################################### # 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 11363 _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 15N-separated NOESY' 1 $sample_1 isotropic 11363 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11363 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 $XWINNMR . . 11363 1 2 $NMRPipe . . 11363 1 3 $NMRView . . 11363 1 4 $Kujira . . 11363 1 5 $CYANA . . 11363 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 6 6 SER HA H 1 4.488 0.030 . 1 . . . . 6 SER HA . 11363 1 2 . 1 1 6 6 SER HB2 H 1 3.873 0.030 . 1 . . . . 6 SER HB2 . 11363 1 3 . 1 1 6 6 SER HB3 H 1 3.873 0.030 . 1 . . . . 6 SER HB3 . 11363 1 4 . 1 1 6 6 SER C C 13 175.007 0.300 . 1 . . . . 6 SER C . 11363 1 5 . 1 1 6 6 SER CA C 13 58.745 0.300 . 1 . . . . 6 SER CA . 11363 1 6 . 1 1 6 6 SER CB C 13 63.861 0.300 . 1 . . . . 6 SER CB . 11363 1 7 . 1 1 7 7 GLY H H 1 8.418 0.030 . 1 . . . . 7 GLY H . 11363 1 8 . 1 1 7 7 GLY HA2 H 1 3.958 0.030 . 1 . . . . 7 GLY HA2 . 11363 1 9 . 1 1 7 7 GLY HA3 H 1 3.958 0.030 . 1 . . . . 7 GLY HA3 . 11363 1 10 . 1 1 7 7 GLY C C 13 173.958 0.300 . 1 . . . . 7 GLY C . 11363 1 11 . 1 1 7 7 GLY CA C 13 45.382 0.300 . 1 . . . . 7 GLY CA . 11363 1 12 . 1 1 7 7 GLY N N 15 110.818 0.300 . 1 . . . . 7 GLY N . 11363 1 13 . 1 1 8 8 MET H H 1 8.137 0.030 . 1 . . . . 8 MET H . 11363 1 14 . 1 1 8 8 MET HA H 1 4.480 0.030 . 1 . . . . 8 MET HA . 11363 1 15 . 1 1 8 8 MET HB2 H 1 2.052 0.030 . 2 . . . . 8 MET HB2 . 11363 1 16 . 1 1 8 8 MET HB3 H 1 1.930 0.030 . 2 . . . . 8 MET HB3 . 11363 1 17 . 1 1 8 8 MET HE1 H 1 2.063 0.030 . 1 . . . . 8 MET HE . 11363 1 18 . 1 1 8 8 MET HE2 H 1 2.063 0.030 . 1 . . . . 8 MET HE . 11363 1 19 . 1 1 8 8 MET HE3 H 1 2.063 0.030 . 1 . . . . 8 MET HE . 11363 1 20 . 1 1 8 8 MET HG2 H 1 2.540 0.030 . 2 . . . . 8 MET HG2 . 11363 1 21 . 1 1 8 8 MET HG3 H 1 2.470 0.030 . 2 . . . . 8 MET HG3 . 11363 1 22 . 1 1 8 8 MET C C 13 175.990 0.300 . 1 . . . . 8 MET C . 11363 1 23 . 1 1 8 8 MET CA C 13 55.119 0.300 . 1 . . . . 8 MET CA . 11363 1 24 . 1 1 8 8 MET CB C 13 33.091 0.300 . 1 . . . . 8 MET CB . 11363 1 25 . 1 1 8 8 MET CE C 13 16.973 0.300 . 1 . . . . 8 MET CE . 11363 1 26 . 1 1 8 8 MET CG C 13 31.974 0.300 . 1 . . . . 8 MET CG . 11363 1 27 . 1 1 8 8 MET N N 15 119.482 0.300 . 1 . . . . 8 MET N . 11363 1 28 . 1 1 9 9 GLU H H 1 8.420 0.030 . 1 . . . . 9 GLU H . 11363 1 29 . 1 1 9 9 GLU HA H 1 4.500 0.030 . 1 . . . . 9 GLU HA . 11363 1 30 . 1 1 9 9 GLU HB2 H 1 1.977 0.030 . 2 . . . . 9 GLU HB2 . 11363 1 31 . 1 1 9 9 GLU HB3 H 1 1.852 0.030 . 2 . . . . 9 GLU HB3 . 11363 1 32 . 1 1 9 9 GLU HG2 H 1 2.266 0.030 . 1 . . . . 9 GLU HG2 . 11363 1 33 . 1 1 9 9 GLU HG3 H 1 2.266 0.030 . 1 . . . . 9 GLU HG3 . 11363 1 34 . 1 1 9 9 GLU C C 13 174.387 0.300 . 1 . . . . 9 GLU C . 11363 1 35 . 1 1 9 9 GLU CA C 13 54.563 0.300 . 1 . . . . 9 GLU CA . 11363 1 36 . 1 1 9 9 GLU CB C 13 29.429 0.300 . 1 . . . . 9 GLU CB . 11363 1 37 . 1 1 9 9 GLU CG C 13 35.959 0.300 . 1 . . . . 9 GLU CG . 11363 1 38 . 1 1 9 9 GLU N N 15 123.615 0.300 . 1 . . . . 9 GLU N . 11363 1 39 . 1 1 10 10 PRO HA H 1 4.314 0.030 . 1 . . . . 10 PRO HA . 11363 1 40 . 1 1 10 10 PRO HB2 H 1 2.112 0.030 . 2 . . . . 10 PRO HB2 . 11363 1 41 . 1 1 10 10 PRO HB3 H 1 1.784 0.030 . 2 . . . . 10 PRO HB3 . 11363 1 42 . 1 1 10 10 PRO HD2 H 1 3.718 0.030 . 2 . . . . 10 PRO HD2 . 11363 1 43 . 1 1 10 10 PRO HD3 H 1 3.580 0.030 . 2 . . . . 10 PRO HD3 . 11363 1 44 . 1 1 10 10 PRO HG2 H 1 1.885 0.030 . 2 . . . . 10 PRO HG2 . 11363 1 45 . 1 1 10 10 PRO HG3 H 1 1.850 0.030 . 2 . . . . 10 PRO HG3 . 11363 1 46 . 1 1 10 10 PRO C C 13 176.133 0.300 . 1 . . . . 10 PRO C . 11363 1 47 . 1 1 10 10 PRO CA C 13 63.053 0.300 . 1 . . . . 10 PRO CA . 11363 1 48 . 1 1 10 10 PRO CB C 13 31.985 0.300 . 1 . . . . 10 PRO CB . 11363 1 49 . 1 1 10 10 PRO CD C 13 50.458 0.300 . 1 . . . . 10 PRO CD . 11363 1 50 . 1 1 10 10 PRO CG C 13 27.289 0.300 . 1 . . . . 10 PRO CG . 11363 1 51 . 1 1 11 11 ALA H H 1 8.239 0.030 . 1 . . . . 11 ALA H . 11363 1 52 . 1 1 11 11 ALA HA H 1 4.357 0.030 . 1 . . . . 11 ALA HA . 11363 1 53 . 1 1 11 11 ALA HB1 H 1 1.279 0.030 . 1 . . . . 11 ALA HB . 11363 1 54 . 1 1 11 11 ALA HB2 H 1 1.279 0.030 . 1 . . . . 11 ALA HB . 11363 1 55 . 1 1 11 11 ALA HB3 H 1 1.279 0.030 . 1 . . . . 11 ALA HB . 11363 1 56 . 1 1 11 11 ALA C C 13 177.498 0.300 . 1 . . . . 11 ALA C . 11363 1 57 . 1 1 11 11 ALA CA C 13 52.054 0.300 . 1 . . . . 11 ALA CA . 11363 1 58 . 1 1 11 11 ALA CB C 13 19.982 0.300 . 1 . . . . 11 ALA CB . 11363 1 59 . 1 1 11 11 ALA N N 15 124.138 0.300 . 1 . . . . 11 ALA N . 11363 1 60 . 1 1 12 12 GLY H H 1 8.150 0.030 . 1 . . . . 12 GLY H . 11363 1 61 . 1 1 12 12 GLY HA2 H 1 4.110 0.030 . 2 . . . . 12 GLY HA2 . 11363 1 62 . 1 1 12 12 GLY HA3 H 1 3.974 0.030 . 2 . . . . 12 GLY HA3 . 11363 1 63 . 1 1 12 12 GLY C C 13 177.528 0.300 . 1 . . . . 12 GLY C . 11363 1 64 . 1 1 12 12 GLY CA C 13 44.404 0.300 . 1 . . . . 12 GLY CA . 11363 1 65 . 1 1 12 12 GLY N N 15 108.262 0.300 . 1 . . . . 12 GLY N . 11363 1 66 . 1 1 13 13 PRO HA H 1 4.415 0.030 . 1 . . . . 13 PRO HA . 11363 1 67 . 1 1 13 13 PRO HB2 H 1 2.093 0.030 . 2 . . . . 13 PRO HB2 . 11363 1 68 . 