 25652 1 1254 . 1 1 113 113 ALA N N 15 122.168 0.40 . 1 . . . A 153 ALA N . 25652 1 1255 . 1 1 114 114 VAL H H 1 7.651 0.02 . 1 . . . A 154 VAL H . 25652 1 1256 . 1 1 114 114 VAL HA H 1 4.172 0.02 . 1 . . . A 154 VAL HA . 25652 1 1257 . 1 1 114 114 VAL HB H 1 2.251 0.02 . 1 . . . A 154 VAL HB . 25652 1 1258 . 1 1 114 114 VAL HG11 H 1 1.034 0.02 . 2 . . . A 154 VAL HG11 . 25652 1 1259 . 1 1 114 114 VAL HG12 H 1 1.034 0.02 . 2 . . . A 154 VAL HG12 . 25652 1 1260 . 1 1 114 114 VAL HG13 H 1 1.034 0.02 . 2 . . . A 154 VAL HG13 . 25652 1 1261 . 1 1 114 114 VAL HG21 H 1 1.091 0.02 . 2 . . . A 154 VAL HG21 . 25652 1 1262 . 1 1 114 114 VAL HG22 H 1 1.091 0.02 . 2 . . . A 154 VAL HG22 . 25652 1 1263 . 1 1 114 114 VAL HG23 H 1 1.091 0.02 . 2 . . . A 154 VAL HG23 . 25652 1 1264 . 1 1 114 114 VAL CA C 13 63.139 0.40 . 1 . . . A 154 VAL CA . 25652 1 1265 . 1 1 114 114 VAL CB C 13 32.383 0.40 . 1 . . . A 154 VAL CB . 25652 1 1266 . 1 1 114 114 VAL CG1 C 13 21.542 0.40 . 1 . . . A 154 VAL CG1 . 25652 1 1267 . 1 1 114 114 VAL CG2 C 13 20.862 0.40 . 1 . . . A 154 VAL CG2 . 25652 1 1268 . 1 1 114 114 VAL N N 15 115.440 0.40 . 1 . . . A 154 VAL N . 25652 1 1269 . 1 1 115 115 ASN H H 1 8.178 0.02 . 1 . . . A 155 ASN H . 25652 1 1270 . 1 1 115 115 ASN HA H 1 4.827 0.02 . 1 . . . A 155 ASN HA . 25652 1 1271 . 1 1 115 115 ASN HB2 H 1 2.861 0.02 . 2 . . . A 155 ASN HB2 . 25652 1 1272 . 1 1 115 115 ASN HB3 H 1 2.917 0.02 . 2 . . . A 155 ASN HB3 . 25652 1 1273 . 1 1 115 115 ASN HD21 H 1 7.544 0.02 . 2 . . . A 155 ASN HD21 . 25652 1 1274 . 1 1 115 115 ASN HD22 H 1 7.019 0.02 . 2 . . . A 155 ASN HD22 . 25652 1 1275 . 1 1 115 115 ASN CA C 13 53.906 0.40 . 1 . . . A 155 ASN CA . 25652 1 1276 . 1 1 115 115 ASN CB C 13 39.085 0.40 . 1 . . . A 155 ASN CB . 25652 1 1277 . 1 1 115 115 ASN N N 15 120.174 0.40 . 1 . . . A 155 ASN N . 25652 1 1278 . 1 1 115 115 ASN ND2 N 15 112.222 0.40 . 1 . . . A 155 ASN ND2 . 25652 1 1279 . 1 1 116 116 SER H H 1 8.276 0.02 . 1 . . . A 156 SER H . 25652 1 1280 . 1 1 116 116 SER HA H 1 4.422 0.02 . 1 . . . A 156 SER HA . 25652 1 1281 . 1 1 116 116 SER HB2 H 1 3.977 0.02 . 2 . . . A 156 SER HB2 . 25652 1 1282 . 1 1 116 116 SER HB3 H 1 3.977 0.02 . 2 . . . A 156 SER HB3 . 25652 1 1283 . 1 1 116 116 SER CA C 13 59.160 0.40 . 1 . . . A 156 SER CA . 25652 1 1284 . 1 1 116 116 SER CB C 13 63.767 0.40 . 1 . . . A 156 SER CB . 25652 1 1285 . 1 1 116 116 SER N N 15 116.109 0.40 . 1 . . . A 156 SER N . 25652 1 1286 . 1 1 117 117 VAL H H 1 7.964 0.02 . 1 . . . A 157 VAL H . 25652 1 1287 . 1 1 117 117 VAL HA H 1 4.185 0.02 . 1 . . . A 157 VAL HA . 25652 1 1288 . 1 1 117 117 VAL HB H 1 2.158 0.02 . 1 . . . A 157 VAL HB . 25652 1 1289 . 1 1 117 117 VAL HG11 H 1 0.986 0.02 . 2 . . . A 157 VAL HG11 . 25652 1 1290 . 1 1 117 117 VAL HG12 H 1 0.986 0.02 . 2 . . . A 157 VAL HG12 . 25652 1 1291 . 1 1 117 117 VAL HG13 H 1 0.986 0.02 . 2 . . . A 157 VAL HG13 . 25652 1 1292 . 1 1 117 117 VAL HG21 H 1 1.012 0.02 . 2 . . . A 157 VAL HG21 . 25652 1 1293 . 1 1 117 117 VAL HG22 H 1 1.012 0.02 . 2 . . . A 157 VAL HG22 . 25652 1 1294 . 1 1 117 117 VAL HG23 H 1 1.012 0.02 . 2 . . . A 157 VAL HG23 . 25652 1 1295 . 1 1 117 117 VAL CA C 13 62.718 0.40 . 1 . . . A 157 VAL CA . 25652 1 1296 . 1 1 117 117 VAL CB C 13 32.638 0.40 . 1 . . . A 157 VAL CB . 25652 1 1297 . 1 1 117 117 VAL CG1 C 13 21.226 0.40 . 1 . . . A 157 VAL CG1 . 25652 1 1298 . 1 1 117 117 VAL CG2 C 13 20.796 0.40 . 1 . . . A 157 VAL CG2 . 25652 1 1299 . 1 1 117 117 VAL N N 15 121.074 0.40 . 1 . . . A 157 VAL N . 25652 1 1300 . 1 1 118 118 GLN H H 1 8.363 0.02 . 1 . . . A 158 GLN H . 25652 1 1301 . 1 1 118 118 GLN HA H 1 4.414 0.02 . 1 . . . A 158 GLN HA . 25652 1 1302 . 1 1 118 118 GLN HB2 H 1 2.225 0.02 . 