################################### # 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_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10176 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10176 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10176 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 7 7 GLY CA C 13 45.411 0.300 . 1 . . . . 7 GLY CA . 10176 1 2 . 1 1 7 7 GLY HA2 H 1 4.041 0.030 . 1 . . . . 7 GLY HA2 . 10176 1 3 . 1 1 7 7 GLY HA3 H 1 4.041 0.030 . 1 . . . . 7 GLY HA3 . 10176 1 4 . 1 1 7 7 GLY C C 13 174.569 0.300 . 1 . . . . 7 GLY C . 10176 1 5 . 1 1 8 8 THR N N 15 112.805 0.300 . 1 . . . . 8 THR N . 10176 1 6 . 1 1 8 8 THR H H 1 8.148 0.030 . 1 . . . . 8 THR H . 10176 1 7 . 1 1 8 8 THR CA C 13 61.937 0.300 . 1 . . . . 8 THR CA . 10176 1 8 . 1 1 8 8 THR HA H 1 4.368 0.030 . 1 . . . . 8 THR HA . 10176 1 9 . 1 1 8 8 THR CB C 13 69.797 0.300 . 1 . . . . 8 THR CB . 10176 1 10 . 1 1 8 8 THR HB H 1 4.309 0.030 . 1 . . . . 8 THR HB . 10176 1 11 . 1 1 8 8 THR CG2 C 13 21.566 0.300 . 1 . . . . 8 THR CG2 . 10176 1 12 . 1 1 8 8 THR HG21 H 1 1.194 0.030 . 1 . . . . 8 THR HG2 . 10176 1 13 . 1 1 8 8 THR HG22 H 1 1.194 0.030 . 1 . . . . 8 THR HG2 . 10176 1 14 . 1 1 8 8 THR HG23 H 1 1.194 0.030 . 1 . . . . 8 THR HG2 . 10176 1 15 . 1 1 8 8 THR C C 13 175.281 0.300 . 1 . . . . 8 THR C . 10176 1 16 . 1 1 9 9 GLY N N 15 111.033 0.300 . 1 . . . . 9 GLY N . 10176 1 17 . 1 1 9 9 GLY H H 1 8.450 0.030 . 1 . . . . 9 GLY H . 10176 1 18 . 1 1 9 9 GLY CA C 13 45.415 0.300 . 1 . . . . 9 GLY CA . 10176 1 19 . 1 1 9 9 GLY HA2 H 1 3.959 0.030 . 1 . . . . 9 GLY HA2 . 10176 1 20 . 1 1 9 9 GLY HA3 H 1 3.959 0.030 . 1 . . . . 9 GLY HA3 . 10176 1 21 . 1 1 9 9 GLY C C 13 174.015 0.300 . 1 . . . . 9 GLY C . 10176 1 22 . 1 1 10 10 GLU N N 15 120.268 0.300 . 1 . . . . 10 GLU N . 10176 1 23 . 1 1 10 10 GLU H H 1 8.220 0.030 . 1 . . . . 10 GLU H . 10176 1 24 . 1 1 10 10 GLU CA C 13 56.694 0.300 . 1 . . . . 10 GLU CA . 10176 1 25 . 1 1 10 10 GLU HA H 1 4.210 0.030 . 1 . . . . 10 GLU HA . 10176 1 26 . 1 1 10 10 GLU CB C 13 30.530 0.300 . 1 . . . . 10 GLU CB . 10176 1 27 . 1 1 10 10 GLU HB2 H 1 1.979 0.030 . 2 . . . . 10 GLU HB2 . 10176 1 28 . 1 1 10 10 GLU HB3 H 1 1.888 0.030 . 2 . . . . 10 GLU HB3 . 10176 1 29 . 1 1 10 10 GLU CG C 13 36.228 0.300 . 1 . . . . 10 GLU CG . 10176 1 30 . 1 1 10 10 GLU HG2 H 1 2.204 0.030 . 1 . . . . 10 GLU HG2 . 10176 1 31 . 1 1 10 10 GLU HG3 H 1 2.204 0.030 . 1 . . . . 10 GLU HG3 . 10176 1 32 . 1 1 10 10 GLU C C 13 176.497 0.300 . 1 . . . . 10 GLU C . 10176 1 33 . 1 1 11 11 LYS N N 15 122.135 0.300 . 1 . . . . 11 LYS N . 10176 1 34 . 1 1 11 11 LYS H H 1 8.387 0.030 . 1 . . . . 11 LYS H . 10176 1 35 . 1 1 11 11 LYS CA C 13 53.918 0.300 . 1 . . . . 11 LYS CA . 10176 1 36 . 1 1 11 11 LYS HA H 1 4.555 0.030 . 1 . . . . 11 LYS HA . 10176 1 37 . 1 1 11 11 LYS CB C 13 33.223 0.300 . 1 . . . . 11 LYS CB . 10176 1 38 . 1 1 11 11 LYS HB2 H 1 1.579 0.030 . 2 . . . . 11 LYS HB2 . 10176 1 39 . 1 1 11 11 LYS HB3 H 1 1.425 0.030 . 2 . . . . 11 LYS HB3 . 10176 1 40 . 1 1 11 11 LYS CG C 13 24.944 0.300 . 1 . . . . 11 LYS CG . 10176 1 41 . 1 1 11 11 LYS HG2 H 1 1.130 0.030 . 2 . . . . 11 LYS HG2 . 10176 1 42 . 1 1 11 11 LYS HG3 H 1 1.340 0.030 . 2 . . . . 11 LYS HG3 . 10176 1 43 . 1 1 11 11 LYS CD C 13 29.551 0.300 . 1 . . . . 11 LYS CD . 10176 1 44 . 1 1 11 11 LYS HD2 H 1 1.475 0.030 . 1 . . . . 11 LYS HD2 . 10176 1 45 . 1 1 11 11 LYS HD3 H 1 1.475 0.030 . 1 . . . . 11 LYS HD3 . 