1 1 13 13 PRO HB3 H 1 1.781 0.030 . 2 . . . . 13 PRO HB3 . 11363 1 69 . 1 1 13 13 PRO HD2 H 1 3.593 0.030 . 2 . . . . 13 PRO HD2 . 11363 1 70 . 1 1 13 13 PRO HD3 H 1 3.507 0.030 . 2 . . . . 13 PRO HD3 . 11363 1 71 . 1 1 13 13 PRO HG2 H 1 1.942 0.030 . 1 . . . . 13 PRO HG2 . 11363 1 72 . 1 1 13 13 PRO HG3 H 1 1.942 0.030 . 1 . . . . 13 PRO HG3 . 11363 1 73 . 1 1 13 13 PRO C C 13 176.871 0.300 . 1 . . . . 13 PRO C . 11363 1 74 . 1 1 13 13 PRO CA C 13 62.492 0.300 . 1 . . . . 13 PRO CA . 11363 1 75 . 1 1 13 13 PRO CB C 13 32.562 0.300 . 1 . . . . 13 PRO CB . 11363 1 76 . 1 1 13 13 PRO CD C 13 49.553 0.300 . 1 . . . . 13 PRO CD . 11363 1 77 . 1 1 13 13 PRO CG C 13 26.760 0.300 . 1 . . . . 13 PRO CG . 11363 1 78 . 1 1 14 14 CYS H H 1 8.494 0.030 . 1 . . . . 14 CYS H . 11363 1 79 . 1 1 14 14 CYS HA H 1 3.921 0.030 . 1 . . . . 14 CYS HA . 11363 1 80 . 1 1 14 14 CYS HB2 H 1 3.831 0.030 . 2 . . . . 14 CYS HB2 . 11363 1 81 . 1 1 14 14 CYS HB3 H 1 2.661 0.030 . 2 . . . . 14 CYS HB3 . 11363 1 82 . 1 1 14 14 CYS C C 13 176.555 0.300 . 1 . . . . 14 CYS C . 11363 1 83 . 1 1 14 14 CYS CA C 13 60.716 0.300 . 1 . . . . 14 CYS CA . 11363 1 84 . 1 1 14 14 CYS CB C 13 31.837 0.300 . 1 . . . . 14 CYS CB . 11363 1 85 . 1 1 14 14 CYS N N 15 124.262 0.300 . 1 . . . . 14 CYS N . 11363 1 86 . 1 1 15 15 GLY H H 1 8.804 0.030 . 1 . . . . 15 GLY H . 11363 1 87 . 1 1 15 15 GLY HA2 H 1 4.029 0.030 . 2 . . . . 15 GLY HA2 . 11363 1 88 . 1 1 15 15 GLY HA3 H 1 3.270 0.030 . 2 . . . . 15 GLY HA3 . 11363 1 89 . 1 1 15 15 GLY C C 13 174.077 0.300 . 1 . . . . 15 GLY C . 11363 1 90 . 1 1 15 15 GLY CA C 13 45.858 0.300 . 1 . . . . 15 GLY CA . 11363 1 91 . 1 1 15 15 GLY N N 15 117.115 0.300 . 1 . . . . 15 GLY N . 11363 1 92 . 1 1 16 16 PHE H H 1 9.149 0.030 . 1 . . . . 16 PHE H . 11363 1 93 . 1 1 16 16 PHE HA H 1 4.725 0.030 . 1 . . . . 16 PHE HA . 11363 1 94 . 1 1 16 16 PHE HB2 H 1 3.401 0.030 . 2 . . . . 16 PHE HB2 . 11363 1 95 . 1 1 16 16 PHE HB3 H 1 2.928 0.030 . 2 . . . . 16 PHE HB3 . 11363 1 96 . 1 1 16 16 PHE HD1 H 1 7.460 0.030 . 1 . . . . 16 PHE HD1 . 11363 1 97 . 1 1 16 16 PHE HD2 H 1 7.460 0.030 . 1 . . . . 16 PHE HD2 . 11363 1 98 . 1 1 16 16 PHE HZ H 1 7.166 0.030 . 1 . . . . 16 PHE HZ . 11363 1 99 . 1 1 16 16 PHE C C 13 175.593 0.300 . 1 . . . . 16 PHE C . 11363 1 100 . 1 1 16 16 PHE CA C 13 58.450 0.300 . 1 . . . . 16 PHE CA . 11363 1 101 . 1 1 16 16 PHE CB C 13 41.063 0.300 . 1 . . . . 16 PHE CB . 11363 1 102 . 1 1 16 16 PHE CD1 C 13 132.139 0.300 . 1 . . . . 16 PHE CD1 . 11363 1 103 . 1 1 16 16 PHE CD2 C 13 132.139 0.300 . 1 . . . . 16 PHE CD2 . 11363 1 104 . 1 1 16 16 PHE CZ C 13 129.630 0.300 . 1 . . . . 16 PHE CZ . 11363 1 105 . 1 1 16 16 PHE N N 15 120.923 0.300 . 1 . . . . 16 PHE N . 11363 1 106 . 1 1 17 17 CYS H H 1 7.060 0.030 . 1 . . . . 17 CYS H . 11363 1 107 . 1 1 17 17 CYS HA H 1 4.196 0.030 . 1 . . . . 17 CYS HA . 11363 1 108 . 1 1 17 17 CYS HB2 H 1 2.941 0.030 . 2 . . . . 17 CYS HB2 . 11363 1 109 . 1 1 17 17 CYS HB3 H 1 2.605 0.030 . 2 . . . . 17 CYS HB3 . 11363 1 110 . 1 1 17 17 CYS C C 13 173.106 0.300 . 1 . . . . 17 CYS C . 11363 1 111 . 1 1 17 17 CYS CA C 13 61.715 0.300 . 1 . . . . 17 CYS CA . 11363 1 112 . 1 1 17 17 CYS CB C 13 31.302 0.300 . 1 . . . . 17 CYS CB . 11363 1 113 . 1 1 17 17 CYS N N 15 124.814 0.300 . 1 . . . . 17 CYS N . 11363 1 114 . 1 1 18 18 PRO HA H 1 4.391 0.030 . 1 . . . . 18 PRO HA . 11363 1 115 . 1 1 18 18 PRO HB2 H 1 2.308 0.030 . 2 . . . . 18 PRO HB2 . 11363 1 116 . 1 1 18 18 PRO HB3 H 1 1.832 0.030 . 2 . . . . 18 PRO HB3 . 11363 1 117 . 1 1 18 18 PRO HD2 H 1 3.783 0.030 . 2 . . . . 18 PRO HD2 . 11363 1 118 . 1 1 18 18 PRO HD3 H 1 3.534 0.030 . 2 . . . . 18 PRO HD3 . 11363 1 119 . 1 1 18 18 PRO HG2 H 1 2.010 0.030 . 1 . . . . 18 PRO HG2 . 11363 1 120 . 1 1 18 18 PRO HG3 H 1 2.010 0.030 . 1 . . . . 18 PRO HG3 . 11363 1 121 . 1 1 18 18 PRO C C 13 175.981 0.300 . 1 . . . . 18 PRO C . 11363 1 122 . 1 1 18 18 PRO CA C 13 62.345 0.300 . 1 . . . . 18 PRO CA . 11363 1 123 . 1 1 18 18 PRO CB C 13 32.097 0.300 . 1 . . . . 18 PRO CB . 11363 1 124 . 1 1 18 18 PRO CD C 13 50.479 0.300 . 1 . . . . 18 PRO CD . 11363 1 125 . 1 1 18 18 PRO CG C 13 27.625 0.300 . 1 . . . . 18 PRO CG . 11363 1 126 . 1 1 19 19 ALA H H 1 8.212 0.030 . 1 . . . . 19 ALA H . 11363 1 127 . 1 1 19 19 ALA HA H 1 3.999 0.030 . 1 . . . . 19 ALA HA . 11363 1 128 . 1 1 19 19 ALA HB1 H 1 1.352 0.030 . 1 . . . . 19 ALA HB . 11363 1 129 . 1 1 19 19 ALA HB2 H 1 1.352 0.030 . 1 . . . . 19 ALA HB . 11363 1 130 . 1 1 19 19 ALA HB3 H 1 1.352 0.030 . 1 . . . . 19 ALA HB . 11363 1 131 . 1 1 19 19 ALA C C 13 179.075 0.300 . 1 . . . . 19 ALA C . 11363 1 132 . 1 1 19 19 ALA CA C 13 53.787 0.300 . 1 . . . . 19 ALA CA . 11363 1 133 . 1 1 19 19 ALA CB C 13 18.254 0.300 . 1 . . . . 19 ALA CB . 11363 1 134 . 1 1 19 19 ALA N N 15 122.906 0.300 . 1 . . . . 19 ALA N . 11363 1 135 . 1 1 20 20 GLY H H 1 8.663 0.030 . 1 . . . . 20 GLY H . 11363 1 136 . 1 1 20 20 GLY HA2 H 1 4.179 0.030 . 2 . . . . 20 GLY HA2 . 11363 1 137 . 1 1 20 20 GLY HA3 H 1 3.780 0.030 . 2 . . . . 20 GLY HA3 . 11363 1 138 . 1 1 20 20 GLY C C 13 174.394 0.300 . 1 . . . . 20 GLY C . 11363 1 139 . 