2 . . . A 158 GLN HB2 . 25652 1 1303 . 1 1 118 118 GLN HB3 H 1 2.072 0.02 . 2 . . . A 158 GLN HB3 . 25652 1 1304 . 1 1 118 118 GLN HG2 H 1 2.426 0.02 . 2 . . . A 158 GLN HG2 . 25652 1 1305 . 1 1 118 118 GLN HG3 H 1 2.426 0.02 . 2 . . . A 158 GLN HG3 . 25652 1 1306 . 1 1 118 118 GLN CA C 13 56.029 0.40 . 1 . . . A 158 GLN CA . 25652 1 1307 . 1 1 118 118 GLN CB C 13 29.540 0.40 . 1 . . . A 158 GLN CB . 25652 1 1308 . 1 1 118 118 GLN CG C 13 33.873 0.40 . 1 . . . A 158 GLN CG . 25652 1 1309 . 1 1 118 118 GLN N N 15 123.454 0.40 . 1 . . . A 158 GLN N . 25652 1 1310 . 1 1 119 119 SER H H 1 8.308 0.02 . 1 . . . A 159 SER H . 25652 1 1311 . 1 1 119 119 SER HA H 1 4.524 0.02 . 1 . . . A 159 SER HA . 25652 1 1312 . 1 1 119 119 SER HB2 H 1 3.928 0.02 . 2 . . . A 159 SER HB2 . 25652 1 1313 . 1 1 119 119 SER HB3 H 1 3.928 0.02 . 2 . . . A 159 SER HB3 . 25652 1 1314 . 1 1 119 119 SER CA C 13 58.714 0.40 . 1 . . . A 159 SER CA . 25652 1 1315 . 1 1 119 119 SER CB C 13 63.767 0.40 . 1 . . . A 159 SER CB . 25652 1 1316 . 1 1 119 119 SER N N 15 117.041 0.40 . 1 . . . A 159 SER N . 25652 1 1317 . 1 1 120 120 GLY H H 1 8.375 0.02 . 1 . . . A 160 GLY H . 25652 1 1318 . 1 1 120 120 GLY HA2 H 1 4.028 0.02 . 2 . . . A 160 GLY HA2 . 25652 1 1319 . 1 1 120 120 GLY HA3 H 1 4.028 0.02 . 2 . . . A 160 GLY HA3 . 25652 1 1320 . 1 1 120 120 GLY CA C 13 45.520 0.40 . 1 . . . A 160 GLY CA . 25652 1 1321 . 1 1 120 120 GLY N N 15 110.469 0.40 . 1 . . . A 160 GLY N . 25652 1 1322 . 1 1 121 121 ASN H H 1 8.295 0.02 . 1 . . . A 161 ASN H . 25652 1 1323 . 1 1 121 121 ASN HA H 1 4.709 0.02 . 1 . . . A 161 ASN HA . 25652 1 1324 . 1 1 121 121 ASN HB2 H 1 2.793 0.02 . 2 . . . A 161 ASN HB2 . 25652 1 1325 . 1 1 121 121 ASN HB3 H 1 2.793 0.02 . 2 . . . A 161 ASN HB3 . 25652 1 1326 . 1 1 121 121 ASN CB C 13 39.077 0.40 . 1 . . . A 161 ASN CB . 25652 1 1327 . 1 1 121 121 ASN N N 15 118.524 0.40 . 1 . . . A 161 ASN N . 25652 1 1328 . 1 1 122 122 LEU H H 1 8.192 0.02 . 1 . . . A 162 LEU H . 25652 1 1329 . 1 1 122 122 LEU HA H 1 4.395 0.02 . 1 . . . A 162 LEU HA . 25652 1 1330 . 1 1 122 122 LEU HB2 H 1 1.666 0.02 . 2 . . . A 162 LEU HB2 . 25652 1 1331 . 1 1 122 122 LEU HB3 H 1 1.666 0.02 . 2 . . . A 162 LEU HB3 . 25652 1 1332 . 1 1 122 122 LEU CA C 13 55.363 0.40 . 1 . . . A 162 LEU CA . 25652 1 1333 . 1 1 122 122 LEU CB C 13 42.458 0.40 . 1 . . . A 162 LEU CB . 25652 1 1334 . 1 1 123 123 ALA H H 1 7.809 0.02 . 1 . . . A 163 ALA H . 25652 1 1335 . 1 1 123 123 ALA HA H 1 4.159 0.02 . 1 . . . A 163 ALA HA . 25652 1 1336 . 1 1 123 123 ALA HB1 H 1 1.366 0.02 . 1 . . . A 163 ALA HB1 . 25652 1 1337 . 1 1 123 123 ALA HB2 H 1 1.366 0.02 . 1 . . . A 163 ALA HB2 . 25652 1 1338 . 1 1 123 123 ALA HB3 H 1 1.366 0.02 . 1 . . . A 163 ALA HB3 . 25652 1 1339 . 1 1 123 123 ALA CA C 13 54.104 0.40 . 1 . . . A 163 ALA CA . 25652 1 1340 . 1 1 123 123 ALA CB C 13 20.378 0.40 . 1 . . . A 163 ALA CB . 25652 1 stop_ save_ ################################### # 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_RNA-chemical-shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode RNA-chemical-shifts _Assigned_chem_shift_list.Entry_ID 25652 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $40C _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.4 _Assigned_chem_shift_list.Chem_shift_15N_err 0.4 _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 'digital resolution' _Assigned_chem_shift_list.Details 'Chemical shifts for RNA imino protons were obtained from NOESY spectra measured at 5C.' _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 11 '2D 1H-1H NOESY' . . . 25652 2 13 '3D f1-13Cfiltered,f2-13C-edited NOESY aliphatic-HSQC' . . . 25652 2 14 '2D f2-13C-filtered NOESY' . . . 25652 2 15 '3D aliphatic-HSQC-NOESY' . . . 