################################### # 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_chemical_shift_set _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set _Assigned_chem_shift_list.Entry_ID 26698 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details 'Derived from the file: /usr/lab/people/fkieken/ww3/run20/data/aro/aro.ppm' _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26698 1 2 '2D 1H-13C HSQC aliphatic' . . . 26698 1 4 '3D HNCACB' . . . 26698 1 5 '3D CBCA(CO)NH' . . . 26698 1 6 '3D 1H-15N NOESY' . . . 26698 1 7 '3D 1H-13C NOESY aliphatic' . . . 26698 1 8 '3D 1H-13C NOESY aromatic' . . . 26698 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 2 2 SER HA H 1 4.505 . . 1 . . . . 2 SER HA . 26698 1 2 . 1 1 2 2 SER HB2 H 1 3.840 . . 2 . . . . 2 SER HB1 . 26698 1 3 . 1 1 2 2 SER HB3 H 1 3.840 . . 2 . . . . 2 SER HB2 . 26698 1 4 . 1 1 2 2 SER CA C 13 58.300 . . 1 . . . . 2 SER CA . 26698 1 5 . 1 1 2 2 SER CB C 13 63.800 . . 1 . . . . 2 SER CB . 26698 1 6 . 1 1 3 3 LEU H H 1 8.257 . . 1 . . . . 3 LEU HN . 26698 1 7 . 1 1 3 3 LEU HA H 1 4.380 . . 1 . . . . 3 LEU HA . 26698 1 8 . 1 1 3 3 LEU HB2 H 1 1.450 . . 2 . . . . 3 LEU HB1 . 26698 1 9 . 1 1 3 3 LEU HB3 H 1 1.506 . . 2 . . . . 3 LEU HB2 . 26698 1 10 . 1 1 3 3 LEU HG H 1 1.600 . . 1 . . . . 3 LEU HG . 26698 1 11 . 1 1 3 3 LEU HD11 H 1 0.820 . . 2 . . . . 3 LEU HD11 . 26698 1 12 . 1 1 3 3 LEU HD12 H 1 0.820 . . 2 . . . . 3 LEU HD11 . 26698 1 13 . 1 1 3 3 LEU HD13 H 1 0.820 . . 2 . . . . 3 LEU HD11 . 26698 1 14 . 1 1 3 3 LEU HD21 H 1 0.855 . . 2 . . . . 3 LEU HD21 . 26698 1 15 . 1 1 3 3 LEU HD22 H 1 0.855 . . 2 . . . . 3 LEU HD21 . 26698 1 16 . 1 1 3 3 LEU HD23 H 1 0.855 . . 2 . . . . 3 LEU HD21 . 26698 1 17 . 1 1 3 3 LEU CA C 13 55.300 . . 1 . . . . 3 LEU CA . 26698 1 18 . 1 1 3 3 LEU CB C 13 42.900 . . 1 . . . . 3 LEU CB . 26698 1 19 . 1 1 3 3 LEU CG C 13 27.600 . . 1 . . . . 3 LEU CG . 26698 1 20 . 1 1 3 3 LEU CD1 C 13 24.000 . . 1 . . . . 3 LEU CD1 . 26698 1 21 . 1 1 3 3 LEU CD2 C 13 24.000 . . 1 . . . . 3 LEU CD2 . 26698 1 22 . 1 1 3 3 LEU N N 15 125.080 . . 1 . . . . 3 LEU N . 26698 1 23 . 1 1 4 4 GLY H H 1 8.170 . . 1 . . . . 4 GLY HN . 26698 1 24 . 1 1 4 4 GLY HA2 H 1 4.010 . . 2 . . . . 4 GLY HA1 . 26698 1 25 . 1 1 4 4 GLY HA3 H 1 4.030 . . 2 . . . . 4 GLY HA2 . 26698 1 26 . 1 1 4 4 GLY CA C 13 44.200 . . 1 . . . . 4 GLY CA . 26698 1 27 . 1 1 4 4 GLY N N 15 109.800 . . 1 . . . . 4 GLY N . 26698 1 28 . 1 1 5 5 PRO HA H 1 4.474 . . 1 . . . . 5 PRO HA . 26698 1 29 . 1 1 5 5 PRO HB2 H 1 1.905 . . 2 . . . . 5 PRO HB1 . 26698 1 30 . 1 1 5 5 PRO HB3 H 1 2.254 . . 2 . . . . 5 PRO HB2 . 26698 1 31 . 1 1 5 5 PRO HG2 H 1 1.920 . . 2 . . . . 5 PRO HG1 . 26698 1 32 . 1 1 5 5 PRO HG3 H 1 1.980 . . 2 . . . . 5 PRO HG2 . 26698 1 33 . 1 1 5 5 PRO HD2 H 1 3.550 . . 2 . . . . 5 PRO HD1 . 26698 1 34 . 1 1 5 5 PRO HD3 H 1 3.550 . . 2 . . . . 5 PRO HD2 . 26698 1 35 . 1 1 5 5 PRO CA C 13 62.400 . . 1 . . . . 5 PRO CA . 26698 1 36 . 1 1 5 5 PRO CB C 13 32.100 . . 1 . . . . 5 PRO CB . 26698 1 37 . 1 1 5 5 PRO CG C 13 27.200 . . 1 . . . . 5 PRO CG . 26698 1 38 . 1 1 5 5 PRO CD C 13 49.300 . . 1 . . . . 5 PRO CD . 26698 1 39 . 1 1 6 6 LEU H H 1 8.683 . . 1 . . . . 6 LEU HN . 26698 1 40 . 1 1 6 6 LEU HA H 1 4.120 . . 1 . . . . 6 LEU HA . 26698 1 41 . 1 1 6 6 LEU HB2 H 1 1.430 . . 2 . . . . 6 LEU HB1 . 26698 1 42 . 1 1 6 6 LEU HB3 H 1 1.759 . . 2 . . . . 6 LEU HB2 . 26698 1 43 . 1 1 6 6 LEU HG H 1 1.780 . . 1 . . . . 6 LEU HG . 26698 1 44 . 1 1 6 6 LEU HD11 H 1 1.064 . . 2 . . . . 6 LEU HD11 . 26698 1 45 . 1 1 6 6 LEU HD12 H 1 1.064 . . 2 . . . . 6 LEU HD11 . 