################################### # 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 11394 _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 11394 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11394 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 . . 11394 1 2 $NMRPipe . . 11394 1 3 $NMRView . . 11394 1 4 $Kujira . . 11394 1 5 $CYANA . . 11394 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 C C 13 174.454 0.300 . 1 . . . . 7 GLY C . 11394 1 2 . 1 1 7 7 GLY CA C 13 45.527 0.300 . 1 . . . . 7 GLY CA . 11394 1 3 . 1 1 8 8 THR H H 1 8.124 0.030 . 1 . . . . 8 THR H . 11394 1 4 . 1 1 8 8 THR HA H 1 4.350 0.030 . 1 . . . . 8 THR HA . 11394 1 5 . 1 1 8 8 THR HB H 1 4.282 0.030 . 1 . . . . 8 THR HB . 11394 1 6 . 1 1 8 8 THR HG21 H 1 1.189 0.030 . 1 . . . . 8 THR HG2 . 11394 1 7 . 1 1 8 8 THR HG22 H 1 1.189 0.030 . 1 . . . . 8 THR HG2 . 11394 1 8 . 1 1 8 8 THR HG23 H 1 1.189 0.030 . 1 . . . . 8 THR HG2 . 11394 1 9 . 1 1 8 8 THR C C 13 175.197 0.300 . 1 . . . . 8 THR C . 11394 1 10 . 1 1 8 8 THR CA C 13 61.952 0.300 . 1 . . . . 8 THR CA . 11394 1 11 . 1 1 8 8 THR CB C 13 69.874 0.300 . 1 . . . . 8 THR CB . 11394 1 12 . 1 1 8 8 THR CG2 C 13 21.490 0.300 . 1 . . . . 8 THR CG2 . 11394 1 13 . 1 1 8 8 THR N N 15 112.725 0.300 . 1 . . . . 8 THR N . 11394 1 14 . 1 1 9 9 GLY H H 1 8.425 0.030 . 1 . . . . 9 GLY H . 11394 1 15 . 1 1 9 9 GLY HA2 H 1 3.925 0.030 . 2 . . . . 9 GLY HA2 . 11394 1 16 . 1 1 9 9 GLY C C 13 174.082 0.300 . 1 . . . . 9 GLY C . 11394 1 17 . 1 1 9 9 GLY CA C 13 45.379 0.300 . 1 . . . . 9 GLY CA . 11394 1 18 . 1 1 9 9 GLY N N 15 110.868 0.300 . 1 . . . . 9 GLY N . 11394 1 19 . 1 1 10 10 GLU H H 1 8.201 0.030 . 1 . . . . 10 GLU H . 11394 1 20 . 1 1 10 10 GLU HA H 1 4.162 0.030 . 1 . . . . 10 GLU HA . 11394 1 21 . 1 1 10 10 GLU HB2 H 1 1.975 0.030 . 2 . . . . 10 GLU HB2 . 11394 1 22 . 1 1 10 10 GLU HB3 H 1 1.876 0.030 . 2 . . . . 10 GLU HB3 . 11394 1 23 . 1 1 10 10 GLU HG2 H 1 2.227 0.030 . 2 . . . . 10 GLU HG2 . 11394 1 24 . 1 1 10 10 GLU HG3 H 1 2.197 0.030 . 2 . . . . 10 GLU HG3 . 11394 1 25 . 1 1 10 10 GLU C C 13 176.483 0.300 . 1 . . . . 10 GLU C . 11394 1 26 . 1 1 10 10 GLU CA C 13 56.941 0.300 . 1 . . . . 10 GLU CA . 11394 1 27 . 1 1 10 10 GLU CB C 13 30.330 0.300 . 1 . . . . 10 GLU CB . 11394 1 28 . 1 1 10 10 GLU CG C 13 36.212 0.300 . 1 . . . . 10 GLU CG . 11394 1 29 . 1 1 10 10 GLU N N 15 120.195 0.300 . 1 . . . . 10 GLU N . 11394 1 30 . 1 1 11 11 LYS H H 1 8.290 0.030 . 1 . . . . 11 LYS H . 11394 1 31 . 1 1 11 11 LYS HA H 1 4.459 0.030 . 1 . . . . 11 LYS HA . 11394 1 32 . 1 1 11 11 LYS HB2 H 1 1.547 0.030 . 2 . . . . 11 LYS HB2 . 11394 1 33 . 1 1 11 11 LYS HB3 H 1 1.403 0.030 . 2 . . . . 11 LYS HB3 . 11394 1 34 . 1 1 11 11 LYS HG2 H 1 1.172 0.030 . 2 . . . . 11 LYS HG2 . 11394 1 35 . 1 1 11 11 LYS HG3 H 1 1.283 0.030 . 2 . . . . 11 LYS HG3 . 11394 1 36 . 1 1 11 11 LYS C C 13 173.720 0.300 . 1 . . . . 11 LYS C . 11394 1 37 . 1 1 11 11 LYS CA C 13 53.766 0.300 . 1 . . . . 11 LYS CA . 11394 1 38 . 1 1 11 11 LYS CB C 13 33.055 0.300 . 1 . . . . 11 LYS CB . 11394 1 39 . 1 1 11 11 LYS CD C 13 29.158 0.300 . 1 . . . . 11 LYS CD . 11394 1 40 . 1 1 11 11 LYS CE C 13 42.204 0.300 . 1 . . . . 11 LYS CE . 11394 1 41 . 1 1 11 11 LYS CG C 13 24.675 0.300 . 1 . . . . 11 LYS CG . 11394 1 42 . 1 1 11 11 LYS N N 15 121.678 0.300 . 1 . . . . 11 LYS N . 11394 1 43 . 1 1 12 12 PRO HA H 1 4.244 0.030 . 1 . . . . 12 PRO HA . 11394 1 44 . 1 1 12 12 PRO HB2 H 1 1.988 0.030 . 2 . . . . 12 PRO HB2 . 11394 1 45 . 1 1 12 12 PRO HB3 H 1 1.217 0.030 . 2 . . . . 12 PRO HB3 . 