25652 2 31 '2D 1H-1H NOESY' . . . 25652 2 33 '3D 1H-13C NOESY aliphatic' . . . 25652 2 35 '3D f1-13Cfiltered,f2-13C-edited NOESY aliphatic-HSQC' . . . 25652 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 25652 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 . 2 2 1 1 G H1' H 1 5.906 0.02 . 1 . . . B 1 G H1' . 25652 2 2 . 2 2 1 1 G H2' H 1 4.808 0.02 . 1 . . . B 1 G H2' . 25652 2 3 . 2 2 1 1 G H3' H 1 4.999 0.02 . 1 . . . B 1 G H3' . 25652 2 4 . 2 2 1 1 G H4' H 1 4.619 0.02 . 1 . . . B 1 G H4' . 25652 2 5 . 2 2 1 1 G H5' H 1 4.143 0.02 . 2 . . . B 1 G H5' . 25652 2 6 . 2 2 1 1 G H5'' H 1 4.381 0.02 . 2 . . . B 1 G H5'' . 25652 2 7 . 2 2 1 1 G H8 H 1 8.237 0.02 . 1 . . . B 1 G H8 . 25652 2 8 . 2 2 1 1 G C1' C 13 89.329 0.40 . 1 . . . B 1 G C1' . 25652 2 9 . 2 2 1 1 G C2' C 13 71.838 0.40 . 1 . . . B 1 G C2' . 25652 2 10 . 2 2 1 1 G C3' C 13 72.676 0.40 . 1 . . . B 1 G C3' . 25652 2 11 . 2 2 1 1 G C4' C 13 80.852 0.40 . 1 . . . B 1 G C4' . 25652 2 12 . 2 2 1 1 G C5' C 13 63.136 0.40 . 1 . . . B 1 G C5' . 25652 2 13 . 2 2 1 1 G C8 C 13 139.238 0.40 . 1 . . . B 1 G C8 . 25652 2 14 . 2 2 2 2 G H1' H 1 6.013 0.02 . 1 . . . B 2 G H1' . 25652 2 15 . 2 2 2 2 G H2' H 1 4.775 0.02 . 1 . . . B 2 G H2' . 25652 2 16 . 2 2 2 2 G H3' H 1 4.682 0.02 . 1 . . . B 2 G H3' . 25652 2 17 . 2 2 2 2 G H4' H 1 4.550 0.02 . 1 . . . B 2 G H4' . 25652 2 18 . 2 2 2 2 G H5' H 1 4.325 0.02 . 2 . . . B 2 G H5' . 25652 2 19 . 2 2 2 2 G H5'' H 1 4.610 0.02 . 2 . . . B 2 G H5'' . 25652 2 20 . 2 2 2 2 G H8 H 1 7.674 0.02 . 1 . . . B 2 G H8 . 25652 2 21 . 2 2 2 2 G C1' C 13 90.246 0.40 . 1 . . . B 2 G C1' . 25652 2 22 . 2 2 2 2 G C2' C 13 73.073 0.40 . 1 . . . B 2 G C2' . 25652 2 23 . 2 2 2 2 G C3' C 13 70.525 0.40 . 1 . . . B 2 G C3' . 25652 2 24 . 2 2 2 2 G C4' C 13 79.696 0.40 . 1 . . . B 2 G C4' . 25652 2 25 . 2 2 2 2 G C5' C 13 63.512 0.40 . 1 . . . B 2 G C5' . 25652 2 26 . 2 2 2 2 G C8 C 13 136.761 0.40 . 1 . . . B 2 G C8 . 25652 2 27 . 2 2 3 3 G H1' H 1 5.844 0.02 . 1 . . . B 3 G H1' . 25652 2 28 . 2 2 3 3 G H2' H 1 4.689 0.02 . 1 . . . B 3 G H2' . 25652 2 29 . 2 2 3 3 G H3' H 1 4.658 0.02 . 1 . . . B 3 G H3' . 25652 2 30 . 2 2 3 3 G H4' H 1 4.538 0.02 . 1 . . . B 3 G H4' . 25652 2 31 . 2 2 3 3 G H5' H 1 4.130 0.02 . 2 . . . B 3 G H5' . 25652 2 32 . 2 2 3 3 G H5'' H 1 4.593 0.02 . 2 . . . B 3 G H5'' . 25652 2 33 . 2 2 3 3 G H8 H 1 7.327 0.02 . 1 . . . B 3 G H8 . 25652 2 34 . 2 2 3 3 G C1' C 13 90.329 0.40 . 1 . . . B 3 G C1' . 25652 2 35 . 2 2 3 3 G C2' C 13 72.994 0.40 . 1 . . . B 3 G C2' . 25652 2 36 . 2 2 3 3 G C3' C 13 70.532 0.40 . 1 . . . B 3 G C3' . 25652 2 37 . 2 2 3 3 G C4' C 13 79.503 0.40 . 1 . . . B 3 G C4' . 25652 2 38 . 2 2 3 3 G C5' C 13 63.401 0.40 . 1 . . . B 3 G C5' . 25652 2 39 . 2 2 3 3 G C8 C 13 136.384 0.40 . 1 . . . B 3 G C8 . 25652 2 40 . 2 2 4 4 A H1' H 1 6.095 0.02 . 1 . . . B 4 A H1' . 25652 2 41 . 2 2 4 4 A H2 H 1 7.948 0.02 . 1 . . . B 4 A H2 . 25652 2 42 . 2 2 4 4 A H2' H 1 4.679 0.02 . 1 . . . B 4 A H2' . 25652 2 43 . 2 2 4 4 A H3' H 1 4.687 0.02 . 1 . . . B 4 A H3' . 25652 2 44 . 2 2 4 4 A H4' H 1 4.524 0.02 . 1 . . . B 4 A H4' . 25652 2 45 . 2 2 4 4 A H5' H 1 4.144 0.02 . 2 . . . B 4 A H5' . 25652 2 46 . 2 2 4 4 A H5'' H 1 4.672 0.02 . 2 . . . B 4 A H5'' . 25652 2 47 . 2 2 4 4 A H8 H 1 7.919 0.02 . 1 . . . B 4 A H8 . 25652 2 48 . 2 2 4 4 A C1' C 13 90.323 0.40 . 1 . . . B 4 A C1' . 25652 2 49 . 2 2 4 4 A C2 C 13 154.327 0.40 . 1 . . . B 4 A C2 . 25652 2 50 . 2 2 4 4 A C2' C 13 72.870 0.40 . 1 . . . B 4 A C2' . 25652 2 51 . 2 2 4 4 A C3' C 13 70.316 0.40 . 1 . . . B 4 A C3' . 25652 2 52 . 2 2 4 4 A C4' C 13 79.404 0.40 . 1 . . . B 4 A C4' . 25652 2 53 . 2 2 4 4 A C5' C 13 62.646 0.40 . 1 . . . B 4 A C5' . 25652 2 54 . 