26698 1 46 . 1 1 6 6 LEU HD13 H 1 1.064 . . 2 . . . . 6 LEU HD11 . 26698 1 47 . 1 1 6 6 LEU HD21 H 1 0.760 . . 2 . . . . 6 LEU HD21 . 26698 1 48 . 1 1 6 6 LEU HD22 H 1 0.760 . . 2 . . . . 6 LEU HD21 . 26698 1 49 . 1 1 6 6 LEU HD23 H 1 0.760 . . 2 . . . . 6 LEU HD21 . 26698 1 50 . 1 1 6 6 LEU CA C 13 53.400 . . 1 . . . . 6 LEU CA . 26698 1 51 . 1 1 6 6 LEU CB C 13 41.400 . . 1 . . . . 6 LEU CB . 26698 1 52 . 1 1 6 6 LEU CG C 13 27.200 . . 1 . . . . 6 LEU CG . 26698 1 53 . 1 1 6 6 LEU CD1 C 13 26.400 . . 1 . . . . 6 LEU CD1 . 26698 1 54 . 1 1 6 6 LEU CD2 C 13 24.000 . . 1 . . . . 6 LEU CD2 . 26698 1 55 . 1 1 6 6 LEU N N 15 123.920 . . 1 . . . . 6 LEU N . 26698 1 56 . 1 1 7 7 PRO HA H 1 4.530 . . 1 . . . . 7 PRO HA . 26698 1 57 . 1 1 7 7 PRO HB2 H 1 1.960 . . 2 . . . . 7 PRO HB1 . 26698 1 58 . 1 1 7 7 PRO HB3 H 1 2.540 . . 2 . . . . 7 PRO HB2 . 26698 1 59 . 1 1 7 7 PRO HG2 H 1 1.590 . . 2 . . . . 7 PRO HG1 . 26698 1 60 . 1 1 7 7 PRO HG3 H 1 1.820 . . 2 . . . . 7 PRO HG2 . 26698 1 61 . 1 1 7 7 PRO HD2 H 1 2.910 . . 2 . . . . 7 PRO HD1 . 26698 1 62 . 1 1 7 7 PRO HD3 H 1 3.420 . . 2 . . . . 7 PRO HD2 . 26698 1 63 . 1 1 7 7 PRO CA C 13 61.200 . . 1 . . . . 7 PRO CA . 26698 1 64 . 1 1 7 7 PRO CB C 13 29.700 . . 1 . . . . 7 PRO CB . 26698 1 65 . 1 1 7 7 PRO CG C 13 27.260 . . 1 . . . . 7 PRO CG . 26698 1 66 . 1 1 7 7 PRO CD C 13 50.180 . . 1 . . . . 7 PRO CD . 26698 1 67 . 1 1 8 8 PRO HA H 1 4.360 . . 1 . . . . 8 PRO HA . 26698 1 68 . 1 1 8 8 PRO HB2 H 1 1.900 . . 2 . . . . 8 PRO HB1 . 26698 1 69 . 1 1 8 8 PRO HB3 H 1 2.310 . . 2 . . . . 8 PRO HB2 . 26698 1 70 . 1 1 8 8 PRO HG2 H 1 2.020 . . 2 . . . . 8 PRO HG1 . 26698 1 71 . 1 1 8 8 PRO HG3 H 1 2.120 . . 2 . . . . 8 PRO HG2 . 26698 1 72 . 1 1 8 8 PRO HD2 H 1 3.610 . . 2 . . . . 8 PRO HD1 . 26698 1 73 . 1 1 8 8 PRO HD3 H 1 3.860 . . 2 . . . . 8 PRO HD2 . 26698 1 74 . 1 1 8 8 PRO CA C 13 64.000 . . 1 . . . . 8 PRO CA . 26698 1 75 . 1 1 8 8 PRO CB C 13 32.080 . . 1 . . . . 8 PRO CB . 26698 1 76 . 1 1 8 8 PRO CG C 13 27.600 . . 1 . . . . 8 PRO CG . 26698 1 77 . 1 1 8 8 PRO CD C 13 50.180 . . 1 . . . . 8 PRO CD . 26698 1 78 . 1 1 9 9 GLY H H 1 8.788 . . 1 . . . . 9 GLY HN . 26698 1 79 . 1 1 9 9 GLY HA2 H 1 3.616 . . 2 . . . . 9 GLY HA1 . 26698 1 80 . 1 1 9 9 GLY HA3 H 1 4.159 . . 2 . . . . 9 GLY HA2 . 26698 1 81 . 1 1 9 9 GLY CA C 13 45.300 . . 1 . . . . 9 GLY CA . 26698 1 82 . 1 1 9 9 GLY N N 15 113.500 . . 1 . . . . 9 GLY N . 26698 1 83 . 1 1 10 10 TRP H H 1 7.644 . . 1 . . . . 10 TRP HN . 26698 1 84 . 1 1 10 10 TRP HA H 1 5.395 . . 1 . . . . 10 TRP HA . 26698 1 85 . 1 1 10 10 TRP HB2 H 1 3.030 . . 2 . . . . 10 TRP HB1 . 26698 1 86 . 1 1 10 10 TRP HB3 H 1 3.300 . . 2 . . . . 10 TRP HB2 . 26698 1 87 . 1 1 10 10 TRP HE1 H 1 10.600 . . 1 . . . . 10 TRP HE1 . 26698 1 88 . 1 1 10 10 TRP CA C 13 56.700 . . 1 . . . . 10 TRP CA . 26698 1 89 . 1 1 10 10 TRP CB C 13 32.000 . . 1 . . . . 10 TRP CB . 26698 1 90 . 1 1 10 10 TRP CD1 C 13 123.770 . . 1 . . . . 10 TRP CD1 . 26698 1 91 . 1 1 10 10 TRP CE3 C 13 116.600 . . 1 . . . . 10 TRP CE3 . 26698 1 92 . 1 1 10 10 TRP CZ2 C 13 111.400 . . 1 . . . . 10 TRP CZ2 . 26698 1 93 . 1 1 10 10 TRP CZ3 C 13 118.600 . . 1 . . . . 10 TRP CZ3 . 26698 1 94 . 1 1 10 10 TRP CH2 C 13 121.200 . . 1 . . . . 10 TRP CH2 . 26698 1 95 . 1 1 10 10 TRP N N 15 119.410 . . 1 . . . . 10 TRP N . 26698 1 96 . 1 1 10 10 TRP NE1 N 15 130.670 . . 1 . . . . 10 TRP NE1 . 26698 1 97 . 1 1 11 11 GLU H H 1 9.383 . . 1 . . . . 11 GLU HN . 26698 1 98 . 1 1 11 11 GLU HA H 1 4.707 . . 1 . . . . 11 GLU HA . 26698 1 99 . 1 1 11 11 GLU HB2 H 1 1.960 . . 2 . . . . 11 GLU HB1 . 26698 1 100 . 