1 1 20 20 GLY CA C 13 45.331 0.300 . 1 . . . . 20 GLY CA . 11363 1 140 . 1 1 20 20 GLY N N 15 109.238 0.300 . 1 . . . . 20 GLY N . 11363 1 141 . 1 1 21 21 GLU H H 1 7.986 0.030 . 1 . . . . 21 GLU H . 11363 1 142 . 1 1 21 21 GLU HA H 1 4.620 0.030 . 1 . . . . 21 GLU HA . 11363 1 143 . 1 1 21 21 GLU HB2 H 1 2.212 0.030 . 2 . . . . 21 GLU HB2 . 11363 1 144 . 1 1 21 21 GLU HB3 H 1 1.779 0.030 . 2 . . . . 21 GLU HB3 . 11363 1 145 . 1 1 21 21 GLU HG2 H 1 2.128 0.030 . 1 . . . . 21 GLU HG2 . 11363 1 146 . 1 1 21 21 GLU HG3 H 1 2.128 0.030 . 1 . . . . 21 GLU HG3 . 11363 1 147 . 1 1 21 21 GLU C C 13 175.181 0.300 . 1 . . . . 21 GLU C . 11363 1 148 . 1 1 21 21 GLU CA C 13 54.895 0.300 . 1 . . . . 21 GLU CA . 11363 1 149 . 1 1 21 21 GLU CB C 13 30.633 0.300 . 1 . . . . 21 GLU CB . 11363 1 150 . 1 1 21 21 GLU CG C 13 36.302 0.300 . 1 . . . . 21 GLU CG . 11363 1 151 . 1 1 21 21 GLU N N 15 121.101 0.300 . 1 . . . . 21 GLU N . 11363 1 152 . 1 1 22 22 VAL H H 1 7.806 0.030 . 1 . . . . 22 VAL H . 11363 1 153 . 1 1 22 22 VAL HA H 1 4.058 0.030 . 1 . . . . 22 VAL HA . 11363 1 154 . 1 1 22 22 VAL HB H 1 1.960 0.030 . 1 . . . . 22 VAL HB . 11363 1 155 . 1 1 22 22 VAL HG11 H 1 0.971 0.030 . 1 . . . . 22 VAL HG1 . 11363 1 156 . 1 1 22 22 VAL HG12 H 1 0.971 0.030 . 1 . . . . 22 VAL HG1 . 11363 1 157 . 1 1 22 22 VAL HG13 H 1 0.971 0.030 . 1 . . . . 22 VAL HG1 . 11363 1 158 . 1 1 22 22 VAL HG21 H 1 0.978 0.030 . 1 . . . . 22 VAL HG2 . 11363 1 159 . 1 1 22 22 VAL HG22 H 1 0.978 0.030 . 1 . . . . 22 VAL HG2 . 11363 1 160 . 1 1 22 22 VAL HG23 H 1 0.978 0.030 . 1 . . . . 22 VAL HG2 . 11363 1 161 . 1 1 22 22 VAL C C 13 176.081 0.300 . 1 . . . . 22 VAL C . 11363 1 162 . 1 1 22 22 VAL CA C 13 63.377 0.300 . 1 . . . . 22 VAL CA . 11363 1 163 . 1 1 22 22 VAL CB C 13 32.465 0.300 . 1 . . . . 22 VAL CB . 11363 1 164 . 1 1 22 22 VAL CG1 C 13 22.079 0.300 . 2 . . . . 22 VAL CG1 . 11363 1 165 . 1 1 22 22 VAL CG2 C 13 21.997 0.300 . 2 . . . . 22 VAL CG2 . 11363 1 166 . 1 1 22 22 VAL N N 15 121.489 0.300 . 1 . . . . 22 VAL N . 11363 1 167 . 1 1 23 23 GLN H H 1 8.892 0.030 . 1 . . . . 23 GLN H . 11363 1 168 . 1 1 23 23 GLN HA H 1 4.831 0.030 . 1 . . . . 23 GLN HA . 11363 1 169 . 1 1 23 23 GLN HB2 H 1 2.186 0.030 . 2 . . . . 23 GLN HB2 . 11363 1 170 . 1 1 23 23 GLN HB3 H 1 2.150 0.030 . 2 . . . . 23 GLN HB3 . 11363 1 171 . 1 1 23 23 GLN HE21 H 1 6.860 0.030 . 2 . . . . 23 GLN HE21 . 11363 1 172 . 1 1 23 23 GLN HE22 H 1 7.504 0.030 . 2 . . . . 23 GLN HE22 . 11363 1 173 . 1 1 23 23 GLN HG2 H 1 2.630 0.030 . 1 . . . . 23 GLN HG2 . 11363 1 174 . 1 1 23 23 GLN HG3 H 1 2.630 0.030 . 1 . . . . 23 GLN HG3 . 11363 1 175 . 1 1 23 23 GLN C C 13 179.682 0.300 . 1 . . . . 23 GLN C . 11363 1 176 . 1 1 23 23 GLN CA C 13 52.915 0.300 . 1 . . . . 23 GLN CA . 11363 1 177 . 1 1 23 23 GLN CB C 13 30.033 0.300 . 1 . . . . 23 GLN CB . 11363 1 178 . 1 1 23 23 GLN CG C 13 33.995 0.300 . 1 . . . . 23 GLN CG . 11363 1 179 . 1 1 23 23 GLN N N 15 129.808 0.300 . 1 . . . . 23 GLN N . 11363 1 180 . 1 1 23 23 GLN NE2 N 15 113.851 0.300 . 1 . . . . 23 GLN NE2 . 11363 1 181 . 1 1 24 24 PRO HA H 1 4.302 0.030 . 1 . . . . 24 PRO HA . 11363 1 182 . 1 1 24 24 PRO HB2 H 1 2.160 0.030 . 2 . . . . 24 PRO HB2 . 11363 1 183 . 1 1 24 24 PRO HB3 H 1 1.631 0.030 . 2 . . . . 24 PRO HB3 . 11363 1 184 . 1 1 24 24 PRO HD2 H 1 3.750 0.030 . 2 . . . . 24 PRO HD2 . 11363 1 185 . 1 1 24 24 PRO HD3 H 1 3.668 0.030 . 2 . . . . 24 PRO HD3 . 11363 1 186 . 1 1 24 24 PRO HG2 H 1 2.039 0.030 . 2 . . . . 24 PRO HG2 . 11363 1 187 . 1 1 24 24 PRO HG3 H 1 1.912 0.030 . 2 . . . . 24 PRO HG3 . 11363 1 188 . 1 1 24 24 PRO C C 13 176.549 0.300 . 1 . . . . 24 PRO C . 11363 1 189 . 1 1 24 24 PRO CA C 13 62.471 0.300 . 1 . . . . 24 PRO CA . 11363 1 190 . 1 1 24 24 PRO CB C 13 32.079 0.300 . 1 . . . . 24 PRO CB . 11363 1 191 . 1 1 24 24 PRO CD C 13 50.434 0.300 . 1 . . . . 24 PRO CD . 11363 1 192 . 1 1 24 24 PRO CG C 13 27.692 0.300 . 1 . . . . 24 PRO CG . 11363 1 193 . 1 1 25 25 ALA H H 1 8.851 0.030 . 1 . . . . 25 ALA H . 11363 1 194 . 1 1 25 25 ALA HA H 1 3.708 0.030 . 1 . . . . 25 ALA HA . 11363 1 195 . 1 1 25 25 ALA HB1 H 1 1.090 0.030 . 1 . . . . 25 ALA HB . 11363 1 196 . 1 1 25 25 ALA HB2 H 1 1.090 0.030 . 1 . . . . 25 ALA HB . 11363 1 197 . 1 1 25 25 ALA HB3 H 1 1.090 0.030 . 1 . . . . 25 ALA HB . 11363 1 198 . 1 1 25 25 ALA C C 13 176.271 0.300 . 1 . . . . 25 ALA C . 11363 1 199 . 1 1 25 25 ALA CA C 13 52.115 0.300 . 1 . . . . 25 ALA CA . 11363 1 200 . 1 1 25 25 ALA CB C 13 19.030 0.300 . 1 . . . . 25 ALA CB . 11363 1 201 . 1 1 25 25 ALA N N 15 124.466 0.300 . 1 . . . . 25 ALA N . 11363 1 202 . 1 1 26 26 ARG H H 1 7.411 0.030 . 1 . . . . 26 ARG H . 11363 1 203 . 1 1 26 26 ARG HA H 1 4.105 0.030 . 1 . . . . 26 ARG HA . 11363 1 204 . 1 1 26 26 ARG HB2 H 1 1.208 0.030 . 2 . . . . 26 ARG HB2 . 11363 1 205 . 1 1 26 26 ARG HB3 H 1 1.060 0.030 . 2 . . . . 26 ARG HB3 . 11363 1 206 . 1 1 26 26 ARG HD2 H 1 3.047 0.030 . 1 . . . . 26 ARG HD2 . 11363 1 207 . 1 1 26 26 ARG HD3 H 1 3.047 0.030 . 1 . . . . 26 ARG HD3 . 11363 1 208 . 1 1 26 26 ARG HG2 H 1 1.279 0.030 . 2 . . . . 26 ARG HG2 . 11363 1 209 . 1 1 26 26 ARG HG3 H 1 1.228 0.030 . 2 . . . . 