2 2 4 4 A C8 C 13 139.452 0.40 . 1 . . . B 4 A C8 . 25652 2 55 . 2 2 5 5 C H1' H 1 5.468 0.02 . 1 . . . B 5 C H1' . 25652 2 56 . 2 2 5 5 C H2' H 1 4.414 0.02 . 1 . . . B 5 C H2' . 25652 2 57 . 2 2 5 5 C H3' H 1 4.381 0.02 . 1 . . . B 5 C H3' . 25652 2 58 . 2 2 5 5 C H4' H 1 4.454 0.02 . 1 . . . B 5 C H4' . 25652 2 59 . 2 2 5 5 C H5 H 1 5.346 0.02 . 1 . . . B 5 C H5 . 25652 2 60 . 2 2 5 5 C H5' H 1 4.127 0.02 . 2 . . . B 5 C H5' . 25652 2 61 . 2 2 5 5 C H5'' H 1 4.545 0.02 . 2 . . . B 5 C H5'' . 25652 2 62 . 2 2 5 5 C H6 H 1 7.497 0.02 . 1 . . . B 5 C H6 . 25652 2 63 . 2 2 5 5 C C1' C 13 91.284 0.40 . 1 . . . B 5 C C1' . 25652 2 64 . 2 2 5 5 C C2' C 13 73.017 0.40 . 1 . . . B 5 C C2' . 25652 2 65 . 2 2 5 5 C C3' C 13 70.155 0.40 . 1 . . . B 5 C C3' . 25652 2 66 . 2 2 5 5 C C4' C 13 79.297 0.40 . 1 . . . B 5 C C4' . 25652 2 67 . 2 2 5 5 C C5 C 13 94.817 0.40 . 1 . . . B 5 C C5 . 25652 2 68 . 2 2 5 5 C C5' C 13 62.940 0.40 . 1 . . . B 5 C C5' . 25652 2 69 . 2 2 5 5 C C6 C 13 140.894 0.40 . 1 . . . B 5 C C6 . 25652 2 70 . 2 2 6 6 C H1' H 1 5.635 0.02 . 1 . . . B 6 C H1' . 25652 2 71 . 2 2 6 6 C H2' H 1 4.667 0.02 . 1 . . . B 6 C H2' . 25652 2 72 . 2 2 6 6 C H3' H 1 4.536 0.02 . 1 . . . B 6 C H3' . 25652 2 73 . 2 2 6 6 C H4' H 1 4.449 0.02 . 1 . . . B 6 C H4' . 25652 2 74 . 2 2 6 6 C H5 H 1 5.589 0.02 . 1 . . . B 6 C H5 . 25652 2 75 . 2 2 6 6 C H5' H 1 4.167 0.02 . 2 . . . B 6 C H5' . 25652 2 76 . 2 2 6 6 C H5'' H 1 4.632 0.02 . 2 . . . B 6 C H5'' . 25652 2 77 . 2 2 6 6 C H6 H 1 7.833 0.02 . 1 . . . B 6 C H6 . 25652 2 78 . 2 2 6 6 C C1' C 13 91.584 0.40 . 1 . . . B 6 C C1' . 25652 2 79 . 2 2 6 6 C C2' C 13 72.919 0.40 . 1 . . . B 6 C C2' . 25652 2 80 . 2 2 6 6 C C3' C 13 70.079 0.40 . 1 . . . B 6 C C3' . 25652 2 81 . 2 2 6 6 C C4' C 13 79.358 0.40 . 1 . . . B 6 C C4' . 25652 2 82 . 2 2 6 6 C C5 C 13 95.258 0.40 . 1 . . . B 6 C C5 . 25652 2 83 . 2 2 6 6 C C5' C 13 62.228 0.40 . 1 . . . B 6 C C5' . 25652 2 84 . 2 2 6 6 C C6 C 13 141.863 0.40 . 1 . . . B 6 C C6 . 25652 2 85 . 2 2 7 7 U H1' H 1 5.623 0.02 . 1 . . . B 7 U H1' . 25652 2 86 . 2 2 7 7 U H2' H 1 4.681 0.02 . 1 . . . B 7 U H2' . 25652 2 87 . 2 2 7 7 U H3' H 1 4.690 0.02 . 1 . . . B 7 U H3' . 25652 2 88 . 2 2 7 7 U H4' H 1 4.480 0.02 . 1 . . . B 7 U H4' . 25652 2 89 . 2 2 7 7 U H5 H 1 5.484 0.02 . 1 . . . B 7 U H5 . 25652 2 90 . 2 2 7 7 U H5' H 1 4.162 0.02 . 2 . . . B 7 U H5' . 25652 2 91 . 2 2 7 7 U H5'' H 1 4.641 0.02 . 2 . . . B 7 U H5'' . 25652 2 92 . 2 2 7 7 U H6 H 1 7.934 0.02 . 1 . . . B 7 U H6 . 25652 2 93 . 2 2 7 7 U C1' C 13 90.923 0.40 . 1 . . . B 7 U C1' . 25652 2 94 . 2 2 7 7 U C2' C 13 72.846 0.40 . 1 . . . B 7 U C2' . 25652 2 95 . 2 2 7 7 U C3' C 13 70.049 0.40 . 1 . . . B 7 U C3' . 25652 2 96 . 2 2 7 7 U C4' C 13 79.419 0.40 . 1 . . . B 7 U C4' . 25652 2 97 . 2 2 7 7 U C5 C 13 100.983 0.40 . 1 . . . B 7 U C5 . 25652 2 98 . 2 2 7 7 U C5' C 13 62.007 0.40 . 1 . . . B 7 U C5' . 25652 2 99 . 2 2 7 7 U C6 C 13 141.977 0.40 . 1 . . . B 7 U C6 . 25652 2 100 . 2 2 8 8 G H1' H 1 5.861 0.02 . 1 . . . B 8 G H1' . 25652 2 101 . 2 2 8 8 G H2' H 1 4.675 0.02 . 1 . . . B 8 G H2' . 25652 2 102 . 2 2 8 8 G H3' H 1 4.683 0.02 . 1 . . . B 8 G H3' . 25652 2 103 . 2 2 8 8 G H4' H 1 4.468 0.02 . 1 . . . B 8 G H4' . 25652 2 104 . 2 2 8 8 G H5' H 1 4.235 0.02 . 2 . . . B 8 G H5' . 25652 2 105 . 2 2 8 8 G H5'' H 1 4.565 0.02 . 2 . . . B 8 G H5'' . 25652 2 106 . 2 2 8 8 G H8 H 1 7.800 0.02 . 1 . . . B 8 G H8 . 25652 2 107 . 2 2 8 8 G C1' C 13 89.843 0.40 . 1 . . . B 8 G C1' . 25652 2 108 . 2 2 8 8 G C2' C 13 72.895 0.40 . 1 . . . B 8 G C2' . 25652 2 109 . 2 2 8 8 G C3' C 13 70.241 0.40 . 1 . . . B 8 G C3' . 25652 2 110 . 2 2 8 8 G C4' C 13 79.457 0.40 . 1 . . . B 8 G C4' . 25652 2 111 . 2 2 8 8 G C5' C 13 63.105 0.40 . 