10176 1 46 . 1 1 11 11 LYS CE C 13 42.327 0.300 . 1 . . . . 11 LYS CE . 10176 1 47 . 1 1 11 11 LYS HE2 H 1 2.910 0.030 . 1 . . . . 11 LYS HE2 . 10176 1 48 . 1 1 11 11 LYS HE3 H 1 2.910 0.030 . 1 . . . . 11 LYS HE3 . 10176 1 49 . 1 1 11 11 LYS C C 13 174.096 0.300 . 1 . . . . 11 LYS C . 10176 1 50 . 1 1 12 12 PRO CA C 13 63.645 0.300 . 1 . . . . 12 PRO CA . 10176 1 51 . 1 1 12 12 PRO HA H 1 4.298 0.030 . 1 . . . . 12 PRO HA . 10176 1 52 . 1 1 12 12 PRO CB C 13 32.332 0.300 . 1 . . . . 12 PRO CB . 10176 1 53 . 1 1 12 12 PRO HB2 H 1 1.281 0.030 . 2 . . . . 12 PRO HB2 . 10176 1 54 . 1 1 12 12 PRO HB3 H 1 2.034 0.030 . 2 . . . . 12 PRO HB3 . 10176 1 55 . 1 1 12 12 PRO CG C 13 26.589 0.300 . 1 . . . . 12 PRO CG . 10176 1 56 . 1 1 12 12 PRO HG2 H 1 1.820 0.030 . 2 . . . . 12 PRO HG2 . 10176 1 57 . 1 1 12 12 PRO HG3 H 1 1.577 0.030 . 2 . . . . 12 PRO HG3 . 10176 1 58 . 1 1 12 12 PRO CD C 13 50.330 0.300 . 1 . . . . 12 PRO CD . 10176 1 59 . 1 1 12 12 PRO HD2 H 1 3.661 0.030 . 1 . . . . 12 PRO HD2 . 10176 1 60 . 1 1 12 12 PRO HD3 H 1 3.661 0.030 . 1 . . . . 12 PRO HD3 . 10176 1 61 . 1 1 12 12 PRO C C 13 176.462 0.300 . 1 . . . . 12 PRO C . 10176 1 62 . 1 1 13 13 TYR N N 15 118.803 0.300 . 1 . . . . 13 TYR N . 10176 1 63 . 1 1 13 13 TYR H H 1 7.796 0.030 . 1 . . . . 13 TYR H . 10176 1 64 . 1 1 13 13 TYR CA C 13 57.652 0.300 . 1 . . . . 13 TYR CA . 10176 1 65 . 1 1 13 13 TYR HA H 1 4.640 0.030 . 1 . . . . 13 TYR HA . 10176 1 66 . 1 1 13 13 TYR CB C 13 38.399 0.300 . 1 . . . . 13 TYR CB . 10176 1 67 . 1 1 13 13 TYR HB2 H 1 3.042 0.030 . 2 . . . . 13 TYR HB2 . 10176 1 68 . 1 1 13 13 TYR HB3 H 1 2.731 0.030 . 2 . . . . 13 TYR HB3 . 10176 1 69 . 1 1 13 13 TYR CD1 C 13 133.266 0.300 . 1 . . . . 13 TYR CD1 . 10176 1 70 . 1 1 13 13 TYR HD1 H 1 6.988 0.030 . 1 . . . . 13 TYR HD1 . 10176 1 71 . 1 1 13 13 TYR CD2 C 13 133.266 0.300 . 1 . . . . 13 TYR CD2 . 10176 1 72 . 1 1 13 13 TYR HD2 H 1 6.988 0.030 . 1 . . . . 13 TYR HD2 . 10176 1 73 . 1 1 13 13 TYR CE1 C 13 118.127 0.300 . 1 . . . . 13 TYR CE1 . 10176 1 74 . 1 1 13 13 TYR HE1 H 1 6.843 0.030 . 1 . . . . 13 TYR HE1 . 10176 1 75 . 1 1 13 13 TYR CE2 C 13 118.127 0.300 . 1 . . . . 13 TYR CE2 . 10176 1 76 . 1 1 13 13 TYR HE2 H 1 6.843 0.030 . 1 . . . . 13 TYR HE2 . 10176 1 77 . 1 1 13 13 TYR C C 13 174.480 0.300 . 1 . . . . 13 TYR C . 10176 1 78 . 1 1 14 14 LYS N N 15 123.448 0.300 . 1 . . . . 14 LYS N . 10176 1 79 . 1 1 14 14 LYS H H 1 8.515 0.030 . 1 . . . . 14 LYS H . 10176 1 80 . 1 1 14 14 LYS CA C 13 54.743 0.300 . 1 . . . . 14 LYS CA . 10176 1 81 . 1 1 14 14 LYS HA H 1 5.139 0.030 . 1 . . . . 14 LYS HA . 10176 1 82 . 1 1 14 14 LYS CB C 13 35.330 0.300 . 1 . . . . 14 LYS CB . 10176 1 83 . 1 1 14 14 LYS HB2 H 1 1.581 0.030 . 1 . . . . 14 LYS HB2 . 10176 1 84 . 1 1 14 14 LYS HB3 H 1 1.581 0.030 . 1 . . . . 14 LYS HB3 . 10176 1 85 . 1 1 14 14 LYS CG C 13 24.945 0.300 . 1 . . . . 14 LYS CG . 10176 1 86 . 1 1 14 14 LYS HG2 H 1 1.226 0.030 . 1 . . . . 14 LYS HG2 . 10176 1 87 . 1 1 14 14 LYS HG3 H 1 1.226 0.030 . 1 . . . . 14 LYS HG3 . 10176 1 88 . 1 1 14 14 LYS CD C 13 29.342 0.300 . 1 . . . . 14 LYS CD . 10176 1 89 . 1 1 14 14 LYS HD2 H 1 1.586 0.030 . 1 . . . . 14 LYS HD2 . 10176 1 90 . 1 1 14 14 LYS HD3 H 1 1.586 0.030 . 1 . . . . 14 LYS HD3 . 10176 1 91 . 1 1 14 14 LYS CE C 13 42.136 0.300 . 1 . . . . 14 LYS CE . 10176 1 92 . 1 1 14 14 LYS HE2 H 1 2.931 0.030 . 1 . . . . 14 LYS HE2 . 10176 1 93 . 1 1 14 14 LYS HE3 H 1 2.931 0.030 . 1 . . . . 14 LYS HE3 . 