1 1 11 11 GLU HB3 H 1 2.030 . . 2 . . . . 11 GLU HB2 . 26698 1 101 . 1 1 11 11 GLU HG2 H 1 2.200 . . 2 . . . . 11 GLU HG1 . 26698 1 102 . 1 1 11 11 GLU HG3 H 1 2.250 . . 2 . . . . 11 GLU HG2 . 26698 1 103 . 1 1 11 11 GLU CA C 13 55.000 . . 1 . . . . 11 GLU CA . 26698 1 104 . 1 1 11 11 GLU CB C 13 34.600 . . 1 . . . . 11 GLU CB . 26698 1 105 . 1 1 11 11 GLU CG C 13 36.200 . . 1 . . . . 11 GLU CG . 26698 1 106 . 1 1 11 11 GLU N N 15 122.300 . . 1 . . . . 11 GLU N . 26698 1 107 . 1 1 12 12 GLU H H 1 8.688 . . 1 . . . . 12 GLU HN . 26698 1 108 . 1 1 12 12 GLU HA H 1 4.580 . . 1 . . . . 12 GLU HA . 26698 1 109 . 1 1 12 12 GLU HB2 H 1 1.880 . . 2 . . . . 12 GLU HB1 . 26698 1 110 . 1 1 12 12 GLU HB3 H 1 1.870 . . 2 . . . . 12 GLU HB2 . 26698 1 111 . 1 1 12 12 GLU HG2 H 1 1.850 . . 2 . . . . 12 GLU HG1 . 26698 1 112 . 1 1 12 12 GLU HG3 H 1 1.850 . . 2 . . . . 12 GLU HG2 . 26698 1 113 . 1 1 12 12 GLU CA C 13 55.100 . . 1 . . . . 12 GLU CA . 26698 1 114 . 1 1 12 12 GLU CB C 13 32.500 . . 1 . . . . 12 GLU CB . 26698 1 115 . 1 1 12 12 GLU CG C 13 36.700 . . 1 . . . . 12 GLU CG . 26698 1 116 . 1 1 12 12 GLU N N 15 125.847 . . 1 . . . . 12 GLU N . 26698 1 117 . 1 1 13 13 ARG H H 1 8.504 . . 1 . . . . 13 ARG HN . 26698 1 118 . 1 1 13 13 ARG HA H 1 4.360 . . 1 . . . . 13 ARG HA . 26698 1 119 . 1 1 13 13 ARG HB2 H 1 0.028 . . 2 . . . . 13 ARG HB1 . 26698 1 120 . 1 1 13 13 ARG HB3 H 1 1.040 . . 2 . . . . 13 ARG HB2 . 26698 1 121 . 1 1 13 13 ARG HG2 H 1 1.170 . . 2 . . . . 13 ARG HG1 . 26698 1 122 . 1 1 13 13 ARG HG3 H 1 1.170 . . 2 . . . . 13 ARG HG2 . 26698 1 123 . 1 1 13 13 ARG HD2 H 1 2.940 . . 2 . . . . 13 ARG HD1 . 26698 1 124 . 1 1 13 13 ARG HD3 H 1 3.140 . . 2 . . . . 13 ARG HD2 . 26698 1 125 . 1 1 13 13 ARG CA C 13 53.700 . . 1 . . . . 13 ARG CA . 26698 1 126 . 1 1 13 13 ARG CB C 13 34.100 . . 1 . . . . 13 ARG CB . 26698 1 127 . 1 1 13 13 ARG CG C 13 26.800 . . 1 . . . . 13 ARG CG . 26698 1 128 . 1 1 13 13 ARG CD C 13 43.000 . . 1 . . . . 13 ARG CD . 26698 1 129 . 1 1 13 13 ARG N N 15 127.130 . . 1 . . . . 13 ARG N . 26698 1 130 . 1 1 14 14 THR H H 1 8.080 . . 1 . . . . 14 THR HN . 26698 1 131 . 1 1 14 14 THR HA H 1 4.760 . . 1 . . . . 14 THR HA . 26698 1 132 . 1 1 14 14 THR HB H 1 3.900 . . 1 . . . . 14 THR HB . 26698 1 133 . 1 1 14 14 THR HG21 H 1 1.220 . . 1 . . . . 14 THR HG21 . 26698 1 134 . 1 1 14 14 THR HG22 H 1 1.220 . . 1 . . . . 14 THR HG21 . 26698 1 135 . 1 1 14 14 THR HG23 H 1 1.220 . . 1 . . . . 14 THR HG21 . 26698 1 136 . 1 1 14 14 THR CA C 13 61.700 . . 1 . . . . 14 THR CA . 26698 1 137 . 1 1 14 14 THR CB C 13 70.100 . . 1 . . . . 14 THR CB . 26698 1 138 . 1 1 14 14 THR CG2 C 13 21.530 . . 1 . . . . 14 THR CG2 . 26698 1 139 . 1 1 14 14 THR N N 15 114.815 . . 1 . . . . 14 THR N . 26698 1 140 . 1 1 15 15 HIS H H 1 9.710 . . 1 . . . . 15 HIS HN . 26698 1 141 . 1 1 15 15 HIS HA H 1 5.019 . . 1 . . . . 15 HIS HA . 26698 1 142 . 1 1 15 15 HIS HB2 H 1 3.300 . . 2 . . . . 15 HIS HB1 . 26698 1 143 . 1 1 15 15 HIS HB3 H 1 3.680 . . 2 . . . . 15 HIS HB2 . 26698 1 144 . 1 1 15 15 HIS CA C 13 55.700 . . 1 . . . . 15 HIS CA . 26698 1 145 . 1 1 15 15 HIS CB C 13 32.170 . . 1 . . . . 15 HIS CB . 26698 1 146 . 1 1 15 15 HIS CD2 C 13 115.200 . . 1 . . . . 15 HIS CD2 . 26698 1 147 . 1 1 15 15 HIS N N 15 128.550 . . 1 . . . . 15 HIS N . 26698 1 148 . 1 1 16 16 THR HA H 1 3.950 . . 1 . . . . 16 THR HA . 26698 1 149 . 1 1 16 16 THR HB H 1 4.100 . . 1 . . . . 16 THR HB . 26698 1 150 . 1 1 16 16 THR HG21 H 1 1.210 . . 1 . . . . 16 THR HG21 . 26698 1 151 . 1 1 16 16 THR HG22 H 1 1.210 . . 1 . . . . 16 THR HG21 . 26698 1 152 . 1 1 16 16 THR HG23 H 1 1.210 . . 