11394 1 46 . 1 1 12 12 PRO HD2 H 1 3.563 0.030 . 2 . . . . 12 PRO HD2 . 11394 1 47 . 1 1 12 12 PRO HG2 H 1 1.749 0.030 . 2 . . . . 12 PRO HG2 . 11394 1 48 . 1 1 12 12 PRO HG3 H 1 1.495 0.030 . 2 . . . . 12 PRO HG3 . 11394 1 49 . 1 1 12 12 PRO C C 13 176.375 0.300 . 1 . . . . 12 PRO C . 11394 1 50 . 1 1 12 12 PRO CA C 13 63.378 0.300 . 1 . . . . 12 PRO CA . 11394 1 51 . 1 1 12 12 PRO CB C 13 32.219 0.300 . 1 . . . . 12 PRO CB . 11394 1 52 . 1 1 12 12 PRO CD C 13 50.237 0.300 . 1 . . . . 12 PRO CD . 11394 1 53 . 1 1 12 12 PRO CG C 13 26.579 0.300 . 1 . . . . 12 PRO CG . 11394 1 54 . 1 1 13 13 TYR H H 1 7.861 0.030 . 1 . . . . 13 TYR H . 11394 1 55 . 1 1 13 13 TYR HA H 1 4.651 0.030 . 1 . . . . 13 TYR HA . 11394 1 56 . 1 1 13 13 TYR HB2 H 1 2.978 0.030 . 2 . . . . 13 TYR HB2 . 11394 1 57 . 1 1 13 13 TYR HB3 H 1 2.829 0.030 . 2 . . . . 13 TYR HB3 . 11394 1 58 . 1 1 13 13 TYR HD1 H 1 6.963 0.030 . 1 . . . . 13 TYR HD1 . 11394 1 59 . 1 1 13 13 TYR HD2 H 1 6.963 0.030 . 1 . . . . 13 TYR HD2 . 11394 1 60 . 1 1 13 13 TYR HE1 H 1 6.867 0.030 . 1 . . . . 13 TYR HE1 . 11394 1 61 . 1 1 13 13 TYR HE2 H 1 6.867 0.030 . 1 . . . . 13 TYR HE2 . 11394 1 62 . 1 1 13 13 TYR C C 13 174.548 0.300 . 1 . . . . 13 TYR C . 11394 1 63 . 1 1 13 13 TYR CA C 13 57.144 0.300 . 1 . . . . 13 TYR CA . 11394 1 64 . 1 1 13 13 TYR CB C 13 38.240 0.300 . 1 . . . . 13 TYR CB . 11394 1 65 . 1 1 13 13 TYR CD1 C 13 133.073 0.300 . 1 . . . . 13 TYR CD1 . 11394 1 66 . 1 1 13 13 TYR CD2 C 13 133.073 0.300 . 1 . . . . 13 TYR CD2 . 11394 1 67 . 1 1 13 13 TYR CE1 C 13 118.424 0.300 . 1 . . . . 13 TYR CE1 . 11394 1 68 . 1 1 13 13 TYR CE2 C 13 118.424 0.300 . 1 . . . . 13 TYR CE2 . 11394 1 69 . 1 1 13 13 TYR N N 15 118.382 0.300 . 1 . . . . 13 TYR N . 11394 1 70 . 1 1 14 14 GLU H H 1 8.541 0.030 . 1 . . . . 14 GLU H . 11394 1 71 . 1 1 14 14 GLU HA H 1 4.865 0.030 . 1 . . . . 14 GLU HA . 11394 1 72 . 1 1 14 14 GLU HB2 H 1 1.823 0.030 . 1 . . . . 14 GLU HB2 . 11394 1 73 . 1 1 14 14 GLU HB3 H 1 1.823 0.030 . 1 . . . . 14 GLU HB3 . 11394 1 74 . 1 1 14 14 GLU C C 13 175.252 0.300 . 1 . . . . 14 GLU C . 11394 1 75 . 1 1 14 14 GLU CA C 13 55.034 0.300 . 1 . . . . 14 GLU CA . 11394 1 76 . 1 1 14 14 GLU CB C 13 32.804 0.300 . 1 . . . . 14 GLU CB . 11394 1 77 . 1 1 14 14 GLU CG C 13 36.515 0.300 . 1 . . . . 14 GLU CG . 11394 1 78 . 1 1 14 14 GLU N N 15 124.342 0.300 . 1 . . . . 14 GLU N . 11394 1 79 . 1 1 15 15 CYS H H 1 9.228 0.030 . 1 . . . . 15 CYS H . 11394 1 80 . 1 1 15 15 CYS HA H 1 4.525 0.030 . 1 . . . . 15 CYS HA . 11394 1 81 . 1 1 15 15 CYS HB2 H 1 3.413 0.030 . 2 . . . . 15 CYS HB2 . 11394 1 82 . 1 1 15 15 CYS HB3 H 1 2.846 0.030 . 2 . . . . 15 CYS HB3 . 11394 1 83 . 1 1 15 15 CYS C C 13 176.819 0.300 . 1 . . . . 15 CYS C . 11394 1 84 . 1 1 15 15 CYS CA C 13 59.590 0.300 . 1 . . . . 15 CYS CA . 11394 1 85 . 1 1 15 15 CYS CB C 13 29.576 0.300 . 1 . . . . 15 CYS CB . 11394 1 86 . 1 1 15 15 CYS N N 15 126.384 0.300 . 1 . . . . 15 CYS N . 11394 1 87 . 1 1 16 16 ASN HA H 1 4.579 0.030 . 1 . . . . 16 ASN HA . 11394 1 88 . 1 1 16 16 ASN HB2 H 1 2.994 0.030 . 2 . . . . 16 ASN HB2 . 11394 1 89 . 1 1 16 16 ASN HB3 H 1 2.910 0.030 . 2 . . . . 16 ASN HB3 . 11394 1 90 . 1 1 16 16 ASN C C 13 175.305 0.300 . 1 . . . . 16 ASN C . 11394 1 91 . 1 1 16 16 ASN CA C 13 54.939 0.300 . 1 . . . . 16 ASN CA . 11394 1 92 . 1 1 16 16 ASN CB C 13 37.981 0.300 . 1 . . . . 16 ASN CB . 11394 1 93 . 1 1 17 17 GLN H H 1 8.845 0.030 . 1 . . . . 17 GLN H . 11394 1 94 . 1 1 17 17 GLN HA H 1 4.266 0.030 . 1 . . . . 17 GLN HA . 11394 1 95 . 1 1 17 17 GLN HB2 H 1 1.406 0.030 . 