10176 1 94 . 1 1 14 14 LYS C C 13 175.781 0.300 . 1 . . . . 14 LYS C . 10176 1 95 . 1 1 15 15 CYS N N 15 126.149 0.300 . 1 . . . . 15 CYS N . 10176 1 96 . 1 1 15 15 CYS H H 1 9.206 0.030 . 1 . . . . 15 CYS H . 10176 1 97 . 1 1 15 15 CYS CA C 13 59.419 0.300 . 1 . . . . 15 CYS CA . 10176 1 98 . 1 1 15 15 CYS HA H 1 4.452 0.030 . 1 . . . . 15 CYS HA . 10176 1 99 . 1 1 15 15 CYS CB C 13 30.193 0.300 . 1 . . . . 15 CYS CB . 10176 1 100 . 1 1 15 15 CYS HB2 H 1 3.048 0.030 . 2 . . . . 15 CYS HB2 . 10176 1 101 . 1 1 15 15 CYS HB3 H 1 3.422 0.030 . 2 . . . . 15 CYS HB3 . 10176 1 102 . 1 1 15 15 CYS C C 13 177.815 0.300 . 1 . . . . 15 CYS C . 10176 1 103 . 1 1 16 16 MET N N 15 130.364 0.300 . 1 . . . . 16 MET N . 10176 1 104 . 1 1 16 16 MET H H 1 9.109 0.030 . 1 . . . . 16 MET H . 10176 1 105 . 1 1 16 16 MET CA C 13 57.294 0.300 . 1 . . . . 16 MET CA . 10176 1 106 . 1 1 16 16 MET HA H 1 4.344 0.030 . 1 . . . . 16 MET HA . 10176 1 107 . 1 1 16 16 MET CB C 13 32.125 0.300 . 1 . . . . 16 MET CB . 10176 1 108 . 1 1 16 16 MET HB2 H 1 2.149 0.030 . 1 . . . . 16 MET HB2 . 10176 1 109 . 1 1 16 16 MET HB3 H 1 2.149 0.030 . 1 . . . . 16 MET HB3 . 10176 1 110 . 1 1 16 16 MET CG C 13 32.247 0.300 . 1 . . . . 16 MET CG . 10176 1 111 . 1 1 16 16 MET HG2 H 1 2.783 0.030 . 2 . . . . 16 MET HG2 . 10176 1 112 . 1 1 16 16 MET HG3 H 1 2.649 0.030 . 2 . . . . 16 MET HG3 . 10176 1 113 . 1 1 16 16 MET CE C 13 16.893 0.300 . 1 . . . . 16 MET CE . 10176 1 114 . 1 1 16 16 MET HE1 H 1 2.127 0.030 . 1 . . . . 16 MET HE . 10176 1 115 . 1 1 16 16 MET HE2 H 1 2.127 0.030 . 1 . . . . 16 MET HE . 10176 1 116 . 1 1 16 16 MET HE3 H 1 2.127 0.030 . 1 . . . . 16 MET HE . 10176 1 117 . 1 1 16 16 MET C C 13 176.516 0.300 . 1 . . . . 16 MET C . 10176 1 118 . 1 1 17 17 GLU N N 15 121.077 0.300 . 1 . . . . 17 GLU N . 10176 1 119 . 1 1 17 17 GLU H H 1 8.854 0.030 . 1 . . . . 17 GLU H . 10176 1 120 . 1 1 17 17 GLU CA C 13 58.171 0.300 . 1 . . . . 17 GLU CA . 10176 1 121 . 1 1 17 17 GLU HA H 1 4.262 0.030 . 1 . . . . 17 GLU HA . 10176 1 122 . 1 1 17 17 GLU CB C 13 29.895 0.300 . 1 . . . . 17 GLU CB . 10176 1 123 . 1 1 17 17 GLU HB2 H 1 1.440 0.030 . 2 . . . . 17 GLU HB2 . 10176 1 124 . 1 1 17 17 GLU HB3 H 1 1.382 0.030 . 2 . . . . 17 GLU HB3 . 10176 1 125 . 1 1 17 17 GLU CG C 13 35.333 0.300 . 1 . . . . 17 GLU CG . 10176 1 126 . 1 1 17 17 GLU HG2 H 1 1.876 0.030 . 2 . . . . 17 GLU HG2 . 10176 1 127 . 1 1 17 17 GLU HG3 H 1 1.764 0.030 . 2 . . . . 17 GLU HG3 . 10176 1 128 . 1 1 17 17 GLU C C 13 177.191 0.300 . 1 . . . . 17 GLU C . 10176 1 129 . 1 1 18 18 CYS N N 15 115.700 0.300 . 1 . . . . 18 CYS N . 10176 1 130 . 1 1 18 18 CYS H H 1 8.241 0.030 . 1 . . . . 18 CYS H . 10176 1 131 . 1 1 18 18 CYS CA C 13 58.418 0.300 . 1 . . . . 18 CYS CA . 10176 1 132 . 1 1 18 18 CYS HA H 1 5.154 0.030 . 1 . . . . 18 CYS HA . 10176 1 133 . 1 1 18 18 CYS CB C 13 32.494 0.300 . 1 . . . . 18 CYS CB . 10176 1 134 . 1 1 18 18 CYS HB2 H 1 2.802 0.030 . 2 . . . . 18 CYS HB2 . 10176 1 135 . 1 1 18 18 CYS HB3 H 1 3.446 0.030 . 2 . . . . 18 CYS HB3 . 10176 1 136 . 1 1 18 18 CYS C C 13 176.450 0.300 . 1 . . . . 18 CYS C . 10176 1 137 . 1 1 19 19 GLY N N 15 113.303 0.300 . 1 . . . . 19 GLY N . 10176 1 138 . 1 1 19 19 GLY H H 1 8.052 0.030 . 1 . . . . 19 GLY H . 10176 1 139 . 1 1 19 19 GLY CA C 13 46.231 0.300 . 1 . . . . 19 GLY CA . 10176 1 140 . 1 1 19 19 GLY HA2 H 1 3.797 0.030 . 2 . . . . 19 GLY HA2 . 10176 1 141 . 1 1 19 19 GLY HA3 H 1 4.246 0.030 . 2 . . . . 