1 . . . B 8 G C5' . 25652 2 112 . 2 2 8 8 G C8 C 13 136.550 0.40 . 1 . . . B 8 G C8 . 25652 2 113 . 2 2 9 9 G H1' H 1 5.792 0.02 . 1 . . . B 9 G H1' . 25652 2 114 . 2 2 9 9 G H2' H 1 4.489 0.02 . 1 . . . B 9 G H2' . 25652 2 115 . 2 2 9 9 G H3' H 1 4.428 0.02 . 1 . . . B 9 G H3' . 25652 2 116 . 2 2 9 9 G H4' H 1 4.499 0.02 . 1 . . . B 9 G H4' . 25652 2 117 . 2 2 9 9 G H5' H 1 4.117 0.02 . 2 . . . B 9 G H5' . 25652 2 118 . 2 2 9 9 G H5'' H 1 4.517 0.02 . 2 . . . B 9 G H5'' . 25652 2 119 . 2 2 9 9 G H8 H 1 7.254 0.02 . 1 . . . B 9 G H8 . 25652 2 120 . 2 2 9 9 G C1' C 13 89.843 0.40 . 1 . . . B 9 G C1' . 25652 2 121 . 2 2 9 9 G C2' C 13 73.234 0.40 . 1 . . . B 9 G C2' . 25652 2 122 . 2 2 9 9 G C3' C 13 70.737 0.40 . 1 . . . B 9 G C3' . 25652 2 123 . 2 2 9 9 G C4' C 13 79.741 0.40 . 1 . . . B 9 G C4' . 25652 2 124 . 2 2 9 9 G C5' C 13 63.433 0.40 . 1 . . . B 9 G C5' . 25652 2 125 . 2 2 9 9 G C8 C 13 136.086 0.40 . 1 . . . B 9 G C8 . 25652 2 126 . 2 2 10 10 U H1' H 1 5.811 0.02 . 1 . . . B 10 U H1' . 25652 2 127 . 2 2 10 10 U H2' H 1 4.262 0.02 . 1 . . . B 10 U H2' . 25652 2 128 . 2 2 10 10 U H3' H 1 4.704 0.02 . 1 . . . B 10 U H3' . 25652 2 129 . 2 2 10 10 U H4' H 1 4.453 0.02 . 1 . . . B 10 U H4' . 25652 2 130 . 2 2 10 10 U H5 H 1 5.477 0.02 . 1 . . . B 10 U H5 . 25652 2 131 . 2 2 10 10 U H5' H 1 4.126 0.02 . 2 . . . B 10 U H5' . 25652 2 132 . 2 2 10 10 U H5'' H 1 4.339 0.02 . 2 . . . B 10 U H5'' . 25652 2 133 . 2 2 10 10 U H6 H 1 7.691 0.02 . 1 . . . B 10 U H6 . 25652 2 134 . 2 2 10 10 U C1' C 13 89.253 0.40 . 1 . . . B 10 U C1' . 25652 2 135 . 2 2 10 10 U C2' C 13 73.651 0.40 . 1 . . . B 10 U C2' . 25652 2 136 . 2 2 10 10 U C3' C 13 73.758 0.40 . 1 . . . B 10 U C3' . 25652 2 137 . 2 2 10 10 U C4' C 13 81.318 0.40 . 1 . . . B 10 U C4' . 25652 2 138 . 2 2 10 10 U C5 C 13 101.820 0.40 . 1 . . . B 10 U C5 . 25652 2 139 . 2 2 10 10 U C5' C 13 62.909 0.40 . 1 . . . B 10 U C5' . 25652 2 140 . 2 2 10 10 U C6 C 13 141.803 0.40 . 1 . . . B 10 U C6 . 25652 2 141 . 2 2 11 11 C H2' H 1 4.264 0.02 . 1 . . . B 11 C H2' . 25652 2 142 . 2 2 11 11 C H3' H 1 4.380 0.02 . 1 . . . B 11 C H3' . 25652 2 143 . 2 2 11 11 C H4' H 1 4.350 0.02 . 1 . . . B 11 C H4' . 25652 2 144 . 2 2 11 11 C H5 H 1 6.013 0.02 . 1 . . . B 11 C H5 . 25652 2 145 . 2 2 11 11 C H5' H 1 4.133 0.02 . 2 . . . B 11 C H5' . 25652 2 146 . 2 2 11 11 C H5'' H 1 4.173 0.02 . 2 . . . B 11 C H5'' . 25652 2 147 . 2 2 11 11 C H6 H 1 7.790 0.02 . 1 . . . B 11 C H6 . 25652 2 148 . 2 2 11 11 C C2' C 13 74.412 0.40 . 1 . . . B 11 C C2' . 25652 2 149 . 2 2 11 11 C C3' C 13 70.138 0.40 . 1 . . . B 11 C C3' . 25652 2 150 . 2 2 11 11 C C4' C 13 83.151 0.40 . 1 . . . B 11 C C4' . 25652 2 151 . 2 2 11 11 C C5 C 13 96.495 0.40 . 1 . . . B 11 C C5 . 25652 2 152 . 2 2 11 11 C C5' C 13 65.094 0.40 . 1 . . . B 11 C C5' . 25652 2 153 . 2 2 11 11 C C6 C 13 143.348 0.40 . 1 . . . B 11 C C6 . 25652 2 154 . 2 2 12 12 U H1' H 1 5.987 0.02 . 1 . . . B 12 U H1' . 25652 2 155 . 2 2 12 12 U H2' H 1 4.361 0.02 . 1 . . . B 12 U H2' . 25652 2 156 . 2 2 12 12 U H3' H 1 4.758 0.02 . 1 . . . B 12 U H3' . 25652 2 157 . 2 2 12 12 U H4' H 1 4.480 0.02 . 1 . . . B 12 U H4' . 25652 2 158 . 2 2 12 12 U H5' H 1 4.113 0.02 . 2 . . . B 12 U H5' . 25652 2 159 . 2 2 12 12 U H5'' H 1 4.225 0.02 . 2 . . . B 12 U H5'' . 25652 2 160 . 2 2 12 12 U H6 H 1 7.608 0.02 . 1 . . . B 12 U H6 . 25652 2 161 . 2 2 12 12 U C1' C 13 87.132 0.40 . 1 . . . B 12 U C1' . 25652 2 162 . 2 2 12 12 U C2' C 13 74.113 0.40 . 1 . . . B 12 U C2' . 25652 2 163 . 2 2 12 12 U C3' C 13 76.486 0.40 . 1 . . . B 12 U C3' . 25652 2 164 . 2 2 12 12 U C4' C 13 83.539 0.40 . 1 . . . B 12 U C4' . 25652 2 165 . 2 2 12 12 U C5' C 13 65.594 0.40 . 1 . . . B 12 U C5' . 25652 2 166 . 