2 . . . . 17 GLN HB2 . 11394 1 96 . 1 1 17 17 GLN HB3 H 1 1.272 0.030 . 2 . . . . 17 GLN HB3 . 11394 1 97 . 1 1 17 17 GLN HG2 H 1 2.086 0.030 . 2 . . . . 17 GLN HG2 . 11394 1 98 . 1 1 17 17 GLN HG3 H 1 2.022 0.030 . 2 . . . . 17 GLN HG3 . 11394 1 99 . 1 1 17 17 GLN C C 13 176.560 0.300 . 1 . . . . 17 GLN C . 11394 1 100 . 1 1 17 17 GLN CA C 13 57.735 0.300 . 1 . . . . 17 GLN CA . 11394 1 101 . 1 1 17 17 GLN CB C 13 29.131 0.300 . 1 . . . . 17 GLN CB . 11394 1 102 . 1 1 17 17 GLN CG C 13 34.176 0.300 . 1 . . . . 17 GLN CG . 11394 1 103 . 1 1 17 17 GLN N N 15 120.209 0.300 . 1 . . . . 17 GLN N . 11394 1 104 . 1 1 18 18 CYS H H 1 7.878 0.030 . 1 . . . . 18 CYS H . 11394 1 105 . 1 1 18 18 CYS HA H 1 5.125 0.030 . 1 . . . . 18 CYS HA . 11394 1 106 . 1 1 18 18 CYS HB2 H 1 3.408 0.030 . 2 . . . . 18 CYS HB2 . 11394 1 107 . 1 1 18 18 CYS HB3 H 1 2.861 0.030 . 2 . . . . 18 CYS HB3 . 11394 1 108 . 1 1 18 18 CYS C C 13 175.971 0.300 . 1 . . . . 18 CYS C . 11394 1 109 . 1 1 18 18 CYS CA C 13 58.554 0.300 . 1 . . . . 18 CYS CA . 11394 1 110 . 1 1 18 18 CYS CB C 13 32.485 0.300 . 1 . . . . 18 CYS CB . 11394 1 111 . 1 1 18 18 CYS N N 15 115.308 0.300 . 1 . . . . 18 CYS N . 11394 1 112 . 1 1 19 19 GLY H H 1 8.185 0.030 . 1 . . . . 19 GLY H . 11394 1 113 . 1 1 19 19 GLY HA2 H 1 4.196 0.030 . 2 . . . . 19 GLY HA2 . 11394 1 114 . 1 1 19 19 GLY HA3 H 1 3.879 0.030 . 2 . . . . 19 GLY HA3 . 11394 1 115 . 1 1 19 19 GLY C C 13 173.764 0.300 . 1 . . . . 19 GLY C . 11394 1 116 . 1 1 19 19 GLY CA C 13 46.150 0.300 . 1 . . . . 19 GLY CA . 11394 1 117 . 1 1 19 19 GLY N N 15 113.034 0.300 . 1 . . . . 19 GLY N . 11394 1 118 . 1 1 20 20 LYS H H 1 7.953 0.030 . 1 . . . . 20 LYS H . 11394 1 119 . 1 1 20 20 LYS HA H 1 3.925 0.030 . 1 . . . . 20 LYS HA . 11394 1 120 . 1 1 20 20 LYS HB2 H 1 1.408 0.030 . 2 . . . . 20 LYS HB2 . 11394 1 121 . 1 1 20 20 LYS HB3 H 1 1.156 0.030 . 2 . . . . 20 LYS HB3 . 11394 1 122 . 1 1 20 20 LYS HE2 H 1 2.962 0.030 . 2 . . . . 20 LYS HE2 . 11394 1 123 . 1 1 20 20 LYS HE3 H 1 2.871 0.030 . 2 . . . . 20 LYS HE3 . 11394 1 124 . 1 1 20 20 LYS HG2 H 1 1.046 0.030 . 2 . . . . 20 LYS HG2 . 11394 1 125 . 1 1 20 20 LYS HG3 H 1 1.320 0.030 . 2 . . . . 20 LYS HG3 . 11394 1 126 . 1 1 20 20 LYS C C 13 173.729 0.300 . 1 . . . . 20 LYS C . 11394 1 127 . 1 1 20 20 LYS CA C 13 58.117 0.300 . 1 . . . . 20 LYS CA . 11394 1 128 . 1 1 20 20 LYS CB C 13 33.534 0.300 . 1 . . . . 20 LYS CB . 11394 1 129 . 1 1 20 20 LYS CD C 13 28.854 0.300 . 1 . . . . 20 LYS CD . 11394 1 130 . 1 1 20 20 LYS CE C 13 42.128 0.300 . 1 . . . . 20 LYS CE . 11394 1 131 . 1 1 20 20 LYS CG C 13 26.048 0.300 . 1 . . . . 20 LYS CG . 11394 1 132 . 1 1 20 20 LYS N N 15 123.033 0.300 . 1 . . . . 20 LYS N . 11394 1 133 . 1 1 21 21 ALA H H 1 7.750 0.030 . 1 . . . . 21 ALA H . 11394 1 134 . 1 1 21 21 ALA HA H 1 5.119 0.030 . 1 . . . . 21 ALA HA . 11394 1 135 . 1 1 21 21 ALA HB1 H 1 1.203 0.030 . 1 . . . . 21 ALA HB . 11394 1 136 . 1 1 21 21 ALA HB2 H 1 1.203 0.030 . 1 . . . . 21 ALA HB . 11394 1 137 . 1 1 21 21 ALA HB3 H 1 1.203 0.030 . 1 . . . . 21 ALA HB . 11394 1 138 . 1 1 21 21 ALA C C 13 176.213 0.300 . 1 . . . . 21 ALA C . 11394 1 139 . 1 1 21 21 ALA CA C 13 50.452 0.300 . 1 . . . . 21 ALA CA . 11394 1 140 . 1 1 21 21 ALA CB C 13 22.338 0.300 . 1 . . . . 21 ALA CB . 11394 1 141 . 1 1 21 21 ALA N N 15 124.217 0.300 . 1 . . . . 21 ALA N . 11394 1 142 . 1 1 22 22 PHE H H 1 8.649 0.030 . 1 . . . . 22 PHE H . 11394 1 143 . 1 1 22 22 PHE HB2 H 1 3.365 0.030 . 2 . . . . 22 PHE HB2 . 11394 1 144 . 1 1 22 22 PHE HB3 H 1 2.676 0.030 . 