26 ARG HG3 . 11363 1 210 . 1 1 26 26 ARG C C 13 173.717 0.300 . 1 . . . . 26 ARG C . 11363 1 211 . 1 1 26 26 ARG CA C 13 56.120 0.300 . 1 . . . . 26 ARG CA . 11363 1 212 . 1 1 26 26 ARG CB C 13 32.410 0.300 . 1 . . . . 26 ARG CB . 11363 1 213 . 1 1 26 26 ARG CD C 13 43.306 0.300 . 1 . . . . 26 ARG CD . 11363 1 214 . 1 1 26 26 ARG CG C 13 27.366 0.300 . 1 . . . . 26 ARG CG . 11363 1 215 . 1 1 26 26 ARG N N 15 119.690 0.300 . 1 . . . . 26 ARG N . 11363 1 216 . 1 1 27 27 TYR H H 1 7.718 0.030 . 1 . . . . 27 TYR H . 11363 1 217 . 1 1 27 27 TYR HA H 1 4.708 0.030 . 1 . . . . 27 TYR HA . 11363 1 218 . 1 1 27 27 TYR HB2 H 1 2.578 0.030 . 2 . . . . 27 TYR HB2 . 11363 1 219 . 1 1 27 27 TYR HB3 H 1 0.973 0.030 . 2 . . . . 27 TYR HB3 . 11363 1 220 . 1 1 27 27 TYR HD1 H 1 6.751 0.030 . 1 . . . . 27 TYR HD1 . 11363 1 221 . 1 1 27 27 TYR HD2 H 1 6.751 0.030 . 1 . . . . 27 TYR HD2 . 11363 1 222 . 1 1 27 27 TYR HE1 H 1 6.701 0.030 . 1 . . . . 27 TYR HE1 . 11363 1 223 . 1 1 27 27 TYR HE2 H 1 6.701 0.030 . 1 . . . . 27 TYR HE2 . 11363 1 224 . 1 1 27 27 TYR C C 13 174.774 0.300 . 1 . . . . 27 TYR C . 11363 1 225 . 1 1 27 27 TYR CA C 13 55.261 0.300 . 1 . . . . 27 TYR CA . 11363 1 226 . 1 1 27 27 TYR CB C 13 41.068 0.300 . 1 . . . . 27 TYR CB . 11363 1 227 . 1 1 27 27 TYR CD1 C 13 133.830 0.300 . 1 . . . . 27 TYR CD1 . 11363 1 228 . 1 1 27 27 TYR CD2 C 13 133.830 0.300 . 1 . . . . 27 TYR CD2 . 11363 1 229 . 1 1 27 27 TYR CE1 C 13 117.498 0.300 . 1 . . . . 27 TYR CE1 . 11363 1 230 . 1 1 27 27 TYR CE2 C 13 117.498 0.300 . 1 . . . . 27 TYR CE2 . 11363 1 231 . 1 1 27 27 TYR N N 15 117.815 0.300 . 1 . . . . 27 TYR N . 11363 1 232 . 1 1 28 28 THR H H 1 8.289 0.030 . 1 . . . . 28 THR H . 11363 1 233 . 1 1 28 28 THR HA H 1 4.962 0.030 . 1 . . . . 28 THR HA . 11363 1 234 . 1 1 28 28 THR HB H 1 3.712 0.030 . 1 . . . . 28 THR HB . 11363 1 235 . 1 1 28 28 THR HG21 H 1 0.942 0.030 . 1 . . . . 28 THR HG2 . 11363 1 236 . 1 1 28 28 THR HG22 H 1 0.942 0.030 . 1 . . . . 28 THR HG2 . 11363 1 237 . 1 1 28 28 THR HG23 H 1 0.942 0.030 . 1 . . . . 28 THR HG2 . 11363 1 238 . 1 1 28 28 THR C C 13 174.691 0.300 . 1 . . . . 28 THR C . 11363 1 239 . 1 1 28 28 THR CA C 13 60.154 0.300 . 1 . . . . 28 THR CA . 11363 1 240 . 1 1 28 28 THR CB C 13 71.567 0.300 . 1 . . . . 28 THR CB . 11363 1 241 . 1 1 28 28 THR CG2 C 13 22.079 0.300 . 1 . . . . 28 THR CG2 . 11363 1 242 . 1 1 28 28 THR N N 15 111.618 0.300 . 1 . . . . 28 THR N . 11363 1 243 . 1 1 29 29 CYS H H 1 9.197 0.030 . 1 . . . . 29 CYS H . 11363 1 244 . 1 1 29 29 CYS HA H 1 4.854 0.030 . 1 . . . . 29 CYS HA . 11363 1 245 . 1 1 29 29 CYS HB2 H 1 3.481 0.030 . 2 . . . . 29 CYS HB2 . 11363 1 246 . 1 1 29 29 CYS HB3 H 1 2.750 0.030 . 2 . . . . 29 CYS HB3 . 11363 1 247 . 1 1 29 29 CYS C C 13 175.621 0.300 . 1 . . . . 29 CYS C . 11363 1 248 . 1 1 29 29 CYS CA C 13 57.329 0.300 . 1 . . . . 29 CYS CA . 11363 1 249 . 1 1 29 29 CYS CB C 13 30.778 0.300 . 1 . . . . 29 CYS CB . 11363 1 250 . 1 1 29 29 CYS N N 15 129.883 0.300 . 1 . . . . 29 CYS N . 11363 1 251 . 1 1 30 30 PRO HA H 1 4.537 0.030 . 1 . . . . 30 PRO HA . 11363 1 252 . 1 1 30 30 PRO HB2 H 1 2.385 0.030 . 2 . . . . 30 PRO HB2 . 11363 1 253 . 1 1 30 30 PRO HB3 H 1 2.024 0.030 . 2 . . . . 30 PRO HB3 . 11363 1 254 . 1 1 30 30 PRO HD2 H 1 4.351 0.030 . 2 . . . . 30 PRO HD2 . 11363 1 255 . 1 1 30 30 PRO HD3 H 1 4.162 0.030 . 2 . . . . 30 PRO HD3 . 11363 1 256 . 1 1 30 30 PRO HG2 H 1 2.160 0.030 . 2 . . . . 30 PRO HG2 . 11363 1 257 . 1 1 30 30 PRO HG3 H 1 2.029 0.030 . 2 . . . . 30 PRO HG3 . 11363 1 258 . 1 1 30 30 PRO C C 13 176.918 0.300 . 1 . . . . 30 PRO C . 11363 1 259 . 1 1 30 30 PRO CA C 13 64.408 0.300 . 1 . . . . 30 PRO CA . 11363 1 260 . 1 1 30 30 PRO CB C 13 32.296 0.300 . 1 . . . . 30 PRO CB . 11363 1 261 . 1 1 30 30 PRO CD C 13 51.500 0.300 . 1 . . . . 30 PRO CD . 11363 1 262 . 1 1 30 30 PRO CG C 13 27.252 0.300 . 1 . . . . 30 PRO CG . 11363 1 263 . 1 1 31 31 ARG H H 1 8.914 0.030 . 1 . . . . 31 ARG H . 11363 1 264 . 1 1 31 31 ARG HA H 1 4.421 0.030 . 1 . . . . 31 ARG HA . 11363 1 265 . 1 1 31 31 ARG HB2 H 1 1.949 0.030 . 2 . . . . 31 ARG HB2 . 11363 1 266 . 1 1 31 31 ARG HB3 H 1 1.830 0.030 . 2 . . . . 31 ARG HB3 . 11363 1 267 . 1 1 31 31 ARG HD2 H 1 3.148 0.030 . 1 . . . . 31 ARG HD2 . 11363 1 268 . 1 1 31 31 ARG HD3 H 1 3.148 0.030 . 1 . . . . 31 ARG HD3 . 11363 1 269 . 1 1 31 31 ARG HG2 H 1 1.602 0.030 . 2 . . . . 31 ARG HG2 . 11363 1 270 . 1 1 31 31 ARG HG3 H 1 1.519 0.030 . 2 . . . . 31 ARG HG3 . 11363 1 271 . 1 1 31 31 ARG C C 13 176.820 0.300 . 1 . . . . 31 ARG C . 11363 1 272 . 1 1 31 31 ARG CA C 13 57.940 0.300 . 1 . . . . 31 ARG CA . 11363 1 273 . 1 1 31 31 ARG CB C 13 31.535 0.300 . 1 . . . . 31 ARG CB . 11363 1 274 . 1 1 31 31 ARG CD C 13 43.074 0.300 . 1 . . . . 31 ARG CD . 11363 1 275 . 1 1 31 31 ARG CG C 13 27.629 0.300 . 1 . . . . 31 ARG CG . 11363 1 276 . 1 1 31 31 ARG N N 15 120.907 0.300 . 1 . . . . 31 ARG N . 11363 1 277 . 1 1 32 32 CYS H H 1 8.059 0.030 . 1 . . . . 32 CYS H . 11363 1 278 . 1 1 32 32 CYS HA H 1 5.041 0.030 . 1 . . . . 32 CYS HA . 11363 1 279 . 1 1 32 32 CYS HB2 H 1 3.397 0.030 . 2 . . . . 32 CYS HB2 . 11363 1 280 . 