2 2 12 12 U C6 C 13 143.433 0.40 . 1 . . . B 12 U C6 . 25652 2 167 . 2 2 13 13 U H1' H 1 6.008 0.02 . 1 . . . B 13 U H1' . 25652 2 168 . 2 2 13 13 U H2' H 1 4.466 0.02 . 1 . . . B 13 U H2' . 25652 2 169 . 2 2 13 13 U H3' H 1 4.786 0.02 . 1 . . . B 13 U H3' . 25652 2 170 . 2 2 13 13 U H4' H 1 4.451 0.02 . 1 . . . B 13 U H4' . 25652 2 171 . 2 2 13 13 U H5 H 1 6.062 0.02 . 1 . . . B 13 U H5 . 25652 2 172 . 2 2 13 13 U H5' H 1 4.158 0.02 . 2 . . . B 13 U H5' . 25652 2 173 . 2 2 13 13 U H5'' H 1 4.236 0.02 . 2 . . . B 13 U H5'' . 25652 2 174 . 2 2 13 13 U H6 H 1 7.937 0.02 . 1 . . . B 13 U H6 . 25652 2 175 . 2 2 13 13 U C1' C 13 88.081 0.40 . 1 . . . B 13 U C1' . 25652 2 176 . 2 2 13 13 U C2' C 13 72.809 0.40 . 1 . . . B 13 U C2' . 25652 2 177 . 2 2 13 13 U C3' C 13 74.556 0.40 . 1 . . . B 13 U C3' . 25652 2 178 . 2 2 13 13 U C4' C 13 82.698 0.40 . 1 . . . B 13 U C4' . 25652 2 179 . 2 2 13 13 U C5 C 13 103.096 0.40 . 1 . . . B 13 U C5 . 25652 2 180 . 2 2 13 13 U C5' C 13 65.180 0.40 . 1 . . . B 13 U C5' . 25652 2 181 . 2 2 13 13 U C6 C 13 143.771 0.40 . 1 . . . B 13 U C6 . 25652 2 182 . 2 2 14 14 U H1' H 1 5.981 0.02 . 1 . . . B 14 U H1' . 25652 2 183 . 2 2 14 14 U H2' H 1 4.587 0.02 . 1 . . . B 14 U H2' . 25652 2 184 . 2 2 14 14 U H3' H 1 4.724 0.02 . 1 . . . B 14 U H3' . 25652 2 185 . 2 2 14 14 U H4' H 1 4.591 0.02 . 1 . . . B 14 U H4' . 25652 2 186 . 2 2 14 14 U H5 H 1 5.997 0.02 . 1 . . . B 14 U H5 . 25652 2 187 . 2 2 14 14 U H5' H 1 4.227 0.02 . 2 . . . B 14 U H5' . 25652 2 188 . 2 2 14 14 U H5'' H 1 4.357 0.02 . 2 . . . B 14 U H5'' . 25652 2 189 . 2 2 14 14 U H6 H 1 8.029 0.02 . 1 . . . B 14 U H6 . 25652 2 190 . 2 2 14 14 U C1' C 13 88.664 0.40 . 1 . . . B 14 U C1' . 25652 2 191 . 2 2 14 14 U C2' C 13 72.624 0.40 . 1 . . . B 14 U C2' . 25652 2 192 . 2 2 14 14 U C3' C 13 73.965 0.40 . 1 . . . B 14 U C3' . 25652 2 193 . 2 2 14 14 U C4' C 13 82.273 0.40 . 1 . . . B 14 U C4' . 25652 2 194 . 2 2 14 14 U C5 C 13 102.534 0.40 . 1 . . . B 14 U C5 . 25652 2 195 . 2 2 14 14 U C5' C 13 65.267 0.40 . 1 . . . B 14 U C5' . 25652 2 196 . 2 2 14 14 U C6 C 13 144.139 0.40 . 1 . . . B 14 U C6 . 25652 2 197 . 2 2 15 15 C H1' H 1 5.690 0.02 . 1 . . . B 15 C H1' . 25652 2 198 . 2 2 15 15 C H2' H 1 4.585 0.02 . 1 . . . B 15 C H2' . 25652 2 199 . 2 2 15 15 C H3' H 1 4.581 0.02 . 1 . . . B 15 C H3' . 25652 2 200 . 2 2 15 15 C H4' H 1 4.599 0.02 . 1 . . . B 15 C H4' . 25652 2 201 . 2 2 15 15 C H5 H 1 6.105 0.02 . 1 . . . B 15 C H5 . 25652 2 202 . 2 2 15 15 C H5' H 1 4.327 0.02 . 2 . . . B 15 C H5' . 25652 2 203 . 2 2 15 15 C H5'' H 1 4.514 0.02 . 2 . . . B 15 C H5'' . 25652 2 204 . 2 2 15 15 C H6 H 1 8.095 0.02 . 1 . . . B 15 C H6 . 25652 2 205 . 2 2 15 15 C C1' C 13 91.445 0.40 . 1 . . . B 15 C C1' . 25652 2 206 . 2 2 15 15 C C2' C 13 72.786 0.40 . 1 . . . B 15 C C2' . 25652 2 207 . 2 2 15 15 C C3' C 13 71.261 0.40 . 1 . . . B 15 C C3' . 25652 2 208 . 2 2 15 15 C C4' C 13 80.031 0.40 . 1 . . . B 15 C C4' . 25652 2 209 . 2 2 15 15 C C5 C 13 95.976 0.40 . 1 . . . B 15 C C5 . 25652 2 210 . 2 2 15 15 C C5' C 13 64.374 0.40 . 1 . . . B 15 C C5' . 25652 2 211 . 2 2 15 15 C C6 C 13 143.010 0.40 . 1 . . . B 15 C C6 . 25652 2 212 . 2 2 16 16 C H1' H 1 5.596 0.02 . 1 . . . B 16 C H1' . 25652 2 213 . 2 2 16 16 C H2' H 1 4.673 0.02 . 1 . . . B 16 C H2' . 25652 2 214 . 2 2 16 16 C H3' H 1 4.674 0.02 . 1 . . . B 16 C H3' . 25652 2 215 . 2 2 16 16 C H4' H 1 4.472 0.02 . 1 . . . B 16 C H4' . 25652 2 216 . 2 2 16 16 C H5 H 1 5.758 0.02 . 1 . . . B 16 C H5 . 25652 2 217 . 2 2 16 16 C H5' H 1 4.164 0.02 . 2 . . . B 16 C H5' . 25652 2 218 . 2 2 16 16 C H5'' H 1 4.602 0.02 . 2 . . . B 16 C H5'' . 25652 2 219 . 2 2 16 16 C H6 H 1 7.841 0.02 . 1 . . . B 16 C H6 . 25652 2 220 . 