19 GLY HA3 . 10176 1 142 . 1 1 19 19 GLY C C 13 173.412 0.300 . 1 . . . . 19 GLY C . 10176 1 143 . 1 1 20 20 LYS N N 15 123.674 0.300 . 1 . . . . 20 LYS N . 10176 1 144 . 1 1 20 20 LYS H H 1 8.067 0.030 . 1 . . . . 20 LYS H . 10176 1 145 . 1 1 20 20 LYS CA C 13 58.381 0.300 . 1 . . . . 20 LYS CA . 10176 1 146 . 1 1 20 20 LYS HA H 1 3.928 0.030 . 1 . . . . 20 LYS HA . 10176 1 147 . 1 1 20 20 LYS CB C 13 33.713 0.300 . 1 . . . . 20 LYS CB . 10176 1 148 . 1 1 20 20 LYS HB2 H 1 1.202 0.030 . 2 . . . . 20 LYS HB2 . 10176 1 149 . 1 1 20 20 LYS HB3 H 1 1.601 0.030 . 2 . . . . 20 LYS HB3 . 10176 1 150 . 1 1 20 20 LYS CG C 13 25.795 0.300 . 1 . . . . 20 LYS CG . 10176 1 151 . 1 1 20 20 LYS HG2 H 1 1.292 0.030 . 2 . . . . 20 LYS HG2 . 10176 1 152 . 1 1 20 20 LYS HG3 H 1 0.884 0.030 . 2 . . . . 20 LYS HG3 . 10176 1 153 . 1 1 20 20 LYS CD C 13 29.383 0.300 . 1 . . . . 20 LYS CD . 10176 1 154 . 1 1 20 20 LYS HD2 H 1 1.484 0.030 . 2 . . . . 20 LYS HD2 . 10176 1 155 . 1 1 20 20 LYS HD3 H 1 1.295 0.030 . 2 . . . . 20 LYS HD3 . 10176 1 156 . 1 1 20 20 LYS CE C 13 42.071 0.300 . 1 . . . . 20 LYS CE . 10176 1 157 . 1 1 20 20 LYS HE2 H 1 2.915 0.030 . 2 . . . . 20 LYS HE2 . 10176 1 158 . 1 1 20 20 LYS HE3 H 1 2.802 0.030 . 2 . . . . 20 LYS HE3 . 10176 1 159 . 1 1 20 20 LYS C C 13 173.631 0.300 . 1 . . . . 20 LYS C . 10176 1 160 . 1 1 21 21 ALA N N 15 125.402 0.300 . 1 . . . . 21 ALA N . 10176 1 161 . 1 1 21 21 ALA H H 1 7.887 0.030 . 1 . . . . 21 ALA H . 10176 1 162 . 1 1 21 21 ALA CA C 13 50.759 0.300 . 1 . . . . 21 ALA CA . 10176 1 163 . 1 1 21 21 ALA HA H 1 5.081 0.030 . 1 . . . . 21 ALA HA . 10176 1 164 . 1 1 21 21 ALA CB C 13 21.883 0.300 . 1 . . . . 21 ALA CB . 10176 1 165 . 1 1 21 21 ALA HB1 H 1 1.284 0.030 . 1 . . . . 21 ALA HB . 10176 1 166 . 1 1 21 21 ALA HB2 H 1 1.284 0.030 . 1 . . . . 21 ALA HB . 10176 1 167 . 1 1 21 21 ALA HB3 H 1 1.284 0.030 . 1 . . . . 21 ALA HB . 10176 1 168 . 1 1 21 21 ALA C C 13 176.527 0.300 . 1 . . . . 21 ALA C . 10176 1 169 . 1 1 22 22 PHE N N 15 117.170 0.300 . 1 . . . . 22 PHE N . 10176 1 170 . 1 1 22 22 PHE H H 1 8.990 0.030 . 1 . . . . 22 PHE H . 10176 1 171 . 1 1 22 22 PHE CA C 13 57.350 0.300 . 1 . . . . 22 PHE CA . 10176 1 172 . 1 1 22 22 PHE HA H 1 4.659 0.030 . 1 . . . . 22 PHE HA . 10176 1 173 . 1 1 22 22 PHE CB C 13 44.390 0.300 . 1 . . . . 22 PHE CB . 10176 1 174 . 1 1 22 22 PHE HB2 H 1 3.400 0.030 . 2 . . . . 22 PHE HB2 . 10176 1 175 . 1 1 22 22 PHE HB3 H 1 2.773 0.030 . 2 . . . . 22 PHE HB3 . 10176 1 176 . 1 1 22 22 PHE CD1 C 13 132.345 0.300 . 1 . . . . 22 PHE CD1 . 10176 1 177 . 1 1 22 22 PHE HD1 H 1 7.236 0.030 . 1 . . . . 22 PHE HD1 . 10176 1 178 . 1 1 22 22 PHE CD2 C 13 132.345 0.300 . 1 . . . . 22 PHE CD2 . 10176 1 179 . 1 1 22 22 PHE HD2 H 1 7.236 0.030 . 1 . . . . 22 PHE HD2 . 10176 1 180 . 1 1 22 22 PHE CE1 C 13 130.796 0.300 . 1 . . . . 22 PHE CE1 . 10176 1 181 . 1 1 22 22 PHE HE1 H 1 6.895 0.030 . 1 . . . . 22 PHE HE1 . 10176 1 182 . 1 1 22 22 PHE CE2 C 13 130.796 0.300 . 1 . . . . 22 PHE CE2 . 10176 1 183 . 1 1 22 22 PHE HE2 H 1 6.895 0.030 . 1 . . . . 22 PHE HE2 . 10176 1 184 . 1 1 22 22 PHE CZ C 13 128.719 0.300 . 1 . . . . 22 PHE CZ . 10176 1 185 . 1 1 22 22 PHE HZ H 1 6.219 0.030 . 1 . . . . 22 PHE HZ . 10176 1 186 . 1 1 22 22 PHE C C 13 175.725 0.300 . 1 . . . . 22 PHE C . 10176 1 187 . 1 1 23 23 GLY N N 15 107.188 0.300 . 1 . . . . 23 GLY N . 10176 1 188 . 1 1 23 23 GLY H H 1 9.268 0.030 . 1 . . . . 23 GLY H . 10176 1 189 . 