2 . . . . 22 PHE HB3 . 11394 1 145 . 1 1 22 22 PHE HD1 H 1 7.220 0.030 . 1 . . . . 22 PHE HD1 . 11394 1 146 . 1 1 22 22 PHE HD2 H 1 7.220 0.030 . 1 . . . . 22 PHE HD2 . 11394 1 147 . 1 1 22 22 PHE HE1 H 1 6.833 0.030 . 1 . . . . 22 PHE HE1 . 11394 1 148 . 1 1 22 22 PHE HE2 H 1 6.833 0.030 . 1 . . . . 22 PHE HE2 . 11394 1 149 . 1 1 22 22 PHE HZ H 1 6.305 0.030 . 1 . . . . 22 PHE HZ . 11394 1 150 . 1 1 22 22 PHE C C 13 175.497 0.300 . 1 . . . . 22 PHE C . 11394 1 151 . 1 1 22 22 PHE CA C 13 57.222 0.300 . 1 . . . . 22 PHE CA . 11394 1 152 . 1 1 22 22 PHE CB C 13 43.867 0.300 . 1 . . . . 22 PHE CB . 11394 1 153 . 1 1 22 22 PHE CD1 C 13 132.438 0.300 . 1 . . . . 22 PHE CD1 . 11394 1 154 . 1 1 22 22 PHE CD2 C 13 132.438 0.300 . 1 . . . . 22 PHE CD2 . 11394 1 155 . 1 1 22 22 PHE CE1 C 13 130.676 0.300 . 1 . . . . 22 PHE CE1 . 11394 1 156 . 1 1 22 22 PHE CE2 C 13 130.676 0.300 . 1 . . . . 22 PHE CE2 . 11394 1 157 . 1 1 22 22 PHE CZ C 13 128.768 0.300 . 1 . . . . 22 PHE CZ . 11394 1 158 . 1 1 22 22 PHE N N 15 116.743 0.300 . 1 . . . . 22 PHE N . 11394 1 159 . 1 1 23 23 SER HA H 1 4.666 0.030 . 1 . . . . 23 SER HA . 11394 1 160 . 1 1 23 23 SER HB2 H 1 4.079 0.030 . 2 . . . . 23 SER HB2 . 11394 1 161 . 1 1 23 23 SER C C 13 173.820 0.300 . 1 . . . . 23 SER C . 11394 1 162 . 1 1 23 23 SER CA C 13 60.457 0.300 . 1 . . . . 23 SER CA . 11394 1 163 . 1 1 23 23 SER CB C 13 64.271 0.300 . 1 . . . . 23 SER CB . 11394 1 164 . 1 1 24 24 VAL H H 1 7.369 0.030 . 1 . . . . 24 VAL H . 11394 1 165 . 1 1 24 24 VAL HA H 1 4.604 0.030 . 1 . . . . 24 VAL HA . 11394 1 166 . 1 1 24 24 VAL HB H 1 2.177 0.030 . 1 . . . . 24 VAL HB . 11394 1 167 . 1 1 24 24 VAL HG11 H 1 1.033 0.030 . 1 . . . . 24 VAL HG1 . 11394 1 168 . 1 1 24 24 VAL HG12 H 1 1.033 0.030 . 1 . . . . 24 VAL HG1 . 11394 1 169 . 1 1 24 24 VAL HG13 H 1 1.033 0.030 . 1 . . . . 24 VAL HG1 . 11394 1 170 . 1 1 24 24 VAL HG21 H 1 0.968 0.030 . 1 . . . . 24 VAL HG2 . 11394 1 171 . 1 1 24 24 VAL HG22 H 1 0.968 0.030 . 1 . . . . 24 VAL HG2 . 11394 1 172 . 1 1 24 24 VAL HG23 H 1 0.968 0.030 . 1 . . . . 24 VAL HG2 . 11394 1 173 . 1 1 24 24 VAL C C 13 176.242 0.300 . 1 . . . . 24 VAL C . 11394 1 174 . 1 1 24 24 VAL CA C 13 60.147 0.300 . 1 . . . . 24 VAL CA . 11394 1 175 . 1 1 24 24 VAL CB C 13 35.076 0.300 . 1 . . . . 24 VAL CB . 11394 1 176 . 1 1 24 24 VAL CG1 C 13 22.036 0.300 . 2 . . . . 24 VAL CG1 . 11394 1 177 . 1 1 24 24 VAL CG2 C 13 20.203 0.300 . 2 . . . . 24 VAL CG2 . 11394 1 178 . 1 1 24 24 VAL N N 15 115.857 0.300 . 1 . . . . 24 VAL N . 11394 1 179 . 1 1 25 25 ARG H H 1 8.558 0.030 . 1 . . . . 25 ARG H . 11394 1 180 . 1 1 25 25 ARG HB2 H 1 1.497 0.030 . 2 . . . . 25 ARG HB2 . 11394 1 181 . 1 1 25 25 ARG HB3 H 1 1.030 0.030 . 2 . . . . 25 ARG HB3 . 11394 1 182 . 1 1 25 25 ARG HD2 H 1 2.999 0.030 . 2 . . . . 25 ARG HD2 . 11394 1 183 . 1 1 25 25 ARG HG2 H 1 1.157 0.030 . 2 . . . . 25 ARG HG2 . 11394 1 184 . 1 1 25 25 ARG HG3 H 1 1.300 0.030 . 2 . . . . 25 ARG HG3 . 11394 1 185 . 1 1 25 25 ARG C C 13 178.539 0.300 . 1 . . . . 25 ARG C . 11394 1 186 . 1 1 25 25 ARG CA C 13 60.158 0.300 . 1 . . . . 25 ARG CA . 11394 1 187 . 1 1 25 25 ARG CB C 13 29.252 0.300 . 1 . . . . 25 ARG CB . 11394 1 188 . 1 1 25 25 ARG CD C 13 43.040 0.300 . 1 . . . . 25 ARG CD . 11394 1 189 . 1 1 25 25 ARG CG C 13 27.406 0.300 . 1 . . . . 25 ARG CG . 11394 1 190 . 1 1 25 25 ARG N N 15 128.396 0.300 . 1 . . . . 25 ARG N . 11394 1 191 . 1 1 26 26 SER HA H 1 4.076 0.030 . 1 . . . . 26 SER HA . 11394 1 192 . 1 1 26 26 SER HB2 H 1 3.814 0.030 . 2 . . . . 26 SER HB2 . 11394 1 193 . 