1 . . . . 16 THR HG21 . 26698 1 153 . 1 1 16 16 THR CA C 13 64.800 . . 1 . . . . 16 THR CA . 26698 1 154 . 1 1 16 16 THR CB C 13 68.500 . . 1 . . . . 16 THR CB . 26698 1 155 . 1 1 16 16 THR CG2 C 13 21.900 . . 1 . . . . 16 THR CG2 . 26698 1 156 . 1 1 17 17 ASP H H 1 8.490 . . 1 . . . . 17 ASP HN . 26698 1 157 . 1 1 17 17 ASP HA H 1 4.550 . . 1 . . . . 17 ASP HA . 26698 1 158 . 1 1 17 17 ASP HB2 H 1 2.570 . . 2 . . . . 17 ASP HB1 . 26698 1 159 . 1 1 17 17 ASP HB3 H 1 3.091 . . 2 . . . . 17 ASP HB2 . 26698 1 160 . 1 1 17 17 ASP CA C 13 53.450 . . 1 . . . . 17 ASP CA . 26698 1 161 . 1 1 17 17 ASP CB C 13 40.500 . . 1 . . . . 17 ASP CB . 26698 1 162 . 1 1 17 17 ASP N N 15 121.150 . . 1 . . . . 17 ASP N . 26698 1 163 . 1 1 18 18 GLY H H 1 8.162 . . 1 . . . . 18 GLY HN . 26698 1 164 . 1 1 18 18 GLY HA2 H 1 3.550 . . 2 . . . . 18 GLY HA1 . 26698 1 165 . 1 1 18 18 GLY HA3 H 1 4.380 . . 2 . . . . 18 GLY HA2 . 26698 1 166 . 1 1 18 18 GLY CA C 13 45.000 . . 1 . . . . 18 GLY CA . 26698 1 167 . 1 1 18 18 GLY N N 15 109.580 . . 1 . . . . 18 GLY N . 26698 1 168 . 1 1 19 19 ARG H H 1 8.186 . . 1 . . . . 19 ARG HN . 26698 1 169 . 1 1 19 19 ARG HA H 1 4.400 . . 1 . . . . 19 ARG HA . 26698 1 170 . 1 1 19 19 ARG HB2 H 1 2.000 . . 2 . . . . 19 ARG HB1 . 26698 1 171 . 1 1 19 19 ARG HB3 H 1 2.208 . . 2 . . . . 19 ARG HB2 . 26698 1 172 . 1 1 19 19 ARG HG2 H 1 1.670 . . 2 . . . . 19 ARG HG1 . 26698 1 173 . 1 1 19 19 ARG HG3 H 1 1.670 . . 2 . . . . 19 ARG HG2 . 26698 1 174 . 1 1 19 19 ARG HD2 H 1 2.780 . . 2 . . . . 19 ARG HD1 . 26698 1 175 . 1 1 19 19 ARG HD3 H 1 2.970 . . 2 . . . . 19 ARG HD2 . 26698 1 176 . 1 1 19 19 ARG CA C 13 57.200 . . 1 . . . . 19 ARG CA . 26698 1 177 . 1 1 19 19 ARG CB C 13 32.500 . . 1 . . . . 19 ARG CB . 26698 1 178 . 1 1 19 19 ARG CG C 13 27.670 . . 1 . . . . 19 ARG CG . 26698 1 179 . 1 1 19 19 ARG CD C 13 43.600 . . 1 . . . . 19 ARG CD . 26698 1 180 . 1 1 19 19 ARG N N 15 122.570 . . 1 . . . . 19 ARG N . 26698 1 181 . 1 1 20 20 VAL H H 1 8.350 . . 1 . . . . 20 VAL HN . 26698 1 182 . 1 1 20 20 VAL HA H 1 4.790 . . 1 . . . . 20 VAL HA . 26698 1 183 . 1 1 20 20 VAL HB H 1 1.880 . . 1 . . . . 20 VAL HB . 26698 1 184 . 1 1 20 20 VAL HG11 H 1 0.680 . . 2 . . . . 20 VAL HG11 . 26698 1 185 . 1 1 20 20 VAL HG12 H 1 0.680 . . 2 . . . . 20 VAL HG11 . 26698 1 186 . 1 1 20 20 VAL HG13 H 1 0.680 . . 2 . . . . 20 VAL HG11 . 26698 1 187 . 1 1 20 20 VAL HG21 H 1 0.945 . . 2 . . . . 20 VAL HG21 . 26698 1 188 . 1 1 20 20 VAL HG22 H 1 0.945 . . 2 . . . . 20 VAL HG21 . 26698 1 189 . 1 1 20 20 VAL HG23 H 1 0.945 . . 2 . . . . 20 VAL HG21 . 26698 1 190 . 1 1 20 20 VAL CA C 13 61.600 . . 1 . . . . 20 VAL CA . 26698 1 191 . 1 1 20 20 VAL CB C 13 33.360 . . 1 . . . . 20 VAL CB . 26698 1 192 . 1 1 20 20 VAL CG1 C 13 21.500 . . 1 . . . . 20 VAL CG1 . 26698 1 193 . 1 1 20 20 VAL CG2 C 13 21.500 . . 1 . . . . 20 VAL CG2 . 26698 1 194 . 1 1 20 20 VAL N N 15 123.560 . . 1 . . . . 20 VAL N . 26698 1 195 . 1 1 21 21 PHE H H 1 8.620 . . 1 . . . . 21 PHE HN . 26698 1 196 . 1 1 21 21 PHE HA H 1 4.760 . . 1 . . . . 21 PHE HA . 26698 1 197 . 1 1 21 21 PHE HB2 H 1 2.302 . . 2 . . . . 21 PHE HB1 . 26698 1 198 . 1 1 21 21 PHE HB3 H 1 2.439 . . 2 . . . . 21 PHE HB2 . 26698 1 199 . 1 1 21 21 PHE CA C 13 55.300 . . 1 . . . . 21 PHE CA . 26698 1 200 . 1 1 21 21 PHE CB C 13 40.000 . . 1 . . . . 21 PHE CB . 26698 1 201 . 1 1 21 21 PHE CD1 C 13 128.800 . . 3 . . . . 21 PHE CD1 . 26698 1 202 . 1 1 21 21 PHE CD2 C 13 128.800 . . 3 . . . . 21 PHE CD2 . 26698 1 203 . 1 1 21 21 PHE CE1 C 13 126.800 . . 3 . . . . 21 PHE CE1 . 26698 1 204 . 1 1 21 21 PHE CE2 C 13 126.800 . . 