################################### # 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 11381 _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 11381 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11381 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 . . 11381 1 2 $NMRPipe . . 11381 1 3 $NMRView . . 11381 1 4 $Kujira . . 11381 1 5 $CYANA . . 11381 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 HA2 H 1 3.982 0.030 . 2 . . . . 7 GLY HA2 . 11381 1 2 . 1 1 7 7 GLY C C 13 173.950 0.300 . 1 . . . . 7 GLY C . 11381 1 3 . 1 1 7 7 GLY CA C 13 45.410 0.300 . 1 . . . . 7 GLY CA . 11381 1 4 . 1 1 8 8 GLN H H 1 8.130 0.030 . 1 . . . . 8 GLN H . 11381 1 5 . 1 1 8 8 GLN HA H 1 4.342 0.030 . 1 . . . . 8 GLN HA . 11381 1 6 . 1 1 8 8 GLN HB2 H 1 2.075 0.030 . 2 . . . . 8 GLN HB2 . 11381 1 7 . 1 1 8 8 GLN HB3 H 1 1.936 0.030 . 2 . . . . 8 GLN HB3 . 11381 1 8 . 1 1 8 8 GLN HE21 H 1 7.550 0.030 . 2 . . . . 8 GLN HE21 . 11381 1 9 . 1 1 8 8 GLN HE22 H 1 6.879 0.030 . 2 . . . . 8 GLN HE22 . 11381 1 10 . 1 1 8 8 GLN HG2 H 1 2.319 0.030 . 1 . . . . 8 GLN HG2 . 11381 1 11 . 1 1 8 8 GLN HG3 H 1 2.319 0.030 . 1 . . . . 8 GLN HG3 . 11381 1 12 . 1 1 8 8 GLN C C 13 175.577 0.300 . 1 . . . . 8 GLN C . 11381 1 13 . 1 1 8 8 GLN CA C 13 55.682 0.300 . 1 . . . . 8 GLN CA . 11381 1 14 . 1 1 8 8 GLN CB C 13 29.607 0.300 . 1 . . . . 8 GLN CB . 11381 1 15 . 1 1 8 8 GLN CG C 13 33.835 0.300 . 1 . . . . 8 GLN CG . 11381 1 16 . 1 1 8 8 GLN N N 15 119.775 0.300 . 1 . . . . 8 GLN N . 11381 1 17 . 1 1 8 8 GLN NE2 N 15 112.619 0.300 . 1 . . . . 8 GLN NE2 . 11381 1 18 . 1 1 9 9 ARG H H 1 8.371 0.030 . 1 . . . . 9 ARG H . 11381 1 19 . 1 1 9 9 ARG HA H 1 4.274 0.030 . 1 . . . . 9 ARG HA . 11381 1 20 . 1 1 9 9 ARG HB2 H 1 1.719 0.030 . 2 . . . . 9 ARG HB2 . 11381 1 21 . 1 1 9 9 ARG HB3 H 1 1.662 0.030 . 2 . . . . 9 ARG HB3 . 11381 1 22 . 1 1 9 9 ARG HD2 H 1 3.119 0.030 . 1 . . . . 9 ARG HD2 . 11381 1 23 . 1 1 9 9 ARG HD3 H 1 3.119 0.030 . 1 . . . . 9 ARG HD3 . 11381 1 24 . 1 1 9 9 ARG HG2 H 1 1.441 0.030 . 1 . . . . 9 ARG HG2 . 11381 1 25 . 1 1 9 9 ARG HG3 H 1 1.441 0.030 . 1 . . . . 9 ARG HG3 . 11381 1 26 . 1 1 9 9 ARG C C 13 175.168 0.300 . 1 . . . . 9 ARG C . 11381 1 27 . 1 1 9 9 ARG CA C 13 56.053 0.300 . 1 . . . . 9 ARG CA . 11381 1 28 . 1 1 9 9 ARG CB C 13 30.828 0.300 . 1 . . . . 9 ARG CB . 11381 1 29 . 1 1 9 9 ARG CD C 13 43.233 0.300 . 1 . . . . 9 ARG CD . 11381 1 30 . 1 1 9 9 ARG CG C 13 26.877 0.300 . 1 . . . . 9 ARG CG . 11381 1 31 . 1 1 9 9 ARG N N 15 123.270 0.300 . 1 . . . . 9 ARG N . 11381 1 32 . 1 1 10 10 VAL H H 1 7.793 0.030 . 1 . . . . 