1 1 26 26 SER HB3 H 1 3.880 0.030 . 2 . . . . 26 SER HB3 . 11394 1 194 . 1 1 26 26 SER C C 13 176.974 0.300 . 1 . . . . 26 SER C . 11394 1 195 . 1 1 26 26 SER CA C 13 60.921 0.300 . 1 . . . . 26 SER CA . 11394 1 196 . 1 1 26 26 SER CB C 13 61.641 0.300 . 1 . . . . 26 SER CB . 11394 1 197 . 1 1 27 27 SER H H 1 7.090 0.030 . 1 . . . . 27 SER H . 11394 1 198 . 1 1 27 27 SER HA H 1 4.201 0.030 . 1 . . . . 27 SER HA . 11394 1 199 . 1 1 27 27 SER HB2 H 1 3.982 0.030 . 2 . . . . 27 SER HB2 . 11394 1 200 . 1 1 27 27 SER HB3 H 1 3.857 0.030 . 2 . . . . 27 SER HB3 . 11394 1 201 . 1 1 27 27 SER C C 13 176.050 0.300 . 1 . . . . 27 SER C . 11394 1 202 . 1 1 27 27 SER CA C 13 61.105 0.300 . 1 . . . . 27 SER CA . 11394 1 203 . 1 1 27 27 SER CB C 13 62.567 0.300 . 1 . . . . 27 SER CB . 11394 1 204 . 1 1 27 27 SER N N 15 117.735 0.300 . 1 . . . . 27 SER N . 11394 1 205 . 1 1 28 28 LEU H H 1 6.938 0.030 . 1 . . . . 28 LEU H . 11394 1 206 . 1 1 28 28 LEU HA H 1 3.294 0.030 . 1 . . . . 28 LEU HA . 11394 1 207 . 1 1 28 28 LEU HB2 H 1 2.099 0.030 . 2 . . . . 28 LEU HB2 . 11394 1 208 . 1 1 28 28 LEU HB3 H 1 1.206 0.030 . 2 . . . . 28 LEU HB3 . 11394 1 209 . 1 1 28 28 LEU HD11 H 1 1.005 0.030 . 1 . . . . 28 LEU HD1 . 11394 1 210 . 1 1 28 28 LEU HD12 H 1 1.005 0.030 . 1 . . . . 28 LEU HD1 . 11394 1 211 . 1 1 28 28 LEU HD13 H 1 1.005 0.030 . 1 . . . . 28 LEU HD1 . 11394 1 212 . 1 1 28 28 LEU HD21 H 1 0.942 0.030 . 1 . . . . 28 LEU HD2 . 11394 1 213 . 1 1 28 28 LEU HD22 H 1 0.942 0.030 . 1 . . . . 28 LEU HD2 . 11394 1 214 . 1 1 28 28 LEU HD23 H 1 0.942 0.030 . 1 . . . . 28 LEU HD2 . 11394 1 215 . 1 1 28 28 LEU HG H 1 1.454 0.030 . 1 . . . . 28 LEU HG . 11394 1 216 . 1 1 28 28 LEU C C 13 177.603 0.300 . 1 . . . . 28 LEU C . 11394 1 217 . 1 1 28 28 LEU CA C 13 57.833 0.300 . 1 . . . . 28 LEU CA . 11394 1 218 . 1 1 28 28 LEU CB C 13 39.837 0.300 . 1 . . . . 28 LEU CB . 11394 1 219 . 1 1 28 28 LEU CD1 C 13 22.783 0.300 . 2 . . . . 28 LEU CD1 . 11394 1 220 . 1 1 28 28 LEU CD2 C 13 26.406 0.300 . 2 . . . . 28 LEU CD2 . 11394 1 221 . 1 1 28 28 LEU CG C 13 27.545 0.300 . 1 . . . . 28 LEU CG . 11394 1 222 . 1 1 28 28 LEU N N 15 124.121 0.300 . 1 . . . . 28 LEU N . 11394 1 223 . 1 1 29 29 THR H H 1 8.271 0.030 . 1 . . . . 29 THR H . 11394 1 224 . 1 1 29 29 THR HA H 1 3.921 0.030 . 1 . . . . 29 THR HA . 11394 1 225 . 1 1 29 29 THR HB H 1 4.136 0.030 . 1 . . . . 29 THR HB . 11394 1 226 . 1 1 29 29 THR HG21 H 1 1.151 0.030 . 1 . . . . 29 THR HG2 . 11394 1 227 . 1 1 29 29 THR HG22 H 1 1.151 0.030 . 1 . . . . 29 THR HG2 . 11394 1 228 . 1 1 29 29 THR HG23 H 1 1.151 0.030 . 1 . . . . 29 THR HG2 . 11394 1 229 . 1 1 29 29 THR C C 13 177.469 0.300 . 1 . . . . 29 THR C . 11394 1 230 . 1 1 29 29 THR CA C 13 66.433 0.300 . 1 . . . . 29 THR CA . 11394 1 231 . 1 1 29 29 THR CB C 13 68.161 0.300 . 1 . . . . 29 THR CB . 11394 1 232 . 1 1 29 29 THR CG2 C 13 22.253 0.300 . 1 . . . . 29 THR CG2 . 11394 1 233 . 1 1 29 29 THR N N 15 116.040 0.300 . 1 . . . . 29 THR N . 11394 1 234 . 1 1 30 30 THR H H 1 7.856 0.030 . 1 . . . . 30 THR H . 11394 1 235 . 1 1 30 30 THR HA H 1 3.870 0.030 . 1 . . . . 30 THR HA . 11394 1 236 . 1 1 30 30 THR HB H 1 4.017 0.030 . 1 . . . . 30 THR HB . 11394 1 237 . 1 1 30 30 THR HG21 H 1 1.187 0.030 . 1 . . . . 30 THR HG2 . 11394 1 238 . 1 1 30 30 THR HG22 H 1 1.187 0.030 . 1 . . . . 30 THR HG2 . 11394 1 239 . 1 1 30 30 THR HG23 H 1 1.187 0.030 . 1 . . . . 30 THR HG2 . 11394 1 240 . 1 1 30 30 THR C C 13 176.331 0.300 . 1 . . . . 30 THR C . 11394 1 241 . 1 1 30 30 THR CA C 13 66.311 0.300 . 1 . . . . 30 THR CA . 