2 2 16 16 C C1' C 13 91.729 0.40 . 1 . . . B 16 C C1' . 25652 2 221 . 2 2 16 16 C C2' C 13 72.910 0.40 . 1 . . . B 16 C C2' . 25652 2 222 . 2 2 16 16 C C3' C 13 70.262 0.40 . 1 . . . B 16 C C3' . 25652 2 223 . 2 2 16 16 C C4' C 13 79.404 0.40 . 1 . . . B 16 C C4' . 25652 2 224 . 2 2 16 16 C C5 C 13 95.104 0.40 . 1 . . . B 16 C C5 . 25652 2 225 . 2 2 16 16 C C5' C 13 62.567 0.40 . 1 . . . B 16 C C5' . 25652 2 226 . 2 2 16 16 C C6 C 13 141.716 0.40 . 1 . . . B 16 C C6 . 25652 2 227 . 2 2 17 17 A H1' H 1 6.016 0.02 . 1 . . . B 17 A H1' . 25652 2 228 . 2 2 17 17 A H2 H 1 7.117 0.02 . 1 . . . B 17 A H2 . 25652 2 229 . 2 2 17 17 A H2' H 1 4.781 0.02 . 1 . . . B 17 A H2' . 25652 2 230 . 2 2 17 17 A H3' H 1 4.837 0.02 . 1 . . . B 17 A H3' . 25652 2 231 . 2 2 17 17 A H4' H 1 4.539 0.02 . 1 . . . B 17 A H4' . 25652 2 232 . 2 2 17 17 A H5' H 1 4.272 0.02 . 2 . . . B 17 A H5' . 25652 2 233 . 2 2 17 17 A H5'' H 1 4.657 0.02 . 2 . . . B 17 A H5'' . 25652 2 234 . 2 2 17 17 A H8 H 1 8.163 0.02 . 1 . . . B 17 A H8 . 25652 2 235 . 2 2 17 17 A C1' C 13 90.058 0.40 . 1 . . . B 17 A C1' . 25652 2 236 . 2 2 17 17 A C2 C 13 152.781 0.40 . 1 . . . B 17 A C2 . 25652 2 237 . 2 2 17 17 A C2' C 13 73.299 0.40 . 1 . . . B 17 A C2' . 25652 2 238 . 2 2 17 17 A C3' C 13 70.373 0.40 . 1 . . . B 17 A C3' . 25652 2 239 . 2 2 17 17 A C4' C 13 79.346 0.40 . 1 . . . B 17 A C4' . 25652 2 240 . 2 2 17 17 A C5' C 13 62.739 0.40 . 1 . . . B 17 A C5' . 25652 2 241 . 2 2 17 17 A C8 C 13 139.742 0.40 . 1 . . . B 17 A C8 . 25652 2 242 . 2 2 18 18 G H1' H 1 5.685 0.02 . 1 . . . B 18 G H1' . 25652 2 243 . 2 2 18 18 G H2' H 1 4.651 0.02 . 1 . . . B 18 G H2' . 25652 2 244 . 2 2 18 18 G H3' H 1 4.524 0.02 . 1 . . . B 18 G H3' . 25652 2 245 . 2 2 18 18 G H4' H 1 4.479 0.02 . 1 . . . B 18 G H4' . 25652 2 246 . 2 2 18 18 G H5' H 1 4.166 0.02 . 2 . . . B 18 G H5' . 25652 2 247 . 2 2 18 18 G H5'' H 1 4.535 0.02 . 2 . . . B 18 G H5'' . 25652 2 248 . 2 2 18 18 G H8 H 1 7.255 0.02 . 1 . . . B 18 G H8 . 25652 2 249 . 2 2 18 18 G C1' C 13 89.903 0.40 . 1 . . . B 18 G C1' . 25652 2 250 . 2 2 18 18 G C2' C 13 72.875 0.40 . 1 . . . B 18 G C2' . 25652 2 251 . 2 2 18 18 G C3' C 13 70.368 0.40 . 1 . . . B 18 G C3' . 25652 2 252 . 2 2 18 18 G C4' C 13 79.404 0.40 . 1 . . . B 18 G C4' . 25652 2 253 . 2 2 18 18 G C5' C 13 63.309 0.40 . 1 . . . B 18 G C5' . 25652 2 254 . 2 2 18 18 G C8 C 13 136.237 0.40 . 1 . . . B 18 G C8 . 25652 2 255 . 2 2 19 19 G H1' H 1 5.810 0.02 . 1 . . . B 19 G H1' . 25652 2 256 . 2 2 19 19 G H2' H 1 4.539 0.02 . 1 . . . B 19 G H2' . 25652 2 257 . 2 2 19 19 G H3' H 1 4.528 0.02 . 1 . . . B 19 G H3' . 25652 2 258 . 2 2 19 19 G H4' H 1 4.469 0.02 . 1 . . . B 19 G H4' . 25652 2 259 . 2 2 19 19 G H5' H 1 4.125 0.02 . 2 . . . B 19 G H5' . 25652 2 260 . 2 2 19 19 G H5'' H 1 4.534 0.02 . 2 . . . B 19 G H5'' . 25652 2 261 . 2 2 19 19 G H8 H 1 7.273 0.02 . 1 . . . B 19 G H8 . 25652 2 262 . 2 2 19 19 G C1' C 13 90.480 0.40 . 1 . . . B 19 G C1' . 25652 2 263 . 2 2 19 19 G C2' C 13 73.067 0.40 . 1 . . . B 19 G C2' . 25652 2 264 . 2 2 19 19 G C3' C 13 70.455 0.40 . 1 . . . B 19 G C3' . 25652 2 265 . 2 2 19 19 G C4' C 13 79.578 0.40 . 1 . . . B 19 G C4' . 25652 2 266 . 2 2 19 19 G C5' C 13 63.253 0.40 . 1 . . . B 19 G C5' . 25652 2 267 . 2 2 19 19 G C8 C 13 136.352 0.40 . 1 . . . B 19 G C8 . 25652 2 268 . 2 2 20 20 U H1' H 1 5.701 0.02 . 1 . . . B 20 U H1' . 25652 2 269 . 2 2 20 20 U H2' H 1 4.652 0.02 . 1 . . . B 20 U H2' . 25652 2 270 . 2 2 20 20 U H3' H 1 4.548 0.02 . 1 . . . B 20 U H3' . 25652 2 271 . 2 2 20 20 U H4' H 1 4.477 0.02 . 1 . . . B 20 U H4' . 25652 2 272 . 2 2 20 20 U H5 H 1 5.160 0.02 . 1 . . . B 20 U H5 . 25652 2 273 . 2 2 20 20 U H5' H 1 4.146 0.02 . 2 . . . B 20 U H5' . 25652 2 274 . 