10 VAL H . 11381 1 33 . 1 1 10 10 VAL HA H 1 4.348 0.030 . 1 . . . . 10 VAL HA . 11381 1 34 . 1 1 10 10 VAL HB H 1 1.895 0.030 . 1 . . . . 10 VAL HB . 11381 1 35 . 1 1 10 10 VAL HG11 H 1 0.776 0.030 . 1 . . . . 10 VAL HG1 . 11381 1 36 . 1 1 10 10 VAL HG12 H 1 0.776 0.030 . 1 . . . . 10 VAL HG1 . 11381 1 37 . 1 1 10 10 VAL HG13 H 1 0.776 0.030 . 1 . . . . 10 VAL HG1 . 11381 1 38 . 1 1 10 10 VAL HG21 H 1 0.740 0.030 . 1 . . . . 10 VAL HG2 . 11381 1 39 . 1 1 10 10 VAL HG22 H 1 0.740 0.030 . 1 . . . . 10 VAL HG2 . 11381 1 40 . 1 1 10 10 VAL HG23 H 1 0.740 0.030 . 1 . . . . 10 VAL HG2 . 11381 1 41 . 1 1 10 10 VAL C C 13 174.570 0.300 . 1 . . . . 10 VAL C . 11381 1 42 . 1 1 10 10 VAL CA C 13 60.695 0.300 . 1 . . . . 10 VAL CA . 11381 1 43 . 1 1 10 10 VAL CB C 13 34.290 0.300 . 1 . . . . 10 VAL CB . 11381 1 44 . 1 1 10 10 VAL CG1 C 13 21.517 0.300 . 2 . . . . 10 VAL CG1 . 11381 1 45 . 1 1 10 10 VAL CG2 C 13 19.606 0.300 . 2 . . . . 10 VAL CG2 . 11381 1 46 . 1 1 10 10 VAL N N 15 117.945 0.300 . 1 . . . . 10 VAL N . 11381 1 47 . 1 1 11 11 TYR H H 1 8.752 0.030 . 1 . . . . 11 TYR H . 11381 1 48 . 1 1 11 11 TYR HA H 1 4.626 0.030 . 1 . . . . 11 TYR HA . 11381 1 49 . 1 1 11 11 TYR HB2 H 1 3.022 0.030 . 2 . . . . 11 TYR HB2 . 11381 1 50 . 1 1 11 11 TYR HB3 H 1 2.746 0.030 . 2 . . . . 11 TYR HB3 . 11381 1 51 . 1 1 11 11 TYR HD1 H 1 6.994 0.030 . 1 . . . . 11 TYR HD1 . 11381 1 52 . 1 1 11 11 TYR HD2 H 1 6.994 0.030 . 1 . . . . 11 TYR HD2 . 11381 1 53 . 1 1 11 11 TYR HE1 H 1 6.784 0.030 . 1 . . . . 11 TYR HE1 . 11381 1 54 . 1 1 11 11 TYR HE2 H 1 6.784 0.030 . 1 . . . . 11 TYR HE2 . 11381 1 55 . 1 1 11 11 TYR C C 13 174.601 0.300 . 1 . . . . 11 TYR C . 11381 1 56 . 1 1 11 11 TYR CA C 13 57.381 0.300 . 1 . . . . 11 TYR CA . 11381 1 57 . 1 1 11 11 TYR CB C 13 39.426 0.300 . 1 . . . . 11 TYR CB . 11381 1 58 . 1 1 11 11 TYR CD1 C 13 133.338 0.300 . 1 . . . . 11 TYR CD1 . 11381 1 59 . 1 1 11 11 TYR CD2 C 13 133.338 0.300 . 1 . . . . 11 TYR CD2 . 11381 1 60 . 1 1 11 11 TYR CE1 C 13 118.000 0.300 . 1 . . . . 11 TYR CE1 . 11381 1 61 . 1 1 11 11 TYR CE2 C 13 118.000 0.300 . 1 . . . . 11 TYR CE2 . 11381 1 62 . 1 1 11 11 TYR N N 15 123.637 0.300 . 1 . . . . 11 TYR N . 11381 1 63 . 1 1 12 12 GLU H H 1 8.764 0.030 . 1 . . . . 12 GLU H . 11381 1 64 . 1 1 12 12 GLU HA H 1 4.919 0.030 . 1 . . . . 12 GLU HA . 11381 1 65 . 1 1 12 12 GLU HB2 H 1 1.795 0.030 . 1 . . . . 12 GLU HB2 . 11381 1 66 . 1 1 12 12 GLU HB3 H 1 1.795 0.030 . 1 . . . . 12 GLU HB3 . 11381 1 67 . 1 1 12 12 GLU HG2 H 1 1.980 0.030 . 2 . . . . 12 GLU HG2 . 11381 1 68 . 1 1 12 12 GLU HG3 H 1 1.924 0.030 . 