11394 1 242 . 1 1 30 30 THR CB C 13 68.765 0.300 . 1 . . . . 30 THR CB . 11394 1 243 . 1 1 30 30 THR CG2 C 13 22.001 0.300 . 1 . . . . 30 THR CG2 . 11394 1 244 . 1 1 30 30 THR N N 15 117.530 0.300 . 1 . . . . 30 THR N . 11394 1 245 . 1 1 31 31 HIS H H 1 7.433 0.030 . 1 . . . . 31 HIS H . 11394 1 246 . 1 1 31 31 HIS HA H 1 4.177 0.030 . 1 . . . . 31 HIS HA . 11394 1 247 . 1 1 31 31 HIS HB2 H 1 3.193 0.030 . 2 . . . . 31 HIS HB2 . 11394 1 248 . 1 1 31 31 HIS HB3 H 1 2.932 0.030 . 2 . . . . 31 HIS HB3 . 11394 1 249 . 1 1 31 31 HIS HD2 H 1 6.943 0.030 . 1 . . . . 31 HIS HD2 . 11394 1 250 . 1 1 31 31 HIS HE1 H 1 7.998 0.030 . 1 . . . . 31 HIS HE1 . 11394 1 251 . 1 1 31 31 HIS C C 13 175.989 0.300 . 1 . . . . 31 HIS C . 11394 1 252 . 1 1 31 31 HIS CA C 13 59.334 0.300 . 1 . . . . 31 HIS CA . 11394 1 253 . 1 1 31 31 HIS CB C 13 28.626 0.300 . 1 . . . . 31 HIS CB . 11394 1 254 . 1 1 31 31 HIS CD2 C 13 127.126 0.300 . 1 . . . . 31 HIS CD2 . 11394 1 255 . 1 1 31 31 HIS CE1 C 13 139.695 0.300 . 1 . . . . 31 HIS CE1 . 11394 1 256 . 1 1 31 31 HIS N N 15 121.436 0.300 . 1 . . . . 31 HIS N . 11394 1 257 . 1 1 32 32 GLN H H 1 8.360 0.030 . 1 . . . . 32 GLN H . 11394 1 258 . 1 1 32 32 GLN HA H 1 3.662 0.030 . 1 . . . . 32 GLN HA . 11394 1 259 . 1 1 32 32 GLN HB2 H 1 2.306 0.030 . 2 . . . . 32 GLN HB2 . 11394 1 260 . 1 1 32 32 GLN HB3 H 1 2.177 0.030 . 2 . . . . 32 GLN HB3 . 11394 1 261 . 1 1 32 32 GLN HE21 H 1 7.023 0.030 . 2 . . . . 32 GLN HE21 . 11394 1 262 . 1 1 32 32 GLN HE22 H 1 7.532 0.030 . 2 . . . . 32 GLN HE22 . 11394 1 263 . 1 1 32 32 GLN HG2 H 1 2.814 0.030 . 1 . . . . 32 GLN HG2 . 11394 1 264 . 1 1 32 32 GLN HG3 H 1 2.814 0.030 . 1 . . . . 32 GLN HG3 . 11394 1 265 . 1 1 32 32 GLN C C 13 177.216 0.300 . 1 . . . . 32 GLN C . 11394 1 266 . 1 1 32 32 GLN CA C 13 59.361 0.300 . 1 . . . . 32 GLN CA . 11394 1 267 . 1 1 32 32 GLN CB C 13 28.203 0.300 . 1 . . . . 32 GLN CB . 11394 1 268 . 1 1 32 32 GLN CG C 13 35.523 0.300 . 1 . . . . 32 GLN CG . 11394 1 269 . 1 1 32 32 GLN N N 15 115.172 0.300 . 1 . . . . 32 GLN N . 11394 1 270 . 1 1 32 32 GLN NE2 N 15 112.440 0.300 . 1 . . . . 32 GLN NE2 . 11394 1 271 . 1 1 33 33 ALA H H 1 7.065 0.030 . 1 . . . . 33 ALA H . 11394 1 272 . 1 1 33 33 ALA HA H 1 4.163 0.030 . 1 . . . . 33 ALA HA . 11394 1 273 . 1 1 33 33 ALA HB1 H 1 1.426 0.030 . 1 . . . . 33 ALA HB . 11394 1 274 . 1 1 33 33 ALA HB2 H 1 1.426 0.030 . 1 . . . . 33 ALA HB . 11394 1 275 . 1 1 33 33 ALA HB3 H 1 1.426 0.030 . 1 . . . . 33 ALA HB . 11394 1 276 . 1 1 33 33 ALA C C 13 179.709 0.300 . 1 . . . . 33 ALA C . 11394 1 277 . 1 1 33 33 ALA CA C 13 54.304 0.300 . 1 . . . . 33 ALA CA . 11394 1 278 . 1 1 33 33 ALA CB C 13 18.363 0.300 . 1 . . . . 33 ALA CB . 11394 1 279 . 1 1 33 33 ALA N N 15 120.630 0.300 . 1 . . . . 33 ALA N . 11394 1 280 . 1 1 34 34 ILE H H 1 7.769 0.030 . 1 . . . . 34 ILE H . 11394 1 281 . 1 1 34 34 ILE HA H 1 3.957 0.030 . 1 . . . . 34 ILE HA . 11394 1 282 . 1 1 34 34 ILE HB H 1 1.677 0.030 . 1 . . . . 34 ILE HB . 11394 1 283 . 1 1 34 34 ILE HD11 H 1 0.686 0.030 . 1 . . . . 34 ILE HD1 . 11394 1 284 . 1 1 34 34 ILE HD12 H 1 0.686 0.030 . 1 . . . . 34 ILE HD1 . 11394 1 285 . 1 1 34 34 ILE HD13 H 1 0.686 0.030 . 1 . . . . 34 ILE HD1 . 11394 1 286 . 1 1 34 34 ILE HG12 H 1 0.936 0.030 . 2 . . . . 34 ILE HG12 . 11394 1 287 . 1 1 34 34 ILE HG13 H 1 0.779 0.030 . 2 . . . . 34 ILE HG13 . 11394 1 288 . 1 1 34 34 ILE HG21 H 1 0.553 0.030 . 1 . . . . 34 ILE HG2 . 11394 1 289 . 1 1 34 34 ILE HG22 H 1 0.553 0.030 . 1 . . . . 34 ILE HG2 . 11394 1 290 . 1 1 34 34 ILE HG23 H 1 0.553 0.030 . 