1 1 23 23 GLY CA C 13 46.079 0.300 . 1 . . . . 23 GLY CA . 10176 1 190 . 1 1 23 23 GLY HA2 H 1 4.077 0.030 . 2 . . . . 23 GLY HA2 . 10176 1 191 . 1 1 23 23 GLY HA3 H 1 4.414 0.030 . 2 . . . . 23 GLY HA3 . 10176 1 192 . 1 1 23 23 GLY C C 13 172.890 0.300 . 1 . . . . 23 GLY C . 10176 1 193 . 1 1 24 24 ASP N N 15 114.453 0.300 . 1 . . . . 24 ASP N . 10176 1 194 . 1 1 24 24 ASP H H 1 7.507 0.030 . 1 . . . . 24 ASP H . 10176 1 195 . 1 1 24 24 ASP CA C 13 52.483 0.300 . 1 . . . . 24 ASP CA . 10176 1 196 . 1 1 24 24 ASP HA H 1 4.760 0.030 . 1 . . . . 24 ASP HA . 10176 1 197 . 1 1 24 24 ASP CB C 13 43.786 0.300 . 1 . . . . 24 ASP CB . 10176 1 198 . 1 1 24 24 ASP HB2 H 1 2.755 0.030 . 1 . . . . 24 ASP HB2 . 10176 1 199 . 1 1 24 24 ASP HB3 H 1 2.755 0.030 . 1 . . . . 24 ASP HB3 . 10176 1 200 . 1 1 24 24 ASP C C 13 174.172 0.300 . 1 . . . . 24 ASP C . 10176 1 201 . 1 1 25 25 ASN N N 15 119.702 0.300 . 1 . . . . 25 ASN N . 10176 1 202 . 1 1 25 25 ASN H H 1 8.385 0.030 . 1 . . . . 25 ASN H . 10176 1 203 . 1 1 25 25 ASN CA C 13 55.536 0.300 . 1 . . . . 25 ASN CA . 10176 1 204 . 1 1 25 25 ASN HA H 1 3.715 0.030 . 1 . . . . 25 ASN HA . 10176 1 205 . 1 1 25 25 ASN CB C 13 38.986 0.300 . 1 . . . . 25 ASN CB . 10176 1 206 . 1 1 25 25 ASN HB2 H 1 2.380 0.030 . 2 . . . . 25 ASN HB2 . 10176 1 207 . 1 1 25 25 ASN HB3 H 1 1.987 0.030 . 2 . . . . 25 ASN HB3 . 10176 1 208 . 1 1 25 25 ASN ND2 N 15 111.951 0.300 . 1 . . . . 25 ASN ND2 . 10176 1 209 . 1 1 25 25 ASN HD21 H 1 6.836 0.030 . 2 . . . . 25 ASN HD21 . 10176 1 210 . 1 1 25 25 ASN HD22 H 1 7.345 0.030 . 2 . . . . 25 ASN HD22 . 10176 1 211 . 1 1 25 25 ASN C C 13 177.693 0.300 . 1 . . . . 25 ASN C . 10176 1 212 . 1 1 26 26 SER CA C 13 61.855 0.300 . 1 . . . . 26 SER CA . 10176 1 213 . 1 1 26 26 SER HA H 1 4.021 0.030 . 1 . . . . 26 SER HA . 10176 1 214 . 1 1 26 26 SER CB C 13 62.050 0.300 . 1 . . . . 26 SER CB . 10176 1 215 . 1 1 26 26 SER HB2 H 1 3.856 0.030 . 1 . . . . 26 SER HB2 . 10176 1 216 . 1 1 26 26 SER HB3 H 1 3.856 0.030 . 1 . . . . 26 SER HB3 . 10176 1 217 . 1 1 26 26 SER C C 13 177.134 0.300 . 1 . . . . 26 SER C . 10176 1 218 . 1 1 27 27 SER N N 15 118.698 0.300 . 1 . . . . 27 SER N . 10176 1 219 . 1 1 27 27 SER H H 1 8.647 0.030 . 1 . . . . 27 SER H . 10176 1 220 . 1 1 27 27 SER CA C 13 61.907 0.300 . 1 . . . . 27 SER CA . 10176 1 221 . 1 1 27 27 SER HA H 1 4.100 0.030 . 1 . . . . 27 SER HA . 10176 1 222 . 1 1 27 27 SER CB C 13 62.115 0.300 . 1 . . . . 27 SER CB . 10176 1 223 . 1 1 27 27 SER HB2 H 1 3.889 0.030 . 2 . . . . 27 SER HB2 . 10176 1 224 . 1 1 27 27 SER HB3 H 1 3.858 0.030 . 2 . . . . 27 SER HB3 . 10176 1 225 . 1 1 27 27 SER C C 13 176.423 0.300 . 1 . . . . 27 SER C . 10176 1 226 . 1 1 28 28 CYS N N 15 122.742 0.300 . 1 . . . . 28 CYS N . 10176 1 227 . 1 1 28 28 CYS H H 1 6.956 0.030 . 1 . . . . 28 CYS H . 10176 1 228 . 1 1 28 28 CYS CA C 13 61.820 0.300 . 1 . . . . 28 CYS CA . 10176 1 229 . 1 1 28 28 CYS HA H 1 2.705 0.030 . 1 . . . . 28 CYS HA . 10176 1 230 . 1 1 28 28 CYS CB C 13 26.539 0.300 . 1 . . . . 28 CYS CB . 10176 1 231 . 1 1 28 28 CYS HB2 H 1 2.421 0.030 . 2 . . . . 28 CYS HB2 . 10176 1 232 . 1 1 28 28 CYS HB3 H 1 3.116 0.030 . 2 . . . . 28 CYS HB3 . 10176 1 233 . 1 1 28 28 CYS C C 13 175.832 0.300 . 1 . . . . 28 CYS C . 10176 1 234 . 1 1 29 29 THR N N 15 115.897 0.300 . 1 . . . . 29 THR N . 10176 1 235 . 1 1 29 29 THR H H 1 8.427 0.030 . 1 . . . . 29 THR H . 10176 1 236 . 1 1 29 29 THR CA C 13 66.778 0.300 . 1 . . . . 29 THR CA . 