1 1 32 32 CYS HB3 H 1 2.772 0.030 . 2 . . . . 32 CYS HB3 . 11363 1 281 . 1 1 32 32 CYS C C 13 176.308 0.300 . 1 . . . . 32 CYS C . 11363 1 282 . 1 1 32 32 CYS CA C 13 58.638 0.300 . 1 . . . . 32 CYS CA . 11363 1 283 . 1 1 32 32 CYS CB C 13 32.414 0.300 . 1 . . . . 32 CYS CB . 11363 1 284 . 1 1 32 32 CYS N N 15 116.818 0.300 . 1 . . . . 32 CYS N . 11363 1 285 . 1 1 33 33 ASN H H 1 8.210 0.030 . 1 . . . . 33 ASN H . 11363 1 286 . 1 1 33 33 ASN HA H 1 4.619 0.030 . 1 . . . . 33 ASN HA . 11363 1 287 . 1 1 33 33 ASN HB2 H 1 3.113 0.030 . 2 . . . . 33 ASN HB2 . 11363 1 288 . 1 1 33 33 ASN HB3 H 1 3.041 0.030 . 2 . . . . 33 ASN HB3 . 11363 1 289 . 1 1 33 33 ASN HD21 H 1 7.459 0.030 . 2 . . . . 33 ASN HD21 . 11363 1 290 . 1 1 33 33 ASN HD22 H 1 6.784 0.030 . 2 . . . . 33 ASN HD22 . 11363 1 291 . 1 1 33 33 ASN C C 13 173.787 0.300 . 1 . . . . 33 ASN C . 11363 1 292 . 1 1 33 33 ASN CA C 13 55.546 0.300 . 1 . . . . 33 ASN CA . 11363 1 293 . 1 1 33 33 ASN CB C 13 38.281 0.300 . 1 . . . . 33 ASN CB . 11363 1 294 . 1 1 33 33 ASN N N 15 118.673 0.300 . 1 . . . . 33 ASN N . 11363 1 295 . 1 1 33 33 ASN ND2 N 15 112.400 0.300 . 1 . . . . 33 ASN ND2 . 11363 1 296 . 1 1 34 34 ALA H H 1 8.769 0.030 . 1 . . . . 34 ALA H . 11363 1 297 . 1 1 34 34 ALA HA H 1 4.744 0.030 . 1 . . . . 34 ALA HA . 11363 1 298 . 1 1 34 34 ALA HB1 H 1 1.571 0.030 . 1 . . . . 34 ALA HB . 11363 1 299 . 1 1 34 34 ALA HB2 H 1 1.571 0.030 . 1 . . . . 34 ALA HB . 11363 1 300 . 1 1 34 34 ALA HB3 H 1 1.571 0.030 . 1 . . . . 34 ALA HB . 11363 1 301 . 1 1 34 34 ALA C C 13 175.943 0.300 . 1 . . . . 34 ALA C . 11363 1 302 . 1 1 34 34 ALA CA C 13 51.806 0.300 . 1 . . . . 34 ALA CA . 11363 1 303 . 1 1 34 34 ALA CB C 13 20.109 0.300 . 1 . . . . 34 ALA CB . 11363 1 304 . 1 1 34 34 ALA N N 15 125.749 0.300 . 1 . . . . 34 ALA N . 11363 1 305 . 1 1 35 35 PRO HA H 1 5.434 0.030 . 1 . . . . 35 PRO HA . 11363 1 306 . 1 1 35 35 PRO HB2 H 1 2.151 0.030 . 2 . . . . 35 PRO HB2 . 11363 1 307 . 1 1 35 35 PRO HB3 H 1 1.790 0.030 . 2 . . . . 35 PRO HB3 . 11363 1 308 . 1 1 35 35 PRO HD2 H 1 4.231 0.030 . 2 . . . . 35 PRO HD2 . 11363 1 309 . 1 1 35 35 PRO HD3 H 1 3.725 0.030 . 2 . . . . 35 PRO HD3 . 11363 1 310 . 1 1 35 35 PRO HG2 H 1 2.192 0.030 . 2 . . . . 35 PRO HG2 . 11363 1 311 . 1 1 35 35 PRO HG3 H 1 2.002 0.030 . 2 . . . . 35 PRO HG3 . 11363 1 312 . 1 1 35 35 PRO C C 13 177.022 0.300 . 1 . . . . 35 PRO C . 11363 1 313 . 1 1 35 35 PRO CA C 13 61.309 0.300 . 1 . . . . 35 PRO CA . 11363 1 314 . 1 1 35 35 PRO CB C 13 32.732 0.300 . 1 . . . . 35 PRO CB . 11363 1 315 . 1 1 35 35 PRO CD C 13 51.241 0.300 . 1 . . . . 35 PRO CD . 11363 1 316 . 1 1 35 35 PRO CG C 13 27.812 0.300 . 1 . . . . 35 PRO CG . 11363 1 317 . 1 1 36 36 TYR H H 1 8.721 0.030 . 1 . . . . 36 TYR H . 11363 1 318 . 1 1 36 36 TYR HA H 1 6.460 0.030 . 1 . . . . 36 TYR HA . 11363 1 319 . 1 1 36 36 TYR HB2 H 1 3.079 0.030 . 2 . . . . 36 TYR HB2 . 11363 1 320 . 1 1 36 36 TYR HB3 H 1 2.930 0.030 . 2 . . . . 36 TYR HB3 . 11363 1 321 . 1 1 36 36 TYR HD1 H 1 7.159 0.030 . 1 . . . . 36 TYR HD1 . 11363 1 322 . 1 1 36 36 TYR HD2 H 1 7.159 0.030 . 1 . . . . 36 TYR HD2 . 11363 1 323 . 1 1 36 36 TYR HE1 H 1 6.106 0.030 . 1 . . . . 36 TYR HE1 . 11363 1 324 . 1 1 36 36 TYR HE2 H 1 6.106 0.030 . 1 . . . . 36 TYR HE2 . 11363 1 325 . 1 1 36 36 TYR C C 13 176.360 0.300 . 1 . . . . 36 TYR C . 11363 1 326 . 1 1 36 36 TYR CA C 13 56.659 0.300 . 1 . . . . 36 TYR CA . 11363 1 327 . 1 1 36 36 TYR CB C 13 41.375 0.300 . 1 . . . . 36 TYR CB . 11363 1 328 . 1 1 36 36 TYR CD1 C 13 134.016 0.300 . 1 . . . . 36 TYR CD1 . 11363 1 329 . 1 1 36 36 TYR CD2 C 13 134.016 0.300 . 1 . . . . 36 TYR CD2 . 11363 1 330 . 1 1 36 36 TYR CE1 C 13 118.063 0.300 . 1 . . . . 36 TYR CE1 . 11363 1 331 . 1 1 36 36 TYR CE2 C 13 118.063 0.300 . 1 . . . . 36 TYR CE2 . 11363 1 332 . 1 1 36 36 TYR N N 15 116.978 0.300 . 1 . . . . 36 TYR N . 11363 1 333 . 1 1 37 37 CYS H H 1 9.188 0.030 . 1 . . . . 37 CYS H . 11363 1 334 . 1 1 37 37 CYS HA H 1 4.869 0.030 . 1 . . . . 37 CYS HA . 11363 1 335 . 1 1 37 37 CYS HB2 H 1 3.080 0.030 . 2 . . . . 37 CYS HB2 . 11363 1 336 . 1 1 37 37 CYS HB3 H 1 2.720 0.030 . 2 . . . . 37 CYS HB3 . 11363 1 337 . 1 1 37 37 CYS C C 13 176.114 0.300 . 1 . . . . 37 CYS C . 11363 1 338 . 1 1 37 37 CYS CA C 13 60.031 0.300 . 1 . . . . 37 CYS CA . 11363 1 339 . 1 1 37 37 CYS CB C 13 34.424 0.300 . 1 . . . . 37 CYS CB . 11363 1 340 . 1 1 37 37 CYS N N 15 119.128 0.300 . 1 . . . . 37 CYS N . 11363 1 341 . 1 1 38 38 SER H H 1 7.553 0.030 . 1 . . . . 38 SER H . 11363 1 342 . 1 1 38 38 SER HA H 1 5.028 0.030 . 1 . . . . 38 SER HA . 11363 1 343 . 1 1 38 38 SER HB2 H 1 4.351 0.030 . 2 . . . . 38 SER HB2 . 11363 1 344 . 1 1 38 38 SER HB3 H 1 4.219 0.030 . 2 . . . . 38 SER HB3 . 11363 1 345 . 1 1 38 38 SER C C 13 173.960 0.300 . 1 . . . . 38 SER C . 11363 1 346 . 1 1 38 38 SER CA C 13 57.856 0.300 . 1 . . . . 38 SER CA . 11363 1 347 . 1 1 38 38 SER CB C 13 65.263 0.300 . 1 . . . . 38 SER CB . 11363 1 348 . 1 1 38 38 SER N N 15 115.493 0.300 . 1 . . . . 38 SER N . 11363 1 349 . 1 1 39 39 LEU HA H 1 4.121 0.030 . 1 . . . . 39 LEU HA . 11363 1 350 . 1 1 39 39 LEU HB2 H 1 1.679 0.030 . 1 . . . . 