1 . . . . 34 ILE HG2 . 11394 1 291 . 1 1 34 34 ILE C C 13 177.466 0.300 . 1 . . . . 34 ILE C . 11394 1 292 . 1 1 34 34 ILE CA C 13 62.904 0.300 . 1 . . . . 34 ILE CA . 11394 1 293 . 1 1 34 34 ILE CB C 13 37.753 0.300 . 1 . . . . 34 ILE CB . 11394 1 294 . 1 1 34 34 ILE CD1 C 13 14.337 0.300 . 1 . . . . 34 ILE CD1 . 11394 1 295 . 1 1 34 34 ILE CG1 C 13 26.771 0.300 . 1 . . . . 34 ILE CG1 . 11394 1 296 . 1 1 34 34 ILE CG2 C 13 16.468 0.300 . 1 . . . . 34 ILE CG2 . 11394 1 297 . 1 1 34 34 ILE N N 15 115.335 0.300 . 1 . . . . 34 ILE N . 11394 1 298 . 1 1 35 35 HIS H H 1 7.223 0.030 . 1 . . . . 35 HIS H . 11394 1 299 . 1 1 35 35 HIS HA H 1 4.817 0.030 . 1 . . . . 35 HIS HA . 11394 1 300 . 1 1 35 35 HIS HB2 H 1 3.279 0.030 . 2 . . . . 35 HIS HB2 . 11394 1 301 . 1 1 35 35 HIS HB3 H 1 3.211 0.030 . 2 . . . . 35 HIS HB3 . 11394 1 302 . 1 1 35 35 HIS HD2 H 1 6.703 0.030 . 1 . . . . 35 HIS HD2 . 11394 1 303 . 1 1 35 35 HIS HE1 H 1 8.038 0.030 . 1 . . . . 35 HIS HE1 . 11394 1 304 . 1 1 35 35 HIS C C 13 175.637 0.300 . 1 . . . . 35 HIS C . 11394 1 305 . 1 1 35 35 HIS CA C 13 55.156 0.300 . 1 . . . . 35 HIS CA . 11394 1 306 . 1 1 35 35 HIS CB C 13 28.586 0.300 . 1 . . . . 35 HIS CB . 11394 1 307 . 1 1 35 35 HIS CD2 C 13 127.569 0.300 . 1 . . . . 35 HIS CD2 . 11394 1 308 . 1 1 35 35 HIS CE1 C 13 140.114 0.300 . 1 . . . . 35 HIS CE1 . 11394 1 309 . 1 1 35 35 HIS N N 15 117.655 0.300 . 1 . . . . 35 HIS N . 11394 1 310 . 1 1 36 36 THR H H 1 7.738 0.030 . 1 . . . . 36 THR H . 11394 1 311 . 1 1 36 36 THR HA H 1 4.327 0.030 . 1 . . . . 36 THR HA . 11394 1 312 . 1 1 36 36 THR HG21 H 1 1.231 0.030 . 1 . . . . 36 THR HG2 . 11394 1 313 . 1 1 36 36 THR HG22 H 1 1.231 0.030 . 1 . . . . 36 THR HG2 . 11394 1 314 . 1 1 36 36 THR HG23 H 1 1.231 0.030 . 1 . . . . 36 THR HG2 . 11394 1 315 . 1 1 36 36 THR C C 13 175.324 0.300 . 1 . . . . 36 THR C . 11394 1 316 . 1 1 36 36 THR CA C 13 62.538 0.300 . 1 . . . . 36 THR CA . 11394 1 317 . 1 1 36 36 THR CB C 13 69.642 0.300 . 1 . . . . 36 THR CB . 11394 1 318 . 1 1 36 36 THR CG2 C 13 21.733 0.300 . 1 . . . . 36 THR CG2 . 11394 1 319 . 1 1 36 36 THR N N 15 112.177 0.300 . 1 . . . . 36 THR N . 11394 1 320 . 1 1 37 37 GLY H H 1 8.259 0.030 . 1 . . . . 37 GLY H . 11394 1 321 . 1 1 37 37 GLY HA2 H 1 3.961 0.030 . 1 . . . . 37 GLY HA2 . 11394 1 322 . 1 1 37 37 GLY HA3 H 1 3.961 0.030 . 1 . . . . 37 GLY HA3 . 11394 1 323 . 1 1 37 37 GLY C C 13 173.839 0.300 . 1 . . . . 37 GLY C . 11394 1 324 . 1 1 37 37 GLY CA C 13 45.380 0.300 . 1 . . . . 37 GLY CA . 11394 1 325 . 1 1 37 37 GLY N N 15 110.796 0.300 . 1 . . . . 37 GLY N . 11394 1 326 . 1 1 38 38 LYS H H 1 8.057 0.030 . 1 . . . . 38 LYS H . 11394 1 327 . 1 1 38 38 LYS HA H 1 4.317 0.030 . 1 . . . . 38 LYS HA . 11394 1 328 . 1 1 38 38 LYS HB2 H 1 1.764 0.030 . 2 . . . . 38 LYS HB2 . 11394 1 329 . 1 1 38 38 LYS HB3 H 1 1.686 0.030 . 2 . . . . 38 LYS HB3 . 11394 1 330 . 1 1 38 38 LYS HD2 H 1 1.636 0.030 . 1 . . . . 38 LYS HD2 . 11394 1 331 . 1 1 38 38 LYS HD3 H 1 1.636 0.030 . 1 . . . . 38 LYS HD3 . 11394 1 332 . 1 1 38 38 LYS HE2 H 1 2.962 0.030 . 2 . . . . 38 LYS HE2 . 11394 1 333 . 1 1 38 38 LYS HG2 H 1 1.376 0.030 . 1 . . . . 38 LYS HG2 . 11394 1 334 . 1 1 38 38 LYS HG3 H 1 1.376 0.030 . 1 . . . . 38 LYS HG3 . 11394 1 335 . 1 1 38 38 LYS C C 13 176.327 0.300 . 1 . . . . 38 LYS C . 11394 1 336 . 1 1 38 38 LYS CA C 13 55.967 0.300 . 1 . . . . 38 LYS CA . 11394 1 337 . 1 1 38 38 LYS CB C 13 33.185 0.300 . 1 . . . . 38 LYS CB . 11394 1 338 . 1 1 38 38 LYS CD C 13 28.984 0.300 . 1 . . . . 38 LYS CD . 11394 1 339 . 