2 2 20 20 U H5'' H 1 4.621 0.02 . 2 . . . B 20 U H5'' . 25652 2 275 . 2 2 20 20 U H6 H 1 7.889 0.02 . 1 . . . B 20 U H6 . 25652 2 276 . 2 2 20 20 U C1' C 13 91.132 0.40 . 1 . . . B 20 U C1' . 25652 2 277 . 2 2 20 20 U C2' C 13 72.989 0.40 . 1 . . . B 20 U C2' . 25652 2 278 . 2 2 20 20 U C3' C 13 69.799 0.40 . 1 . . . B 20 U C3' . 25652 2 279 . 2 2 20 20 U C4' C 13 79.511 0.40 . 1 . . . B 20 U C4' . 25652 2 280 . 2 2 20 20 U C5 C 13 99.885 0.40 . 1 . . . B 20 U C5 . 25652 2 281 . 2 2 20 20 U C5' C 13 62.227 0.40 . 1 . . . B 20 U C5' . 25652 2 282 . 2 2 20 20 U C6 C 13 142.171 0.40 . 1 . . . B 20 U C6 . 25652 2 283 . 2 2 21 21 C H1' H 1 5.722 0.02 . 1 . . . B 21 C H1' . 25652 2 284 . 2 2 21 21 C H2' H 1 4.463 0.02 . 1 . . . B 21 C H2' . 25652 2 285 . 2 2 21 21 C H3' H 1 4.534 0.02 . 1 . . . B 21 C H3' . 25652 2 286 . 2 2 21 21 C H4' H 1 4.486 0.02 . 1 . . . B 21 C H4' . 25652 2 287 . 2 2 21 21 C H5 H 1 5.762 0.02 . 1 . . . B 21 C H5 . 25652 2 288 . 2 2 21 21 C H5' H 1 4.248 0.02 . 2 . . . B 21 C H5' . 25652 2 289 . 2 2 21 21 C H5'' H 1 4.588 0.02 . 2 . . . B 21 C H5'' . 25652 2 290 . 2 2 21 21 C H6 H 1 7.931 0.02 . 1 . . . B 21 C H6 . 25652 2 291 . 2 2 21 21 C C1' C 13 91.442 0.40 . 1 . . . B 21 C C1' . 25652 2 292 . 2 2 21 21 C C2' C 13 73.113 0.40 . 1 . . . B 21 C C2' . 25652 2 293 . 2 2 21 21 C C3' C 13 69.953 0.40 . 1 . . . B 21 C C3' . 25652 2 294 . 2 2 21 21 C C4' C 13 79.195 0.40 . 1 . . . B 21 C C4' . 25652 2 295 . 2 2 21 21 C C5 C 13 95.465 0.40 . 1 . . . B 21 C C5 . 25652 2 296 . 2 2 21 21 C C5' C 13 62.889 0.40 . 1 . . . B 21 C C5' . 25652 2 297 . 2 2 21 21 C C6 C 13 141.754 0.40 . 1 . . . B 21 C C6 . 25652 2 298 . 2 2 22 22 C H1' H 1 5.561 0.02 . 1 . . . B 22 C H1' . 25652 2 299 . 2 2 22 22 C H2' H 1 4.336 0.02 . 1 . . . B 22 C H2' . 25652 2 300 . 2 2 22 22 C H3' H 1 4.567 0.02 . 1 . . . B 22 C H3' . 25652 2 301 . 2 2 22 22 C H4' H 1 4.436 0.02 . 1 . . . B 22 C H4' . 25652 2 302 . 2 2 22 22 C H5 H 1 5.591 0.02 . 1 . . . B 22 C H5 . 25652 2 303 . 2 2 22 22 C H5' H 1 4.161 0.02 . 2 . . . B 22 C H5' . 25652 2 304 . 2 2 22 22 C H5'' H 1 4.621 0.02 . 2 . . . B 22 C H5'' . 25652 2 305 . 2 2 22 22 C H6 H 1 7.852 0.02 . 1 . . . B 22 C H6 . 25652 2 306 . 2 2 22 22 C C1' C 13 91.718 0.40 . 1 . . . B 22 C C1' . 25652 2 307 . 2 2 22 22 C C2' C 13 72.949 0.40 . 1 . . . B 22 C C2' . 25652 2 308 . 2 2 22 22 C C3' C 13 69.750 0.40 . 1 . . . B 22 C C3' . 25652 2 309 . 2 2 22 22 C C4' C 13 79.484 0.40 . 1 . . . B 22 C C4' . 25652 2 310 . 2 2 22 22 C C5 C 13 95.426 0.40 . 1 . . . B 22 C C5 . 25652 2 311 . 2 2 22 22 C C5' C 13 62.389 0.40 . 1 . . . B 22 C C5' . 25652 2 312 . 2 2 22 22 C C6 C 13 142.026 0.40 . 1 . . . B 22 C C6 . 25652 2 313 . 2 2 23 23 C H1' H 1 5.843 0.02 . 1 . . . B 23 C H1' . 25652 2 314 . 2 2 23 23 C H2' H 1 4.069 0.02 . 1 . . . B 23 C H2' . 25652 2 315 . 2 2 23 23 C H3' H 1 4.254 0.02 . 1 . . . B 23 C H3' . 25652 2 316 . 2 2 23 23 C H4' H 1 4.248 0.02 . 1 . . . B 23 C H4' . 25652 2 317 . 2 2 23 23 C H5 H 1 5.587 0.02 . 1 . . . B 23 C H5 . 25652 2 318 . 2 2 23 23 C H5' H 1 4.109 0.02 . 2 . . . B 23 C H5' . 25652 2 319 . 2 2 23 23 C H5'' H 1 4.560 0.02 . 2 . . . B 23 C H5'' . 25652 2 320 . 2 2 23 23 C H6 H 1 7.784 0.02 . 1 . . . B 23 C H6 . 25652 2 321 . 2 2 23 23 C C1' C 13 90.074 0.40 . 1 . . . B 23 C C1' . 25652 2 322 . 2 2 23 23 C C2' C 13 74.988 0.40 . 1 . . . B 23 C C2' . 25652 2 323 . 2 2 23 23 C C3' C 13 67.309 0.40 . 1 . . . B 23 C C3' . 25652 2 324 . 2 2 23 23 C C4' C 13 81.044 0.40 . 1 . . . B 23 C C4' . 25652 2 325 . 2 2 23 23 C C5 C 13 95.013 0.40 . 1 . . . B 23 C C5 . 25652 2 326 . 2 2 23 23 C C5' C 13 62.877 0.40 . 1 . . . B 23 C C5' . 25652 2 327 . 2 2 23 23 C C6 C 13 141.966 0.40 . 1 . . . B 23 C C6 . 25652 2 stop_ save_