39 LEU HB2 . 11363 1 351 . 1 1 39 39 LEU HB3 H 1 1.679 0.030 . 1 . . . . 39 LEU HB3 . 11363 1 352 . 1 1 39 39 LEU HD11 H 1 0.840 0.030 . 1 . . . . 39 LEU HD1 . 11363 1 353 . 1 1 39 39 LEU HD12 H 1 0.840 0.030 . 1 . . . . 39 LEU HD1 . 11363 1 354 . 1 1 39 39 LEU HD13 H 1 0.840 0.030 . 1 . . . . 39 LEU HD1 . 11363 1 355 . 1 1 39 39 LEU HD21 H 1 0.810 0.030 . 1 . . . . 39 LEU HD2 . 11363 1 356 . 1 1 39 39 LEU HD22 H 1 0.810 0.030 . 1 . . . . 39 LEU HD2 . 11363 1 357 . 1 1 39 39 LEU HD23 H 1 0.810 0.030 . 1 . . . . 39 LEU HD2 . 11363 1 358 . 1 1 39 39 LEU HG H 1 1.598 0.030 . 1 . . . . 39 LEU HG . 11363 1 359 . 1 1 39 39 LEU C C 13 178.253 0.300 . 1 . . . . 39 LEU C . 11363 1 360 . 1 1 39 39 LEU CA C 13 58.006 0.300 . 1 . . . . 39 LEU CA . 11363 1 361 . 1 1 39 39 LEU CB C 13 41.213 0.300 . 1 . . . . 39 LEU CB . 11363 1 362 . 1 1 39 39 LEU CD1 C 13 23.754 0.300 . 2 . . . . 39 LEU CD1 . 11363 1 363 . 1 1 39 39 LEU CD2 C 13 24.214 0.300 . 2 . . . . 39 LEU CD2 . 11363 1 364 . 1 1 39 39 LEU CG C 13 27.110 0.300 . 1 . . . . 39 LEU CG . 11363 1 365 . 1 1 40 40 ARG H H 1 8.315 0.030 . 1 . . . . 40 ARG H . 11363 1 366 . 1 1 40 40 ARG HA H 1 4.001 0.030 . 1 . . . . 40 ARG HA . 11363 1 367 . 1 1 40 40 ARG HB2 H 1 1.970 0.030 . 1 . . . . 40 ARG HB2 . 11363 1 368 . 1 1 40 40 ARG HB3 H 1 1.970 0.030 . 1 . . . . 40 ARG HB3 . 11363 1 369 . 1 1 40 40 ARG HD2 H 1 3.237 0.030 . 2 . . . . 40 ARG HD2 . 11363 1 370 . 1 1 40 40 ARG HD3 H 1 3.207 0.030 . 2 . . . . 40 ARG HD3 . 11363 1 371 . 1 1 40 40 ARG HG2 H 1 1.839 0.030 . 2 . . . . 40 ARG HG2 . 11363 1 372 . 1 1 40 40 ARG HG3 H 1 1.592 0.030 . 2 . . . . 40 ARG HG3 . 11363 1 373 . 1 1 40 40 ARG C C 13 179.108 0.300 . 1 . . . . 40 ARG C . 11363 1 374 . 1 1 40 40 ARG CA C 13 59.951 0.300 . 1 . . . . 40 ARG CA . 11363 1 375 . 1 1 40 40 ARG CB C 13 29.300 0.300 . 1 . . . . 40 ARG CB . 11363 1 376 . 1 1 40 40 ARG CD C 13 43.312 0.300 . 1 . . . . 40 ARG CD . 11363 1 377 . 1 1 40 40 ARG CG C 13 26.380 0.300 . 1 . . . . 40 ARG CG . 11363 1 378 . 1 1 40 40 ARG N N 15 118.997 0.300 . 1 . . . . 40 ARG N . 11363 1 379 . 1 1 41 41 CYS H H 1 7.489 0.030 . 1 . . . . 41 CYS H . 11363 1 380 . 1 1 41 41 CYS HA H 1 4.284 0.030 . 1 . . . . 41 CYS HA . 11363 1 381 . 1 1 41 41 CYS HB2 H 1 3.171 0.030 . 1 . . . . 41 CYS HB2 . 11363 1 382 . 1 1 41 41 CYS HB3 H 1 3.171 0.030 . 1 . . . . 41 CYS HB3 . 11363 1 383 . 1 1 41 41 CYS C C 13 177.488 0.300 . 1 . . . . 41 CYS C . 11363 1 384 . 1 1 41 41 CYS CA C 13 64.476 0.300 . 1 . . . . 41 CYS CA . 11363 1 385 . 1 1 41 41 CYS CB C 13 32.024 0.300 . 1 . . . . 41 CYS CB . 11363 1 386 . 1 1 41 41 CYS N N 15 119.762 0.300 . 1 . . . . 41 CYS N . 11363 1 387 . 1 1 42 42 TYR H H 1 8.520 0.030 . 1 . . . . 42 TYR H . 11363 1 388 . 1 1 42 42 TYR HA H 1 3.210 0.030 . 1 . . . . 42 TYR HA . 11363 1 389 . 1 1 42 42 TYR HB2 H 1 2.899 0.030 . 2 . . . . 42 TYR HB2 . 11363 1 390 . 1 1 42 42 TYR HB3 H 1 2.509 0.030 . 2 . . . . 42 TYR HB3 . 11363 1 391 . 1 1 42 42 TYR HD1 H 1 6.188 0.030 . 1 . . . . 42 TYR HD1 . 11363 1 392 . 1 1 42 42 TYR HD2 H 1 6.188 0.030 . 1 . . . . 42 TYR HD2 . 11363 1 393 . 1 1 42 42 TYR HE1 H 1 6.745 0.030 . 1 . . . . 42 TYR HE1 . 11363 1 394 . 1 1 42 42 TYR HE2 H 1 6.745 0.030 . 1 . . . . 42 TYR HE2 . 11363 1 395 . 1 1 42 42 TYR C C 13 179.175 0.300 . 1 . . . . 42 TYR C . 11363 1 396 . 1 1 42 42 TYR CA C 13 61.115 0.300 . 1 . . . . 42 TYR CA . 11363 1 397 . 1 1 42 42 TYR CB C 13 37.987 0.300 . 1 . . . . 42 TYR CB . 11363 1 398 . 1 1 42 42 TYR CD1 C 13 132.501 0.300 . 1 . . . . 42 TYR CD1 . 11363 1 399 . 1 1 42 42 TYR CD2 C 13 132.501 0.300 . 1 . . . . 42 TYR CD2 . 11363 1 400 . 1 1 42 42 TYR CE1 C 13 118.149 0.300 . 1 . . . . 42 TYR CE1 . 11363 1 401 . 1 1 42 42 TYR CE2 C 13 118.149 0.300 . 1 . . . . 42 TYR CE2 . 11363 1 402 . 1 1 42 42 TYR N N 15 121.863 0.300 . 1 . . . . 42 TYR N . 11363 1 403 . 1 1 43 43 ARG H H 1 8.172 0.030 . 1 . . . . 43 ARG H . 11363 1 404 . 1 1 43 43 ARG HA H 1 3.818 0.030 . 1 . . . . 43 ARG HA . 11363 1 405 . 1 1 43 43 ARG HB2 H 1 1.950 0.030 . 2 . . . . 43 ARG HB2 . 11363 1 406 . 1 1 43 43 ARG HB3 H 1 1.891 0.030 . 2 . . . . 43 ARG HB3 . 11363 1 407 . 1 1 43 43 ARG HD2 H 1 3.140 0.030 . 1 . . . . 43 ARG HD2 . 11363 1 408 . 1 1 43 43 ARG HD3 H 1 3.140 0.030 . 1 . . . . 43 ARG HD3 . 11363 1 409 . 1 1 43 43 ARG HG2 H 1 1.848 0.030 . 2 . . . . 43 ARG HG2 . 11363 1 410 . 1 1 43 43 ARG HG3 H 1 1.630 0.030 . 2 . . . . 43 ARG HG3 . 11363 1 411 . 1 1 43 43 ARG C C 13 177.844 0.300 . 1 . . . . 43 ARG C . 11363 1 412 . 1 1 43 43 ARG CA C 13 59.101 0.300 . 1 . . . . 43 ARG CA . 11363 1 413 . 1 1 43 43 ARG CB C 13 29.902 0.300 . 1 . . . . 43 ARG CB . 11363 1 414 . 1 1 43 43 ARG CD C 13 43.475 0.300 . 1 . . . . 43 ARG CD . 11363 1 415 . 1 1 43 43 ARG CG C 13 28.055 0.300 . 1 . . . . 43 ARG CG . 11363 1 416 . 1 1 43 43 ARG N N 15 117.788 0.300 . 1 . . . . 43 ARG N . 11363 1 417 . 1 1 44 44 THR H H 1 7.472 0.030 . 1 . . . . 44 THR H . 11363 1 418 . 1 1 44 44 THR HA H 1 4.162 0.030 . 1 . . . . 44 THR HA . 11363 1 419 . 1 1 44 44 THR HB H 1 4.386 0.030 . 1 . . . . 44 THR HB . 11363 1 420 . 1 1 44 44 THR HG21 H 1 1.304 0.030 . 1 . . . . 44 THR HG2 . 11363 1 421 . 