1 1 38 38 LYS CE C 13 42.256 0.300 . 1 . . . . 38 LYS CE . 11394 1 340 . 1 1 38 38 LYS CG C 13 24.642 0.300 . 1 . . . . 38 LYS CG . 11394 1 341 . 1 1 38 38 LYS N N 15 120.899 0.300 . 1 . . . . 38 LYS N . 11394 1 342 . 1 1 39 39 LYS H H 1 8.396 0.030 . 1 . . . . 39 LYS H . 11394 1 343 . 1 1 39 39 LYS HA H 1 4.563 0.030 . 1 . . . . 39 LYS HA . 11394 1 344 . 1 1 39 39 LYS HB2 H 1 1.708 0.030 . 2 . . . . 39 LYS HB2 . 11394 1 345 . 1 1 39 39 LYS HB3 H 1 1.793 0.030 . 2 . . . . 39 LYS HB3 . 11394 1 346 . 1 1 39 39 LYS HD2 H 1 1.661 0.030 . 1 . . . . 39 LYS HD2 . 11394 1 347 . 1 1 39 39 LYS HD3 H 1 1.661 0.030 . 1 . . . . 39 LYS HD3 . 11394 1 348 . 1 1 39 39 LYS HE2 H 1 2.996 0.030 . 2 . . . . 39 LYS HE2 . 11394 1 349 . 1 1 39 39 LYS HG2 H 1 1.453 0.030 . 1 . . . . 39 LYS HG2 . 11394 1 350 . 1 1 39 39 LYS HG3 H 1 1.453 0.030 . 1 . . . . 39 LYS HG3 . 11394 1 351 . 1 1 39 39 LYS C C 13 174.644 0.300 . 1 . . . . 39 LYS C . 11394 1 352 . 1 1 39 39 LYS CA C 13 54.229 0.300 . 1 . . . . 39 LYS CA . 11394 1 353 . 1 1 39 39 LYS CB C 13 32.508 0.300 . 1 . . . . 39 LYS CB . 11394 1 354 . 1 1 39 39 LYS CD C 13 29.165 0.300 . 1 . . . . 39 LYS CD . 11394 1 355 . 1 1 39 39 LYS CE C 13 42.166 0.300 . 1 . . . . 39 LYS CE . 11394 1 356 . 1 1 39 39 LYS CG C 13 24.529 0.300 . 1 . . . . 39 LYS CG . 11394 1 357 . 1 1 39 39 LYS N N 15 124.726 0.300 . 1 . . . . 39 LYS N . 11394 1 358 . 1 1 40 40 PRO HA H 1 4.438 0.030 . 1 . . . . 40 PRO HA . 11394 1 359 . 1 1 40 40 PRO HB2 H 1 1.965 0.030 . 2 . . . . 40 PRO HB2 . 11394 1 360 . 1 1 40 40 PRO HB3 H 1 2.278 0.030 . 2 . . . . 40 PRO HB3 . 11394 1 361 . 1 1 40 40 PRO HD2 H 1 3.822 0.030 . 2 . . . . 40 PRO HD2 . 11394 1 362 . 1 1 40 40 PRO HD3 H 1 3.626 0.030 . 2 . . . . 40 PRO HD3 . 11394 1 363 . 1 1 40 40 PRO HG2 H 1 1.998 0.030 . 2 . . . . 40 PRO HG2 . 11394 1 364 . 1 1 40 40 PRO C C 13 176.931 0.300 . 1 . . . . 40 PRO C . 11394 1 365 . 1 1 40 40 PRO CA C 13 63.216 0.300 . 1 . . . . 40 PRO CA . 11394 1 366 . 1 1 40 40 PRO CB C 13 32.157 0.300 . 1 . . . . 40 PRO CB . 11394 1 367 . 1 1 40 40 PRO CD C 13 50.715 0.300 . 1 . . . . 40 PRO CD . 11394 1 368 . 1 1 40 40 PRO CG C 13 27.339 0.300 . 1 . . . . 40 PRO CG . 11394 1 369 . 1 1 41 41 SER H H 1 8.423 0.030 . 1 . . . . 41 SER H . 11394 1 370 . 1 1 41 41 SER HA H 1 4.480 0.030 . 1 . . . . 41 SER HA . 11394 1 371 . 1 1 41 41 SER HB2 H 1 3.865 0.030 . 2 . . . . 41 SER HB2 . 11394 1 372 . 1 1 41 41 SER C C 13 174.551 0.300 . 1 . . . . 41 SER C . 11394 1 373 . 1 1 41 41 SER CA C 13 58.482 0.300 . 1 . . . . 41 SER CA . 11394 1 374 . 1 1 41 41 SER CB C 13 63.949 0.300 . 1 . . . . 41 SER CB . 11394 1 375 . 1 1 41 41 SER N N 15 116.487 0.300 . 1 . . . . 41 SER N . 11394 1 376 . 1 1 42 42 GLY H H 1 8.204 0.030 . 1 . . . . 42 GLY H . 11394 1 377 . 1 1 42 42 GLY C C 13 171.702 0.300 . 1 . . . . 42 GLY C . 11394 1 378 . 1 1 42 42 GLY CA C 13 44.827 0.300 . 1 . . . . 42 GLY CA . 11394 1 379 . 1 1 42 42 GLY N N 15 110.553 0.300 . 1 . . . . 42 GLY N . 11394 1 380 . 1 1 43 43 PRO HA H 1 4.454 0.030 . 1 . . . . 43 PRO HA . 11394 1 381 . 1 1 43 43 PRO HB2 H 1 2.290 0.030 . 2 . . . . 43 PRO HB2 . 11394 1 382 . 1 1 43 43 PRO HD2 H 1 3.605 0.030 . 2 . . . . 43 PRO HD2 . 11394 1 383 . 1 1 43 43 PRO HG2 H 1 1.990 0.030 . 2 . . . . 43 PRO HG2 . 11394 1 384 . 1 1 43 43 PRO CA C 13 63.327 0.300 . 1 . . . . 43 PRO CA . 11394 1 385 . 1 1 43 43 PRO CB C 13 32.116 0.300 . 1 . . . . 43 PRO CB . 11394 1 386 . 1 1 43 43 PRO CD C 13 49.771 0.300 . 1 . . . . 43 PRO CD . 11394 1 387 . 1 1 43 43 PRO CG C 13 26.882 0.300 . 1 . . . . 43 PRO CG . 11394 1 stop_ save_