10176 1 237 . 1 1 29 29 THR HA H 1 3.884 0.030 . 1 . . . . 29 THR HA . 10176 1 238 . 1 1 29 29 THR CB C 13 68.701 0.300 . 1 . . . . 29 THR CB . 10176 1 239 . 1 1 29 29 THR HB H 1 4.199 0.030 . 1 . . . . 29 THR HB . 10176 1 240 . 1 1 29 29 THR CG2 C 13 21.566 0.300 . 1 . . . . 29 THR CG2 . 10176 1 241 . 1 1 29 29 THR HG21 H 1 1.194 0.030 . 1 . . . . 29 THR HG2 . 10176 1 242 . 1 1 29 29 THR HG22 H 1 1.194 0.030 . 1 . . . . 29 THR HG2 . 10176 1 243 . 1 1 29 29 THR HG23 H 1 1.194 0.030 . 1 . . . . 29 THR HG2 . 10176 1 244 . 1 1 29 29 THR C C 13 177.027 0.300 . 1 . . . . 29 THR C . 10176 1 245 . 1 1 30 30 GLN N N 15 120.743 0.300 . 1 . . . . 30 GLN N . 10176 1 246 . 1 1 30 30 GLN H H 1 8.083 0.030 . 1 . . . . 30 GLN H . 10176 1 247 . 1 1 30 30 GLN CA C 13 58.996 0.300 . 1 . . . . 30 GLN CA . 10176 1 248 . 1 1 30 30 GLN HA H 1 3.908 0.030 . 1 . . . . 30 GLN HA . 10176 1 249 . 1 1 30 30 GLN CB C 13 28.430 0.300 . 1 . . . . 30 GLN CB . 10176 1 250 . 1 1 30 30 GLN HB2 H 1 2.015 0.030 . 1 . . . . 30 GLN HB2 . 10176 1 251 . 1 1 30 30 GLN HB3 H 1 2.015 0.030 . 1 . . . . 30 GLN HB3 . 10176 1 252 . 1 1 30 30 GLN CG C 13 33.816 0.300 . 1 . . . . 30 GLN CG . 10176 1 253 . 1 1 30 30 GLN HG2 H 1 2.344 0.030 . 2 . . . . 30 GLN HG2 . 10176 1 254 . 1 1 30 30 GLN HG3 H 1 2.417 0.030 . 2 . . . . 30 GLN HG3 . 10176 1 255 . 1 1 30 30 GLN C C 13 178.340 0.300 . 1 . . . . 30 GLN C . 10176 1 256 . 1 1 31 31 HIS N N 15 118.530 0.300 . 1 . . . . 31 HIS N . 10176 1 257 . 1 1 31 31 HIS H H 1 7.436 0.030 . 1 . . . . 31 HIS H . 10176 1 258 . 1 1 31 31 HIS CA C 13 59.161 0.300 . 1 . . . . 31 HIS CA . 10176 1 259 . 1 1 31 31 HIS HA H 1 4.186 0.030 . 1 . . . . 31 HIS HA . 10176 1 260 . 1 1 31 31 HIS CB C 13 28.230 0.300 . 1 . . . . 31 HIS CB . 10176 1 261 . 1 1 31 31 HIS HB2 H 1 3.092 0.030 . 2 . . . . 31 HIS HB2 . 10176 1 262 . 1 1 31 31 HIS HB3 H 1 2.967 0.030 . 2 . . . . 31 HIS HB3 . 10176 1 263 . 1 1 31 31 HIS CD2 C 13 128.284 0.300 . 1 . . . . 31 HIS CD2 . 10176 1 264 . 1 1 31 31 HIS HD2 H 1 7.131 0.030 . 1 . . . . 31 HIS HD2 . 10176 1 265 . 1 1 31 31 HIS CE1 C 13 139.088 0.300 . 1 . . . . 31 HIS CE1 . 10176 1 266 . 1 1 31 31 HIS HE1 H 1 8.003 0.030 . 1 . . . . 31 HIS HE1 . 10176 1 267 . 1 1 31 31 HIS C C 13 176.587 0.300 . 1 . . . . 31 HIS C . 10176 1 268 . 1 1 32 32 GLN N N 15 117.813 0.300 . 1 . . . . 32 GLN N . 10176 1 269 . 1 1 32 32 GLN H H 1 8.384 0.030 . 1 . . . . 32 GLN H . 10176 1 270 . 1 1 32 32 GLN CA C 13 59.325 0.300 . 1 . . . . 32 GLN CA . 10176 1 271 . 1 1 32 32 GLN HA H 1 3.895 0.030 . 1 . . . . 32 GLN HA . 10176 1 272 . 1 1 32 32 GLN CB C 13 28.890 0.300 . 1 . . . . 32 GLN CB . 10176 1 273 . 1 1 32 32 GLN HB2 H 1 2.381 0.030 . 2 . . . . 32 GLN HB2 . 10176 1 274 . 1 1 32 32 GLN HB3 H 1 2.298 0.030 . 2 . . . . 32 GLN HB3 . 10176 1 275 . 1 1 32 32 GLN CG C 13 35.331 0.300 . 1 . . . . 32 GLN CG . 10176 1 276 . 1 1 32 32 GLN HG2 H 1 3.013 0.030 . 2 . . . . 32 GLN HG2 . 10176 1 277 . 1 1 32 32 GLN HG3 H 1 2.940 0.030 . 2 . . . . 32 GLN HG3 . 10176 1 278 . 1 1 32 32 GLN NE2 N 15 112.934 0.300 . 1 . . . . 32 GLN NE2 . 10176 1 279 . 1 1 32 32 GLN HE21 H 1 7.110 0.030 . 2 . . . . 32 GLN HE21 . 10176 1 280 . 1 1 32 32 GLN HE22 H 1 7.503 0.030 . 2 . . . . 32 GLN HE22 . 10176 1 281 . 1 1 32 32 GLN C C 13 178.421 0.300 . 1 . . . . 32 GLN C . 10176 1 282 . 1 1 33 33 ARG N N 15 117.148 0.300 . 1 . . . . 33 ARG N . 10176 1 283 . 1 1 33 33 ARG H H 1 7.394 0.030 . 1 . . . . 33 ARG H . 10176 1 284 . 