2 . . . . 12 GLU HG3 . 11381 1 69 . 1 1 12 12 GLU C C 13 175.262 0.300 . 1 . . . . 12 GLU C . 11381 1 70 . 1 1 12 12 GLU CA C 13 54.870 0.300 . 1 . . . . 12 GLU CA . 11381 1 71 . 1 1 12 12 GLU CB C 13 32.975 0.300 . 1 . . . . 12 GLU CB . 11381 1 72 . 1 1 12 12 GLU CG C 13 36.585 0.300 . 1 . . . . 12 GLU CG . 11381 1 73 . 1 1 12 12 GLU N N 15 124.225 0.300 . 1 . . . . 12 GLU N . 11381 1 74 . 1 1 13 13 CYS H H 1 9.200 0.030 . 1 . . . . 13 CYS H . 11381 1 75 . 1 1 13 13 CYS HA H 1 4.635 0.030 . 1 . . . . 13 CYS HA . 11381 1 76 . 1 1 13 13 CYS HB2 H 1 3.369 0.030 . 2 . . . . 13 CYS HB2 . 11381 1 77 . 1 1 13 13 CYS HB3 H 1 2.897 0.030 . 2 . . . . 13 CYS HB3 . 11381 1 78 . 1 1 13 13 CYS C C 13 177.740 0.300 . 1 . . . . 13 CYS C . 11381 1 79 . 1 1 13 13 CYS CA C 13 59.672 0.300 . 1 . . . . 13 CYS CA . 11381 1 80 . 1 1 13 13 CYS CB C 13 29.638 0.300 . 1 . . . . 13 CYS CB . 11381 1 81 . 1 1 13 13 CYS N N 15 127.164 0.300 . 1 . . . . 13 CYS N . 11381 1 82 . 1 1 14 14 GLN H H 1 9.563 0.030 . 1 . . . . 14 GLN H . 11381 1 83 . 1 1 14 14 GLN HA H 1 4.169 0.030 . 1 . . . . 14 GLN HA . 11381 1 84 . 1 1 14 14 GLN HB2 H 1 2.249 0.030 . 2 . . . . 14 GLN HB2 . 11381 1 85 . 1 1 14 14 GLN HB3 H 1 2.163 0.030 . 2 . . . . 14 GLN HB3 . 11381 1 86 . 1 1 14 14 GLN HE21 H 1 7.518 0.030 . 2 . . . . 14 GLN HE21 . 11381 1 87 . 1 1 14 14 GLN HE22 H 1 6.999 0.030 . 2 . . . . 14 GLN HE22 . 11381 1 88 . 1 1 14 14 GLN HG2 H 1 2.530 0.030 . 1 . . . . 14 GLN HG2 . 11381 1 89 . 1 1 14 14 GLN HG3 H 1 2.530 0.030 . 1 . . . . 14 GLN HG3 . 11381 1 90 . 1 1 14 14 GLN C C 13 176.005 0.300 . 1 . . . . 14 GLN C . 11381 1 91 . 1 1 14 14 GLN CA C 13 57.877 0.300 . 1 . . . . 14 GLN CA . 11381 1 92 . 1 1 14 14 GLN CB C 13 28.836 0.300 . 1 . . . . 14 GLN CB . 11381 1 93 . 1 1 14 14 GLN CG C 13 34.260 0.300 . 1 . . . . 14 GLN CG . 11381 1 94 . 1 1 14 14 GLN N N 15 131.507 0.300 . 1 . . . . 14 GLN N . 11381 1 95 . 1 1 14 14 GLN NE2 N 15 113.225 0.300 . 1 . . . . 14 GLN NE2 . 11381 1 96 . 1 1 15 15 GLU H H 1 8.690 0.030 . 1 . . . . 15 GLU H . 11381 1 97 . 1 1 15 15 GLU HA H 1 4.253 0.030 . 1 . . . . 15 GLU HA . 11381 1 98 . 1 1 15 15 GLU HB2 H 1 1.372 0.030 . 2 . . . . 15 GLU HB2 . 11381 1 99 . 1 1 15 15 GLU HB3 H 1 1.287 0.030 . 2 . . . . 15 GLU HB3 . 11381 1 100 . 1 1 15 15 GLU HG2 H 1 1.842 0.030 . 2 . . . . 15 GLU HG2 . 11381 1 101 . 1 1 15 15 GLU HG3 H 1 1.748 0.030 . 2 . . . . 15 GLU HG3 . 11381 1 102 . 1 1 15 15 GLU C C 13 177.249 0.300 . 1 . . . . 15 GLU C . 11381 1 103 . 1 1 15 15 GLU CA C 13 58.063 0.300 . 1 . . . . 15 GLU CA . 11381 1 104 . 1 1 15 15 GLU CB C 13 29.656 0.300 . 