3 . . . . 21 PHE CE2 . 26698 1 205 . 1 1 21 21 PHE CZ C 13 126.800 . . 1 . . . . 21 PHE CZ . 26698 1 206 . 1 1 21 21 PHE N N 15 122.500 . . 1 . . . . 21 PHE N . 26698 1 207 . 1 1 22 22 PHE H H 1 8.691 . . 1 . . . . 22 PHE HN . 26698 1 208 . 1 1 22 22 PHE HA H 1 5.435 . . 1 . . . . 22 PHE HA . 26698 1 209 . 1 1 22 22 PHE HB2 H 1 2.830 . . 2 . . . . 22 PHE HB1 . 26698 1 210 . 1 1 22 22 PHE HB3 H 1 3.140 . . 2 . . . . 22 PHE HB2 . 26698 1 211 . 1 1 22 22 PHE CA C 13 56.660 . . 1 . . . . 22 PHE CA . 26698 1 212 . 1 1 22 22 PHE CB C 13 42.700 . . 1 . . . . 22 PHE CB . 26698 1 213 . 1 1 22 22 PHE CD1 C 13 128.800 . . 3 . . . . 22 PHE CD1 . 26698 1 214 . 1 1 22 22 PHE CD2 C 13 128.800 . . 3 . . . . 22 PHE CD2 . 26698 1 215 . 1 1 22 22 PHE CE1 C 13 127.860 . . 3 . . . . 22 PHE CE1 . 26698 1 216 . 1 1 22 22 PHE CE2 C 13 127.860 . . 3 . . . . 22 PHE CE2 . 26698 1 217 . 1 1 22 22 PHE N N 15 117.108 . . 1 . . . . 22 PHE N . 26698 1 218 . 1 1 23 23 ILE H H 1 9.245 . . 1 . . . . 23 ILE HN . 26698 1 219 . 1 1 23 23 ILE HA H 1 4.960 . . 1 . . . . 23 ILE HA . 26698 1 220 . 1 1 23 23 ILE HB H 1 1.410 . . 1 . . . . 23 ILE HB . 26698 1 221 . 1 1 23 23 ILE HG12 H 1 0.619 . . 1 . . . . 23 ILE HG11 . 26698 1 222 . 1 1 23 23 ILE HG13 H 1 1.320 . . 1 . . . . 23 ILE HG12 . 26698 1 223 . 1 1 23 23 ILE HG21 H 1 0.446 . . 1 . . . . 23 ILE HG21 . 26698 1 224 . 1 1 23 23 ILE HG22 H 1 0.446 . . 1 . . . . 23 ILE HG21 . 26698 1 225 . 1 1 23 23 ILE HG23 H 1 0.446 . . 1 . . . . 23 ILE HG21 . 26698 1 226 . 1 1 23 23 ILE HD11 H 1 0.651 . . 1 . . . . 23 ILE HD11 . 26698 1 227 . 1 1 23 23 ILE HD12 H 1 0.651 . . 1 . . . . 23 ILE HD11 . 26698 1 228 . 1 1 23 23 ILE HD13 H 1 0.651 . . 1 . . . . 23 ILE HD11 . 26698 1 229 . 1 1 23 23 ILE CA C 13 59.100 . . 1 . . . . 23 ILE CA . 26698 1 230 . 1 1 23 23 ILE CB C 13 42.500 . . 1 . . . . 23 ILE CB . 26698 1 231 . 1 1 23 23 ILE CG1 C 13 27.630 . . 1 . . . . 23 ILE CG1 . 26698 1 232 . 1 1 23 23 ILE CG2 C 13 16.600 . . 1 . . . . 23 ILE CG2 . 26698 1 233 . 1 1 23 23 ILE CD1 C 13 14.560 . . 1 . . . . 23 ILE CD1 . 26698 1 234 . 1 1 23 23 ILE N N 15 121.800 . . 1 . . . . 23 ILE N . 26698 1 235 . 1 1 24 24 ASN H H 1 8.358 . . 1 . . . . 24 ASN HN . 26698 1 236 . 1 1 24 24 ASN HA H 1 4.340 . . 1 . . . . 24 ASN HA . 26698 1 237 . 1 1 24 24 ASN HB2 H 1 -0.091 . . 2 . . . . 24 ASN HB1 . 26698 1 238 . 1 1 24 24 ASN HB3 H 1 1.738 . . 2 . . . . 24 ASN HB2 . 26698 1 239 . 1 1 24 24 ASN HD21 H 1 6.940 . . 2 . . . . 24 ASN HD21 . 26698 1 240 . 1 1 24 24 ASN HD22 H 1 8.08 . . 2 . . . . 24 ASN HD22 . 26698 1 241 . 1 1 24 24 ASN CA C 13 50.790 . . 1 . . . . 24 ASN CA . 26698 1 242 . 1 1 24 24 ASN CB C 13 37.100 . . 1 . . . . 24 ASN CB . 26698 1 243 . 1 1 24 24 ASN N N 15 125.030 . . 1 . . . . 24 ASN N . 26698 1 244 . 1 1 24 24 ASN ND2 N 15 110.809 . . 1 . . . . 24 ASN ND2 . 26698 1 245 . 1 1 25 25 HIS H H 1 8.610 . . 1 . . . . 25 HIS HN . 26698 1 246 . 1 1 25 25 HIS HA H 1 4.216 . . 1 . . . . 25 HIS HA . 26698 1 247 . 1 1 25 25 HIS HB2 H 1 3.035 . . 2 . . . . 25 HIS HB1 . 26698 1 248 . 1 1 25 25 HIS HB3 H 1 3.035 . . 2 . . . . 25 HIS HB2 . 26698 1 249 . 1 1 25 25 HIS CA C 13 58.660 . . 1 . . . . 25 HIS CA . 26698 1 250 . 1 1 25 25 HIS CB C 13 30.700 . . 1 . . . . 25 HIS CB . 26698 1 251 . 1 1 25 25 HIS CD2 C 13 115.500 . . 1 . . . . 25 HIS CD2 . 26698 1 252 . 1 1 25 25 HIS N N 15 125.140 . . 1 . . . . 25 HIS N . 26698 1 253 . 1 1 26 26 ASN H H 1 8.348 . . 1 . . . . 26 ASN HN . 26698 1 254 . 1 1 26 26 ASN HA H 1 4.420 . . 1 . . . . 26 ASN HA . 26698 1 255 . 1 1 26 26 ASN HB2 H 1 2.740 . . 2 . . . . 26 ASN HB1 . 26698 1 256 . 