1 1 33 33 ARG CA C 13 58.234 0.300 . 1 . . . . 33 ARG CA . 10176 1 285 . 1 1 33 33 ARG HA H 1 4.123 0.030 . 1 . . . . 33 ARG HA . 10176 1 286 . 1 1 33 33 ARG CB C 13 29.993 0.300 . 1 . . . . 33 ARG CB . 10176 1 287 . 1 1 33 33 ARG HB2 H 1 1.883 0.030 . 2 . . . . 33 ARG HB2 . 10176 1 288 . 1 1 33 33 ARG HB3 H 1 1.834 0.030 . 2 . . . . 33 ARG HB3 . 10176 1 289 . 1 1 33 33 ARG CG C 13 27.551 0.300 . 1 . . . . 33 ARG CG . 10176 1 290 . 1 1 33 33 ARG HG2 H 1 1.709 0.030 . 2 . . . . 33 ARG HG2 . 10176 1 291 . 1 1 33 33 ARG HG3 H 1 1.801 0.030 . 2 . . . . 33 ARG HG3 . 10176 1 292 . 1 1 33 33 ARG CD C 13 43.555 0.300 . 1 . . . . 33 ARG CD . 10176 1 293 . 1 1 33 33 ARG HD2 H 1 3.170 0.030 . 1 . . . . 33 ARG HD2 . 10176 1 294 . 1 1 33 33 ARG HD3 H 1 3.170 0.030 . 1 . . . . 33 ARG HD3 . 10176 1 295 . 1 1 33 33 ARG C C 13 177.784 0.300 . 1 . . . . 33 ARG C . 10176 1 296 . 1 1 34 34 LEU N N 15 118.313 0.300 . 1 . . . . 34 LEU N . 10176 1 297 . 1 1 34 34 LEU H H 1 7.675 0.030 . 1 . . . . 34 LEU H . 10176 1 298 . 1 1 34 34 LEU CA C 13 56.303 0.300 . 1 . . . . 34 LEU CA . 10176 1 299 . 1 1 34 34 LEU HA H 1 4.058 0.030 . 1 . . . . 34 LEU HA . 10176 1 300 . 1 1 34 34 LEU CB C 13 41.324 0.300 . 1 . . . . 34 LEU CB . 10176 1 301 . 1 1 34 34 LEU HB2 H 1 1.411 0.030 . 2 . . . . 34 LEU HB2 . 10176 1 302 . 1 1 34 34 LEU HB3 H 1 1.236 0.030 . 2 . . . . 34 LEU HB3 . 10176 1 303 . 1 1 34 34 LEU CG C 13 26.695 0.300 . 1 . . . . 34 LEU CG . 10176 1 304 . 1 1 34 34 LEU HG H 1 1.627 0.030 . 1 . . . . 34 LEU HG . 10176 1 305 . 1 1 34 34 LEU CD1 C 13 25.121 0.300 . 2 . . . . 34 LEU CD1 . 10176 1 306 . 1 1 34 34 LEU HD11 H 1 0.828 0.030 . 1 . . . . 34 LEU HD1 . 10176 1 307 . 1 1 34 34 LEU HD12 H 1 0.828 0.030 . 1 . . . . 34 LEU HD1 . 10176 1 308 . 1 1 34 34 LEU HD13 H 1 0.828 0.030 . 1 . . . . 34 LEU HD1 . 10176 1 309 . 1 1 34 34 LEU CD2 C 13 22.879 0.300 . 2 . . . . 34 LEU CD2 . 10176 1 310 . 1 1 34 34 LEU HD21 H 1 0.766 0.030 . 1 . . . . 34 LEU HD2 . 10176 1 311 . 1 1 34 34 LEU HD22 H 1 0.766 0.030 . 1 . . . . 34 LEU HD2 . 10176 1 312 . 1 1 34 34 LEU HD23 H 1 0.766 0.030 . 1 . . . . 34 LEU HD2 . 10176 1 313 . 1 1 34 34 LEU C C 13 178.808 0.300 . 1 . . . . 34 LEU C . 10176 1 314 . 1 1 35 35 HIS N N 15 115.638 0.300 . 1 . . . . 35 HIS N . 10176 1 315 . 1 1 35 35 HIS H H 1 7.266 0.030 . 1 . . . . 35 HIS H . 10176 1 316 . 1 1 35 35 HIS CA C 13 56.022 0.300 . 1 . . . . 35 HIS CA . 10176 1 317 . 1 1 35 35 HIS HA H 1 4.712 0.030 . 1 . . . . 35 HIS HA . 10176 1 318 . 1 1 35 35 HIS CB C 13 28.540 0.300 . 1 . . . . 35 HIS CB . 10176 1 319 . 1 1 35 35 HIS HB2 H 1 3.305 0.030 . 2 . . . . 35 HIS HB2 . 10176 1 320 . 1 1 35 35 HIS HB3 H 1 3.216 0.030 . 2 . . . . 35 HIS HB3 . 10176 1 321 . 1 1 35 35 HIS CD2 C 13 127.778 0.300 . 1 . . . . 35 HIS CD2 . 10176 1 322 . 1 1 35 35 HIS HD2 H 1 6.844 0.030 . 1 . . . . 35 HIS HD2 . 10176 1 323 . 1 1 35 35 HIS CE1 C 13 140.108 0.300 . 1 . . . . 35 HIS CE1 . 10176 1 324 . 1 1 35 35 HIS HE1 H 1 8.067 0.030 . 1 . . . . 35 HIS HE1 . 10176 1 325 . 1 1 35 35 HIS C C 13 175.711 0.300 . 1 . . . . 35 HIS C . 10176 1 326 . 1 1 36 36 THR N N 15 112.637 0.300 . 1 . . . . 36 THR N . 10176 1 327 . 1 1 36 36 THR H H 1 7.882 0.030 . 1 . . . . 36 THR H . 10176 1 328 . 1 1 36 36 THR CA C 13 62.455 0.300 . 1 . . . . 36 THR CA . 10176 1 329 . 1 1 36 36 THR HA H 1 4.359 0.030 . 1 . . . . 36 THR HA . 10176 1 330 . 1 1 36 36 THR CB C 13 69.921 0.300 . 1 . . . . 36 THR CB . 10176 1 331 . 1 1 36 36 THR HB H 1 4.321 0.030 . 1 . . . . 