1 1 44 44 THR HG22 H 1 1.304 0.030 . 1 . . . . 44 THR HG2 . 11363 1 422 . 1 1 44 44 THR HG23 H 1 1.304 0.030 . 1 . . . . 44 THR HG2 . 11363 1 423 . 1 1 44 44 THR C C 13 175.991 0.300 . 1 . . . . 44 THR C . 11363 1 424 . 1 1 44 44 THR CA C 13 63.188 0.300 . 1 . . . . 44 THR CA . 11363 1 425 . 1 1 44 44 THR CB C 13 69.100 0.300 . 1 . . . . 44 THR CB . 11363 1 426 . 1 1 44 44 THR CG2 C 13 21.928 0.300 . 1 . . . . 44 THR CG2 . 11363 1 427 . 1 1 44 44 THR N N 15 110.736 0.300 . 1 . . . . 44 THR N . 11363 1 428 . 1 1 45 45 HIS H H 1 7.380 0.030 . 1 . . . . 45 HIS H . 11363 1 429 . 1 1 45 45 HIS HA H 1 3.833 0.030 . 1 . . . . 45 HIS HA . 11363 1 430 . 1 1 45 45 HIS HB2 H 1 2.253 0.030 . 2 . . . . 45 HIS HB2 . 11363 1 431 . 1 1 45 45 HIS HB3 H 1 1.610 0.030 . 2 . . . . 45 HIS HB3 . 11363 1 432 . 1 1 45 45 HIS HD2 H 1 6.523 0.030 . 1 . . . . 45 HIS HD2 . 11363 1 433 . 1 1 45 45 HIS HE1 H 1 7.373 0.030 . 1 . . . . 45 HIS HE1 . 11363 1 434 . 1 1 45 45 HIS C C 13 174.228 0.300 . 1 . . . . 45 HIS C . 11363 1 435 . 1 1 45 45 HIS CA C 13 57.330 0.300 . 1 . . . . 45 HIS CA . 11363 1 436 . 1 1 45 45 HIS CB C 13 25.786 0.300 . 1 . . . . 45 HIS CB . 11363 1 437 . 1 1 45 45 HIS CD2 C 13 127.363 0.300 . 1 . . . . 45 HIS CD2 . 11363 1 438 . 1 1 45 45 HIS CE1 C 13 139.325 0.300 . 1 . . . . 45 HIS CE1 . 11363 1 439 . 1 1 45 45 HIS N N 15 121.036 0.300 . 1 . . . . 45 HIS N . 11363 1 440 . 1 1 46 46 GLY H H 1 7.066 0.030 . 1 . . . . 46 GLY H . 11363 1 441 . 1 1 46 46 GLY HA2 H 1 3.770 0.030 . 2 . . . . 46 GLY HA2 . 11363 1 442 . 1 1 46 46 GLY HA3 H 1 3.661 0.030 . 2 . . . . 46 GLY HA3 . 11363 1 443 . 1 1 46 46 GLY C C 13 173.700 0.300 . 1 . . . . 46 GLY C . 11363 1 444 . 1 1 46 46 GLY CA C 13 45.126 0.300 . 1 . . . . 46 GLY CA . 11363 1 445 . 1 1 46 46 GLY N N 15 106.272 0.300 . 1 . . . . 46 GLY N . 11363 1 446 . 1 1 47 47 THR H H 1 8.206 0.030 . 1 . . . . 47 THR H . 11363 1 447 . 1 1 47 47 THR HA H 1 4.061 0.030 . 1 . . . . 47 THR HA . 11363 1 448 . 1 1 47 47 THR HB H 1 4.218 0.030 . 1 . . . . 47 THR HB . 11363 1 449 . 1 1 47 47 THR HG21 H 1 1.139 0.030 . 1 . . . . 47 THR HG2 . 11363 1 450 . 1 1 47 47 THR HG22 H 1 1.139 0.030 . 1 . . . . 47 THR HG2 . 11363 1 451 . 1 1 47 47 THR HG23 H 1 1.139 0.030 . 1 . . . . 47 THR HG2 . 11363 1 452 . 1 1 47 47 THR C C 13 174.491 0.300 . 1 . . . . 47 THR C . 11363 1 453 . 1 1 47 47 THR CA C 13 62.341 0.300 . 1 . . . . 47 THR CA . 11363 1 454 . 1 1 47 47 THR CB C 13 68.698 0.300 . 1 . . . . 47 THR CB . 11363 1 455 . 1 1 47 47 THR CG2 C 13 21.667 0.300 . 1 . . . . 47 THR CG2 . 11363 1 456 . 1 1 47 47 THR N N 15 114.181 0.300 . 1 . . . . 47 THR N . 11363 1 457 . 1 1 48 48 CYS H H 1 7.500 0.030 . 1 . . . . 48 CYS H . 11363 1 458 . 1 1 48 48 CYS HA H 1 4.044 0.030 . 1 . . . . 48 CYS HA . 11363 1 459 . 1 1 48 48 CYS HB2 H 1 2.580 0.030 . 1 . . . . 48 CYS HB2 . 11363 1 460 . 1 1 48 48 CYS HB3 H 1 2.580 0.030 . 1 . . . . 48 CYS HB3 . 11363 1 461 . 1 1 48 48 CYS C C 13 175.422 0.300 . 1 . . . . 48 CYS C . 11363 1 462 . 1 1 48 48 CYS CA C 13 59.649 0.300 . 1 . . . . 48 CYS CA . 11363 1 463 . 1 1 48 48 CYS CB C 13 30.659 0.300 . 1 . . . . 48 CYS CB . 11363 1 464 . 1 1 48 48 CYS N N 15 123.451 0.300 . 1 . . . . 48 CYS N . 11363 1 465 . 1 1 49 49 ALA H H 1 7.936 0.030 . 1 . . . . 49 ALA H . 11363 1 466 . 1 1 49 49 ALA HA H 1 4.200 0.030 . 1 . . . . 49 ALA HA . 11363 1 467 . 1 1 49 49 ALA HB1 H 1 1.227 0.030 . 1 . . . . 49 ALA HB . 11363 1 468 . 1 1 49 49 ALA HB2 H 1 1.227 0.030 . 1 . . . . 49 ALA HB . 11363 1 469 . 1 1 49 49 ALA HB3 H 1 1.227 0.030 . 1 . . . . 49 ALA HB . 11363 1 470 . 1 1 49 49 ALA C C 13 177.739 0.300 . 1 . . . . 49 ALA C . 11363 1 471 . 1 1 49 49 ALA CA C 13 52.600 0.300 . 1 . . . . 49 ALA CA . 11363 1 472 . 1 1 49 49 ALA CB C 13 19.592 0.300 . 1 . . . . 49 ALA CB . 11363 1 473 . 1 1 49 49 ALA N N 15 121.875 0.300 . 1 . . . . 49 ALA N . 11363 1 474 . 1 1 50 50 GLU H H 1 8.182 0.030 . 1 . . . . 50 GLU H . 11363 1 475 . 1 1 50 50 GLU HA H 1 4.110 0.030 . 1 . . . . 50 GLU HA . 11363 1 476 . 1 1 50 50 GLU HB2 H 1 1.946 0.030 . 2 . . . . 50 GLU HB2 . 11363 1 477 . 1 1 50 50 GLU HB3 H 1 1.891 0.030 . 2 . . . . 50 GLU HB3 . 11363 1 478 . 1 1 50 50 GLU HG2 H 1 2.210 0.030 . 1 . . . . 50 GLU HG2 . 11363 1 479 . 1 1 50 50 GLU HG3 H 1 2.210 0.030 . 1 . . . . 50 GLU HG3 . 11363 1 480 . 1 1 50 50 GLU C C 13 176.479 0.300 . 1 . . . . 50 GLU C . 11363 1 481 . 1 1 50 50 GLU CA C 13 57.323 0.300 . 1 . . . . 50 GLU CA . 11363 1 482 . 1 1 50 50 GLU CB C 13 29.933 0.300 . 1 . . . . 50 GLU CB . 11363 1 483 . 1 1 50 50 GLU CG C 13 36.352 0.300 . 1 . . . . 50 GLU CG . 11363 1 484 . 1 1 50 50 GLU N N 15 119.164 0.300 . 1 . . . . 50 GLU N . 11363 1 485 . 1 1 51 51 ASN H H 1 8.222 0.030 . 1 . . . . 51 ASN H . 11363 1 486 . 1 1 51 51 ASN HA H 1 4.603 0.030 . 1 . . . . 51 ASN HA . 11363 1 487 . 1 1 51 51 ASN HB2 H 1 2.680 0.030 . 2 . . . . 51 ASN HB2 . 11363 1 488 . 1 1 51 51 ASN HB3 H 1 2.643 0.030 . 2 . . . . 51 ASN HB3 . 11363 1 489 . 1 1 51 51 ASN HD21 H 1 7.449 0.030 . 2 . . . . 51 ASN HD21 . 11363 1 490 . 1 1 51 51 ASN HD22 H 1 6.771 0.030 . 2 . . . . 51 ASN HD22 . 11363 1 491 . 1 1 51 51 ASN C C 13 174.783 0.300 . 1 . . . . 51 ASN C . 