1 1 26 26 ASN HB3 H 1 2.930 . . 2 . . . . 26 ASN HB2 . 26698 1 257 . 1 1 26 26 ASN HD21 H 1 7.510 . . 2 . . . . 26 ASN HD21 . 26698 1 258 . 1 1 26 26 ASN HD22 H 1 7.220 . . 2 . . . . 26 ASN HD22 . 26698 1 259 . 1 1 26 26 ASN CA C 13 56.000 . . 1 . . . . 26 ASN CA . 26698 1 260 . 1 1 26 26 ASN CB C 13 38.300 . . 1 . . . . 26 ASN CB . 26698 1 261 . 1 1 26 26 ASN N N 15 118.770 . . 1 . . . . 26 ASN N . 26698 1 262 . 1 1 26 26 ASN ND2 N 15 115.100 . . 1 . . . . 26 ASN ND2 . 26698 1 263 . 1 1 27 27 ILE H H 1 6.740 . . 1 . . . . 27 ILE HN . 26698 1 264 . 1 1 27 27 ILE HA H 1 4.375 . . 1 . . . . 27 ILE HA . 26698 1 265 . 1 1 27 27 ILE HB H 1 1.980 . . 1 . . . . 27 ILE HB . 26698 1 266 . 1 1 27 27 ILE HG12 H 1 0.600 . . 1 . . . . 27 ILE HG11 . 26698 1 267 . 1 1 27 27 ILE HG13 H 1 0.970 . . 1 . . . . 27 ILE HG12 . 26698 1 268 . 1 1 27 27 ILE HG21 H 1 0.734 . . 1 . . . . 27 ILE HG21 . 26698 1 269 . 1 1 27 27 ILE HG22 H 1 0.734 . . 1 . . . . 27 ILE HG21 . 26698 1 270 . 1 1 27 27 ILE HG23 H 1 0.734 . . 1 . . . . 27 ILE HG21 . 26698 1 271 . 1 1 27 27 ILE HD11 H 1 0.747 . . 1 . . . . 27 ILE HD11 . 26698 1 272 . 1 1 27 27 ILE HD12 H 1 0.747 . . 1 . . . . 27 ILE HD11 . 26698 1 273 . 1 1 27 27 ILE HD13 H 1 0.747 . . 1 . . . . 27 ILE HD11 . 26698 1 274 . 1 1 27 27 ILE CA C 13 60.330 . . 1 . . . . 27 ILE CA . 26698 1 275 . 1 1 27 27 ILE CB C 13 38.200 . . 1 . . . . 27 ILE CB . 26698 1 276 . 1 1 27 27 ILE CG1 C 13 25.600 . . 1 . . . . 27 ILE CG1 . 26698 1 277 . 1 1 27 27 ILE CG2 C 13 17.400 . . 1 . . . . 27 ILE CG2 . 26698 1 278 . 1 1 27 27 ILE CD1 C 13 13.750 . . 1 . . . . 27 ILE CD1 . 26698 1 279 . 1 1 28 28 LYS H H 1 7.520 . . 1 . . . . 28 LYS HN . 26698 1 280 . 1 1 28 28 LYS HA H 1 3.740 . . 1 . . . . 28 LYS HA . 26698 1 281 . 1 1 28 28 LYS HB2 H 1 1.720 . . 2 . . . . 28 LYS HB1 . 26698 1 282 . 1 1 28 28 LYS HB3 H 1 2.000 . . 2 . . . . 28 LYS HB2 . 26698 1 283 . 1 1 28 28 LYS HG2 H 1 1.246 . . 2 . . . . 28 LYS HG1 . 26698 1 284 . 1 1 28 28 LYS HG3 H 1 1.246 . . 2 . . . . 28 LYS HG2 . 26698 1 285 . 1 1 28 28 LYS CA C 13 57.000 . . 1 . . . . 28 LYS CA . 26698 1 286 . 1 1 28 28 LYS CB C 13 29.000 . . 1 . . . . 28 LYS CB . 26698 1 287 . 1 1 28 28 LYS CG C 13 24.800 . . 1 . . . . 28 LYS CG . 26698 1 288 . 1 1 28 28 LYS N N 15 120.828 . . 1 . . . . 28 LYS N . 26698 1 289 . 1 1 29 29 LYS H H 1 7.420 . . 1 . . . . 29 LYS HN . 26698 1 290 . 1 1 29 29 LYS HA H 1 4.764 . . 1 . . . . 29 LYS HA . 26698 1 291 . 1 1 29 29 LYS HB2 H 1 1.471 . . 2 . . . . 29 LYS HB1 . 26698 1 292 . 1 1 29 29 LYS HB3 H 1 1.606 . . 2 . . . . 29 LYS HB2 . 26698 1 293 . 1 1 29 29 LYS HG2 H 1 1.400 . . 2 . . . . 29 LYS HG1 . 26698 1 294 . 1 1 29 29 LYS HG3 H 1 1.410 . . 2 . . . . 29 LYS HG2 . 26698 1 295 . 1 1 29 29 LYS CA C 13 54.800 . . 1 . . . . 29 LYS CA . 26698 1 296 . 1 1 29 29 LYS CB C 13 37.500 . . 1 . . . . 29 LYS CB . 26698 1 297 . 1 1 29 29 LYS CG C 13 25.200 . . 1 . . . . 29 LYS CG . 26698 1 298 . 1 1 29 29 LYS N N 15 120.225 . . 1 . . . . 29 LYS N . 26698 1 299 . 1 1 30 30 THR H H 1 8.350 . . 1 . . . . 30 THR HN . 26698 1 300 . 1 1 30 30 THR HA H 1 5.290 . . 1 . . . . 30 THR HA . 26698 1 301 . 1 1 30 30 THR HB H 1 3.872 . . 1 . . . . 30 THR HB . 26698 1 302 . 1 1 30 30 THR HG21 H 1 0.980 . . 1 . . . . 30 THR HG21 . 26698 1 303 . 1 1 30 30 THR HG22 H 1 0.980 . . 1 . . . . 30 THR HG21 . 26698 1 304 . 1 1 30 30 THR HG23 H 1 0.980 . . 1 . . . . 30 THR HG21 . 26698 1 305 . 1 1 30 30 THR CA C 13 60.880 . . 1 . . . . 30 THR CA . 26698 1 306 . 1 1 30 30 THR CB C 13 70.940 . . 1 . . . . 30 THR CB . 26698 1 307 . 1 1 30 30 THR CG2 C 13 21.930 . . 1 . . . . 30 THR CG2 . 26698 1 308 . 