36 THR HB . 10176 1 332 . 1 1 36 36 THR CG2 C 13 21.604 0.300 . 1 . . . . 36 THR CG2 . 10176 1 333 . 1 1 36 36 THR HG21 H 1 1.247 0.030 . 1 . . . . 36 THR HG2 . 10176 1 334 . 1 1 36 36 THR HG22 H 1 1.247 0.030 . 1 . . . . 36 THR HG2 . 10176 1 335 . 1 1 36 36 THR HG23 H 1 1.247 0.030 . 1 . . . . 36 THR HG2 . 10176 1 336 . 1 1 36 36 THR C C 13 175.355 0.300 . 1 . . . . 36 THR C . 10176 1 337 . 1 1 37 37 GLY N N 15 110.846 0.300 . 1 . . . . 37 GLY N . 10176 1 338 . 1 1 37 37 GLY H H 1 8.350 0.030 . 1 . . . . 37 GLY H . 10176 1 339 . 1 1 37 37 GLY CA C 13 45.411 0.300 . 1 . . . . 37 GLY CA . 10176 1 340 . 1 1 37 37 GLY HA2 H 1 4.005 0.030 . 1 . . . . 37 GLY HA2 . 10176 1 341 . 1 1 37 37 GLY HA3 H 1 4.005 0.030 . 1 . . . . 37 GLY HA3 . 10176 1 342 . 1 1 37 37 GLY C C 13 174.062 0.300 . 1 . . . . 37 GLY C . 10176 1 343 . 1 1 38 38 GLN N N 15 119.605 0.300 . 1 . . . . 38 GLN N . 10176 1 344 . 1 1 38 38 GLN H H 1 8.139 0.030 . 1 . . . . 38 GLN H . 10176 1 345 . 1 1 38 38 GLN CA C 13 55.660 0.300 . 1 . . . . 38 GLN CA . 10176 1 346 . 1 1 38 38 GLN HA H 1 4.330 0.030 . 1 . . . . 38 GLN HA . 10176 1 347 . 1 1 38 38 GLN CB C 13 29.565 0.300 . 1 . . . . 38 GLN CB . 10176 1 348 . 1 1 38 38 GLN HB2 H 1 2.085 0.030 . 2 . . . . 38 GLN HB2 . 10176 1 349 . 1 1 38 38 GLN HB3 H 1 1.962 0.030 . 2 . . . . 38 GLN HB3 . 10176 1 350 . 1 1 38 38 GLN CG C 13 33.814 0.300 . 1 . . . . 38 GLN CG . 10176 1 351 . 1 1 38 38 GLN HG2 H 1 2.344 0.030 . 1 . . . . 38 GLN HG2 . 10176 1 352 . 1 1 38 38 GLN HG3 H 1 2.344 0.030 . 1 . . . . 38 GLN HG3 . 10176 1 353 . 1 1 38 38 GLN C C 13 175.790 0.300 . 1 . . . . 38 GLN C . 10176 1 354 . 1 1 39 39 ARG N N 15 123.670 0.300 . 1 . . . . 39 ARG N . 10176 1 355 . 1 1 39 39 ARG H H 1 8.405 0.030 . 1 . . . . 39 ARG H . 10176 1 356 . 1 1 39 39 ARG CA C 13 54.074 0.300 . 1 . . . . 39 ARG CA . 10176 1 357 . 1 1 39 39 ARG HA H 1 4.624 0.030 . 1 . . . . 39 ARG HA . 10176 1 358 . 1 1 39 39 ARG CB C 13 30.193 0.300 . 1 . . . . 39 ARG CB . 10176 1 359 . 1 1 39 39 ARG HB2 H 1 1.849 0.030 . 2 . . . . 39 ARG HB2 . 10176 1 360 . 1 1 39 39 ARG HB3 H 1 1.746 0.030 . 2 . . . . 39 ARG HB3 . 10176 1 361 . 1 1 39 39 ARG CG C 13 26.755 0.300 . 1 . . . . 39 ARG CG . 10176 1 362 . 1 1 39 39 ARG HG2 H 1 1.681 0.030 . 1 . . . . 39 ARG HG2 . 10176 1 363 . 1 1 39 39 ARG HG3 H 1 1.681 0.030 . 1 . . . . 39 ARG HG3 . 10176 1 364 . 1 1 39 39 ARG CD C 13 43.371 0.300 . 1 . . . . 39 ARG CD . 10176 1 365 . 1 1 39 39 ARG HD2 H 1 3.209 0.030 . 1 . . . . 39 ARG HD2 . 10176 1 366 . 1 1 39 39 ARG HD3 H 1 3.209 0.030 . 1 . . . . 39 ARG HD3 . 10176 1 367 . 1 1 39 39 ARG C C 13 174.276 0.300 . 1 . . . . 39 ARG C . 10176 1 368 . 1 1 40 40 PRO CA C 13 63.263 0.300 . 1 . . . . 40 PRO CA . 10176 1 369 . 1 1 40 40 PRO HA H 1 4.475 0.030 . 1 . . . . 40 PRO HA . 10176 1 370 . 1 1 40 40 PRO CB C 13 32.130 0.300 . 1 . . . . 40 PRO CB . 10176 1 371 . 1 1 40 40 PRO HB2 H 1 2.313 0.030 . 2 . . . . 40 PRO HB2 . 10176 1 372 . 1 1 40 40 PRO HB3 H 1 1.945 0.030 . 2 . . . . 40 PRO HB3 . 10176 1 373 . 1 1 40 40 PRO CG C 13 27.298 0.300 . 1 . . . . 40 PRO CG . 10176 1 374 . 1 1 40 40 PRO HG2 H 1 2.019 0.030 . 1 . . . . 40 PRO HG2 . 10176 1 375 . 1 1 40 40 PRO HG3 H 1 2.019 0.030 . 1 . . . . 40 PRO HG3 . 10176 1 376 . 1 1 40 40 PRO CD C 13 50.691 0.300 . 1 . . . . 40 PRO CD . 10176 1 377 . 1 1 40 40 PRO HD2 H 1 3.816 0.030 . 2 . . . . 40 PRO HD2 . 10176 1 378 . 1 1 40 40 PRO HD3 H 1 3.637 0.030 . 2 . . . . 40 PRO HD3 . 10176 1 stop_ save_