11363 1 492 . 1 1 51 51 ASN CA C 13 53.531 0.300 . 1 . . . . 51 ASN CA . 11363 1 493 . 1 1 51 51 ASN CB C 13 38.777 0.300 . 1 . . . . 51 ASN CB . 11363 1 494 . 1 1 51 51 ASN N N 15 117.850 0.300 . 1 . . . . 51 ASN N . 11363 1 495 . 1 1 51 51 ASN ND2 N 15 112.472 0.300 . 1 . . . . 51 ASN ND2 . 11363 1 496 . 1 1 52 52 PHE H H 1 8.000 0.030 . 1 . . . . 52 PHE H . 11363 1 497 . 1 1 52 52 PHE HA H 1 4.521 0.030 . 1 . . . . 52 PHE HA . 11363 1 498 . 1 1 52 52 PHE HB2 H 1 3.038 0.030 . 1 . . . . 52 PHE HB2 . 11363 1 499 . 1 1 52 52 PHE HB3 H 1 3.038 0.030 . 1 . . . . 52 PHE HB3 . 11363 1 500 . 1 1 52 52 PHE HD1 H 1 7.142 0.030 . 1 . . . . 52 PHE HD1 . 11363 1 501 . 1 1 52 52 PHE HD2 H 1 7.142 0.030 . 1 . . . . 52 PHE HD2 . 11363 1 502 . 1 1 52 52 PHE HE1 H 1 7.297 0.030 . 1 . . . . 52 PHE HE1 . 11363 1 503 . 1 1 52 52 PHE HE2 H 1 7.297 0.030 . 1 . . . . 52 PHE HE2 . 11363 1 504 . 1 1 52 52 PHE C C 13 175.276 0.300 . 1 . . . . 52 PHE C . 11363 1 505 . 1 1 52 52 PHE CA C 13 58.262 0.300 . 1 . . . . 52 PHE CA . 11363 1 506 . 1 1 52 52 PHE CB C 13 39.483 0.300 . 1 . . . . 52 PHE CB . 11363 1 507 . 1 1 52 52 PHE CD1 C 13 131.786 0.300 . 1 . . . . 52 PHE CD1 . 11363 1 508 . 1 1 52 52 PHE CD2 C 13 131.786 0.300 . 1 . . . . 52 PHE CD2 . 11363 1 509 . 1 1 52 52 PHE CE1 C 13 131.643 0.300 . 1 . . . . 52 PHE CE1 . 11363 1 510 . 1 1 52 52 PHE CE2 C 13 131.643 0.300 . 1 . . . . 52 PHE CE2 . 11363 1 511 . 1 1 52 52 PHE N N 15 120.004 0.300 . 1 . . . . 52 PHE N . 11363 1 512 . 1 1 53 53 TYR H H 1 8.040 0.030 . 1 . . . . 53 TYR H . 11363 1 513 . 1 1 53 53 TYR HA H 1 4.440 0.030 . 1 . . . . 53 TYR HA . 11363 1 514 . 1 1 53 53 TYR HB2 H 1 2.924 0.030 . 2 . . . . 53 TYR HB2 . 11363 1 515 . 1 1 53 53 TYR HB3 H 1 2.829 0.030 . 2 . . . . 53 TYR HB3 . 11363 1 516 . 1 1 53 53 TYR HD1 H 1 7.065 0.030 . 1 . . . . 53 TYR HD1 . 11363 1 517 . 1 1 53 53 TYR HD2 H 1 7.065 0.030 . 1 . . . . 53 TYR HD2 . 11363 1 518 . 1 1 53 53 TYR HE1 H 1 6.753 0.030 . 1 . . . . 53 TYR HE1 . 11363 1 519 . 1 1 53 53 TYR HE2 H 1 6.753 0.030 . 1 . . . . 53 TYR HE2 . 11363 1 520 . 1 1 53 53 TYR C C 13 175.361 0.300 . 1 . . . . 53 TYR C . 11363 1 521 . 1 1 53 53 TYR CA C 13 58.161 0.300 . 1 . . . . 53 TYR CA . 11363 1 522 . 1 1 53 53 TYR CB C 13 38.802 0.300 . 1 . . . . 53 TYR CB . 11363 1 523 . 1 1 53 53 TYR CD1 C 13 133.390 0.300 . 1 . . . . 53 TYR CD1 . 11363 1 524 . 1 1 53 53 TYR CD2 C 13 133.390 0.300 . 1 . . . . 53 TYR CD2 . 11363 1 525 . 1 1 53 53 TYR CE1 C 13 118.231 0.300 . 1 . . . . 53 TYR CE1 . 11363 1 526 . 1 1 53 53 TYR CE2 C 13 118.231 0.300 . 1 . . . . 53 TYR CE2 . 11363 1 527 . 1 1 53 53 TYR N N 15 122.137 0.300 . 1 . . . . 53 TYR N . 11363 1 528 . 1 1 54 54 SER H H 1 7.988 0.030 . 1 . . . . 54 SER H . 11363 1 529 . 1 1 54 54 SER HA H 1 4.382 0.030 . 1 . . . . 54 SER HA . 11363 1 530 . 1 1 54 54 SER HB2 H 1 3.812 0.030 . 2 . . . . 54 SER HB2 . 11363 1 531 . 1 1 54 54 SER HB3 H 1 3.763 0.030 . 2 . . . . 54 SER HB3 . 11363 1 532 . 1 1 54 54 SER C C 13 173.977 0.300 . 1 . . . . 54 SER C . 11363 1 533 . 1 1 54 54 SER CA C 13 57.908 0.300 . 1 . . . . 54 SER CA . 11363 1 534 . 1 1 54 54 SER CB C 13 63.994 0.300 . 1 . . . . 54 SER CB . 11363 1 535 . 1 1 54 54 SER N N 15 119.073 0.300 . 1 . . . . 54 SER N . 11363 1 536 . 1 1 55 55 GLY H H 1 7.106 0.030 . 1 . . . . 55 GLY H . 11363 1 537 . 1 1 55 55 GLY HA2 H 1 3.914 0.030 . 1 . . . . 55 GLY HA2 . 11363 1 538 . 1 1 55 55 GLY HA3 H 1 3.914 0.030 . 1 . . . . 55 GLY HA3 . 11363 1 539 . 1 1 55 55 GLY C C 13 178.268 0.300 . 1 . . . . 55 GLY C . 11363 1 540 . 1 1 55 55 GLY CA C 13 44.572 0.300 . 1 . . . . 55 GLY CA . 11363 1 541 . 1 1 55 55 GLY N N 15 109.624 0.300 . 1 . . . . 55 GLY N . 11363 1 542 . 1 1 56 56 PRO HA H 1 4.471 0.030 . 1 . . . . 56 PRO HA . 11363 1 543 . 1 1 56 56 PRO HB2 H 1 2.280 0.030 . 2 . . . . 56 PRO HB2 . 11363 1 544 . 1 1 56 56 PRO HB3 H 1 1.964 0.030 . 2 . . . . 56 PRO HB3 . 11363 1 545 . 1 1 56 56 PRO HD2 H 1 3.599 0.030 . 1 . . . . 56 PRO HD2 . 11363 1 546 . 1 1 56 56 PRO HD3 H 1 3.599 0.030 . 1 . . . . 56 PRO HD3 . 11363 1 547 . 1 1 56 56 PRO HG2 H 1 2.017 0.030 . 1 . . . . 56 PRO HG2 . 11363 1 548 . 1 1 56 56 PRO HG3 H 1 2.017 0.030 . 1 . . . . 56 PRO HG3 . 11363 1 549 . 1 1 56 56 PRO C C 13 177.496 0.300 . 1 . . . . 56 PRO C . 11363 1 550 . 1 1 56 56 PRO CA C 13 63.258 0.300 . 1 . . . . 56 PRO CA . 11363 1 551 . 1 1 56 56 PRO CB C 13 32.215 0.300 . 1 . . . . 56 PRO CB . 11363 1 552 . 1 1 56 56 PRO CD C 13 49.693 0.300 . 1 . . . . 56 PRO CD . 11363 1 553 . 1 1 56 56 PRO CG C 13 27.148 0.300 . 1 . . . . 56 PRO CG . 11363 1 554 . 1 1 57 57 SER H H 1 8.533 0.030 . 1 . . . . 57 SER H . 11363 1 555 . 1 1 57 57 SER HA H 1 4.561 0.030 . 1 . . . . 57 SER HA . 11363 1 556 . 1 1 57 57 SER HB2 H 1 3.921 0.030 . 1 . . . . 57 SER HB2 . 11363 1 557 . 1 1 57 57 SER HB3 H 1 3.921 0.030 . 1 . . . . 57 SER HB3 . 11363 1 558 . 1 1 57 57 SER C C 13 174.605 0.300 . 1 . . . . 57 SER C . 11363 1 559 . 1 1 57 57 SER CA C 13 58.361 0.300 . 1 . . . . 57 SER CA . 11363 1 560 . 1 1 57 57 SER CB C 13 63.919 0.300 . 1 . . . . 57 SER CB . 11363 1 561 . 1 1 57 57 SER N N 15 116.652 0.300 . 1 . . . . 57 SER N . 11363 1 stop_ save_