1 1 30 30 THR N N 15 119.610 . . 1 . . . . 30 THR N . 26698 1 309 . 1 1 31 31 GLN H H 1 9.440 . . 1 . . . . 31 GLN HN . 26698 1 310 . 1 1 31 31 GLN HA H 1 4.920 . . 1 . . . . 31 GLN HA . 26698 1 311 . 1 1 31 31 GLN HB2 H 1 2.310 . . 2 . . . . 31 GLN HB1 . 26698 1 312 . 1 1 31 31 GLN HB3 H 1 2.660 . . 2 . . . . 31 GLN HB2 . 26698 1 313 . 1 1 31 31 GLN HG2 H 1 2.410 . . 2 . . . . 31 GLN HG1 . 26698 1 314 . 1 1 31 31 GLN HG3 H 1 2.410 . . 2 . . . . 31 GLN HG2 . 26698 1 315 . 1 1 31 31 GLN HE21 H 1 7.651 . . 2 . . . . 31 GLN HE21 . 26698 1 316 . 1 1 31 31 GLN HE22 H 1 6.850 . . 2 . . . . 31 GLN HE22 . 26698 1 317 . 1 1 31 31 GLN CA C 13 54.570 . . 1 . . . . 31 GLN CA . 26698 1 318 . 1 1 31 31 GLN CB C 13 32.100 . . 1 . . . . 31 GLN CB . 26698 1 319 . 1 1 31 31 GLN CG C 13 32.100 . . 1 . . . . 31 GLN CG . 26698 1 320 . 1 1 31 31 GLN N N 15 120.480 . . 1 . . . . 31 GLN N . 26698 1 321 . 1 1 31 31 GLN NE2 N 15 114.800 . . 1 . . . . 31 GLN NE2 . 26698 1 322 . 1 1 32 32 TRP H H 1 8.710 . . 1 . . . . 32 TRP HN . 26698 1 323 . 1 1 32 32 TRP HA H 1 4.896 . . 1 . . . . 32 TRP HA . 26698 1 324 . 1 1 32 32 TRP HB2 H 1 3.080 . . 2 . . . . 32 TRP HB1 . 26698 1 325 . 1 1 32 32 TRP HB3 H 1 3.580 . . 2 . . . . 32 TRP HB2 . 26698 1 326 . 1 1 32 32 TRP HE1 H 1 9.960 . . 3 . . . . 32 TRP HE1 . 26698 1 327 . 1 1 32 32 TRP CA C 13 58.200 . . 1 . . . . 32 TRP CA . 26698 1 328 . 1 1 32 32 TRP CB C 13 30.220 . . 1 . . . . 32 TRP CB . 26698 1 329 . 1 1 32 32 TRP CD1 C 13 124.200 . . 1 . . . . 32 TRP CD1 . 26698 1 330 . 1 1 32 32 TRP CE3 C 13 118.100 . . 1 . . . . 32 TRP CE3 . 26698 1 331 . 1 1 32 32 TRP CZ2 C 13 110.400 . . 1 . . . . 32 TRP CZ2 . 26698 1 332 . 1 1 32 32 TRP CZ3 C 13 118.600 . . 1 . . . . 32 TRP CZ3 . 26698 1 333 . 1 1 32 32 TRP CH2 C 13 120.180 . . 1 . . . . 32 TRP CH2 . 26698 1 334 . 1 1 32 32 TRP N N 15 121.480 . . 1 . . . . 32 TRP N . 26698 1 335 . 1 1 32 32 TRP NE1 N 15 129.700 . . 1 . . . . 32 TRP NE1 . 26698 1 336 . 1 1 33 33 GLU H H 1 8.072 . . 1 . . . . 33 GLU HN . 26698 1 337 . 1 1 33 33 GLU HA H 1 4.240 . . 1 . . . . 33 GLU HA . 26698 1 338 . 1 1 33 33 GLU HB2 H 1 1.740 . . 2 . . . . 33 GLU HB1 . 26698 1 339 . 1 1 33 33 GLU HB3 H 1 1.880 . . 2 . . . . 33 GLU HB2 . 26698 1 340 . 1 1 33 33 GLU HG2 H 1 2.170 . . 2 . . . . 33 GLU HG1 . 26698 1 341 . 1 1 33 33 GLU HG3 H 1 2.340 . . 2 . . . . 33 GLU HG2 . 26698 1 342 . 1 1 33 33 GLU CA C 13 57.200 . . 1 . . . . 33 GLU CA . 26698 1 343 . 1 1 33 33 GLU CB C 13 29.550 . . 1 . . . . 33 GLU CB . 26698 1 344 . 1 1 33 33 GLU CG C 13 36.600 . . 1 . . . . 33 GLU CG . 26698 1 345 . 1 1 33 33 GLU N N 15 119.300 . . 1 . . . . 33 GLU N . 26698 1 346 . 1 1 34 34 ASP H H 1 8.350 . . 1 . . . . 34 ASP HN . 26698 1 347 . 1 1 34 34 ASP HA H 1 3.102 . . 1 . . . . 34 ASP HA . 26698 1 348 . 1 1 34 34 ASP HB2 H 1 2.300 . . 2 . . . . 34 ASP HB1 . 26698 1 349 . 1 1 34 34 ASP HB3 H 1 2.580 . . 2 . . . . 34 ASP HB2 . 26698 1 350 . 1 1 34 34 ASP CA C 13 50.720 . . 1 . . . . 34 ASP CA . 26698 1 351 . 1 1 34 34 ASP CB C 13 41.730 . . 1 . . . . 34 ASP CB . 26698 1 352 . 1 1 34 34 ASP N N 15 125.850 . . 1 . . . . 34 ASP N . 26698 1 353 . 1 1 35 35 PRO HA H 1 3.930 . . 1 . . . . 35 PRO HA . 26698 1 354 . 1 1 35 35 PRO HB2 H 1 0.760 . . 2 . . . . 35 PRO HB1 . 26698 1 355 . 1 1 35 35 PRO HB3 H 1 0.781 . . 2 . . . . 35 PRO HB2 . 26698 1 356 . 1 1 35 35 PRO HG2 H 1 0.190 . . 2 . . . . 35 PRO HG1 . 26698 1 357 . 1 1 35 35 PRO HG3 H 1 0.510 . . 2 . . . . 35 PRO HG2 . 26698 1 358 . 1 1 35 35 PRO HD2 H 1 2.500 . . 2 . . . . 35 PRO HD1 . 26698 1 359 . 1 1 35 35 PRO HD3 H 1 2.550 . . 2 . . . . 35 PRO HD2 . 26698 1 360 . 1 1 35 35 PRO CA C 13 63.100 . . 1 . . . . 35 PRO CA . 26698 1 361 . 1 1 35 35 PRO CB C 13 30.900 . . 1 . . . . 35 PRO CB . 26698 1 362 . 1 1 35 35 PRO CG C 13 26.030 . . 1 . . . . 35 PRO CG . 26698 1 363 . 1 1 35 35 PRO CD C 13 49.700 . . 1 . . . . 35 PRO CD . 26698 1 364 . 1 1 36 36 ARG H H 1 8.577 . . 1 . . . . 36 ARG HN . 26698 1 365 . 1 1 36 36 ARG HA H 1 3.873 . . 1 . . . . 36 ARG HA . 26698 1 366 . 1 1 36 36 ARG HB2 H 1 1.540 . . 2 . . . . 36 ARG HB1 . 26698 1 367 . 1 1 36 36 ARG HB3 H 1 1.800 . . 2 . . . . 36 ARG HB2 . 26698 1 368 . 1 1 36 36 ARG HG2 H 1 1.202 . . 2 . . . . 36 ARG HG1 . 26698 1 369 . 1 1 36 36 ARG HG3 H 1 1.714 . . 2 . . . . 36 ARG HG2 . 26698 1 370 . 1 1 36 36 ARG HD2 H 1 2.840 . . 2 . . . . 36 ARG HD2 . 26698 1 371 . 1 1 36 36 ARG CA C 13 57.200 . . 1 . . . . 36 ARG CA . 26698 1 372 . 1 1 36 36 ARG CB C 13 30.200 . . 1 . . . . 36 ARG CB . 26698 1 373 . 1 1 36 36 ARG CG C 13 27.670 . . 1 . . . . 36 ARG CG . 26698 1 374 . 1 1 36 36 ARG CD C 13 42.800 . . 1 . . . . 36 ARG CD . 26698 1 375 . 1 1 36 36 ARG N N 15 119.678 . . 1 . . . . 36 ARG N . 26698 1 376 . 1 1 37 37 MET H H 1 7.477 . . 1 . . . . 37 MET HN . 26698 1 377 . 1 1 37 37 MET HA H 1 4.380 . . 1 . . . . 37 MET HA . 26698 1 378 . 1 1 37 37 MET HB2 H 1 1.910 . . 2 . . . . 37 MET HB1 . 26698 1 379 . 1 1 37 37 MET HB3 H 1 2.110 . . 2 . . . . 37 MET HB2 . 26698 1 380 . 1 1 37 37 MET HG2 H 1 2.370 . . 2 . . . . 37 MET HG1 . 26698 1 381 . 1 1 37 37 MET HG3 H 1 2.480 . . 2 . . . . 37 MET HG2 . 26698 1 382 . 1 1 37 37 MET HE1 H 1 0.790 . . 1 . . . . 37 MET HE1 . 26698 1 383 . 1 1 37 37 MET HE2 H 1 0.790 . . 1 . . . . 37 MET HE1 . 26698 1 384 . 1 1 37 37 MET HE3 H 1 0.790 . . 1 . . . . 37 MET HE1 . 26698 1 385 . 1 1 37 37 MET CA C 13 55.000 . . 1 . . . . 37 MET CA . 26698 1 386 . 1 1 37 37 MET CB C 13 32.500 . . 1 . . . . 37 MET CB . 26698 1 387 . 1 1 37 37 MET CG C 13 32.500 . . 1 . . . . 37 MET CG . 26698 1 388 . 1 1 37 37 MET N N 15 118.110 . . 1 . . . . 37 MET N . 26698 1 389 . 1 1 38 38 GLN H H 1 7.680 . . 1 . . . . 38 GLN HN . 26698 1 390 . 1 1 38 38 GLN HA H 1 4.288 . . 1 . . . . 38 GLN HA . 26698 1 391 . 1 1 38 38 GLN HB2 H 1 2.040 . . 2 . . . . 38 GLN HB1 . 26698 1 392 . 1 1 38 38 GLN HB3 H 1 2.040 . . 2 . . . . 38 GLN HB2 . 26698 1 393 . 1 1 38 38 GLN HG2 H 1 2.270 . . 2 . . . . 38 GLN HG1 . 26698 1 394 . 1 1 38 38 GLN HG3 H 1 2.250 . . 2 . . . . 38 GLN HG2 . 26698 1 395 . 1 1 38 38 GLN HE21 H 1 7.500 . . 2 . . . . 38 GLN HE21 . 26698 1 396 . 1 1 38 38 GLN HE22 H 1 6.770 . . 2 . . . . 38 GLN HE22 . 26698 1 397 . 1 1 38 38 GLN CA C 13 55.500 . . 1 . . . . 38 GLN CA . 26698 1 398 . 1 1 38 38 GLN CB C 13 29.800 . . 1 . . . . 38 GLN CB . 26698 1 399 . 1 1 38 38 GLN CG C 13 33.800 . . 1 . . . . 38 GLN CG . 26698 1 400 . 1 1 38 38 GLN N N 15 121.700 . . 1 . . . . 38 GLN N . 26698 1 401 . 1 1 38 38 GLN NE2 N 15 113.800 . . 1 . . . . 38 GLN NE2 . 26698 1 402 . 1 1 39 39 ASN H H 1 7.980 . . 1 . . . . 39 ASN HN . 26698 1 403 . 1 1 39 39 ASN HA H 1 4.430 . . 1 . . . . 39 ASN HA . 26698 1 404 . 1 1 39 39 ASN HB2 H 1 2.602 . . 2 . . . . 39 ASN HB1 . 26698 1 405 . 1 1 39 39 ASN HB3 H 1 2.716 . . 2 . . . . 39 ASN HB2 . 26698 1 406 . 1 1 39 39 ASN HD21 H 1 7.430 . . 2 . . . . 39 ASN HD21 . 26698 1 407 . 1 1 39 39 ASN HD22 H 1 6.730 . . 2 . . . . 39 ASN HD22 . 26698 1 408 . 1 1 39 39 ASN CA C 13 54.800 . . 1 . . . . 39 ASN CA . 26698 1 409 . 1 1 39 39 ASN CB C 13 40.440 . . 1 . . . . 39 ASN CB . 26698 1 410 . 1 1 39 39 ASN N N 15 126.940 . . 1 . . . . 39 ASN N . 26698 1 411 . 1 1 39 39 ASN ND2 N 15 113.800 . . 1 . . . . 39 ASN ND2 . 26698 1 stop_ save_