1 . . . . 15 GLU CB . 11381 1 105 . 1 1 15 15 GLU CG C 13 35.252 0.300 . 1 . . . . 15 GLU CG . 11381 1 106 . 1 1 15 15 GLU N N 15 120.323 0.300 . 1 . . . . 15 GLU N . 11381 1 107 . 1 1 16 16 CYS H H 1 8.071 0.030 . 1 . . . . 16 CYS H . 11381 1 108 . 1 1 16 16 CYS HA H 1 5.185 0.030 . 1 . . . . 16 CYS HA . 11381 1 109 . 1 1 16 16 CYS HB2 H 1 3.455 0.030 . 2 . . . . 16 CYS HB2 . 11381 1 110 . 1 1 16 16 CYS HB3 H 1 2.829 0.030 . 2 . . . . 16 CYS HB3 . 11381 1 111 . 1 1 16 16 CYS C C 13 176.385 0.300 . 1 . . . . 16 CYS C . 11381 1 112 . 1 1 16 16 CYS CA C 13 58.445 0.300 . 1 . . . . 16 CYS CA . 11381 1 113 . 1 1 16 16 CYS CB C 13 32.624 0.300 . 1 . . . . 16 CYS CB . 11381 1 114 . 1 1 16 16 CYS N N 15 114.992 0.300 . 1 . . . . 16 CYS N . 11381 1 115 . 1 1 17 17 GLY H H 1 8.082 0.030 . 1 . . . . 17 GLY H . 11381 1 116 . 1 1 17 17 GLY HA2 H 1 4.221 0.030 . 2 . . . . 17 GLY HA2 . 11381 1 117 . 1 1 17 17 GLY HA3 H 1 3.887 0.030 . 2 . . . . 17 GLY HA3 . 11381 1 118 . 1 1 17 17 GLY C C 13 173.742 0.300 . 1 . . . . 17 GLY C . 11381 1 119 . 1 1 17 17 GLY CA C 13 46.234 0.300 . 1 . . . . 17 GLY CA . 11381 1 120 . 1 1 17 17 GLY N N 15 113.159 0.300 . 1 . . . . 17 GLY N . 11381 1 121 . 1 1 18 18 LYS H H 1 7.976 0.030 . 1 . . . . 18 LYS H . 11381 1 122 . 1 1 18 18 LYS HA H 1 4.007 0.030 . 1 . . . . 18 LYS HA . 11381 1 123 . 1 1 18 18 LYS HB2 H 1 1.212 0.030 . 2 . . . . 18 LYS HB2 . 11381 1 124 . 1 1 18 18 LYS HB3 H 1 1.450 0.030 . 2 . . . . 18 LYS HB3 . 11381 1 125 . 1 1 18 18 LYS HD2 H 1 1.524 0.030 . 2 . . . . 18 LYS HD2 . 11381 1 126 . 1 1 18 18 LYS HD3 H 1 1.458 0.030 . 2 . . . . 18 LYS HD3 . 11381 1 127 . 1 1 18 18 LYS HE2 H 1 3.003 0.030 . 2 . . . . 18 LYS HE2 . 11381 1 128 . 1 1 18 18 LYS HE3 H 1 2.919 0.030 . 2 . . . . 18 LYS HE3 . 11381 1 129 . 1 1 18 18 LYS HG2 H 1 1.105 0.030 . 2 . . . . 18 LYS HG2 . 11381 1 130 . 1 1 18 18 LYS HG3 H 1 1.403 0.030 . 2 . . . . 18 LYS HG3 . 11381 1 131 . 1 1 18 18 LYS C C 13 174.417 0.300 . 1 . . . . 18 LYS C . 11381 1 132 . 1 1 18 18 LYS CA C 13 58.141 0.300 . 1 . . . . 18 LYS CA . 11381 1 133 . 1 1 18 18 LYS CB C 13 33.540 0.300 . 1 . . . . 18 LYS CB . 11381 1 134 . 1 1 18 18 LYS CD C 13 29.267 0.300 . 1 . . . . 18 LYS CD . 11381 1 135 . 1 1 18 18 LYS CE C 13 42.219 0.300 . 1 . . . . 18 LYS CE . 11381 1 136 . 1 1 18 18 LYS CG C 13 26.149 0.300 . 1 . . . . 18 LYS CG . 11381 1 137 . 1 1 18 18 LYS N N 15 123.158 0.300 . 1 . . . . 18 LYS N . 11381 1 138 . 1 1 19 19 SER H H 1 7.901 0.030 . 1 . . . . 19 SER H . 11381 1 139 . 1 1 19 19 SER HA H 1 5.203 0.030 . 1 . . . . 19 SER HA . 11381 1 140 . 1 1 19 19 SER HB2 H 1 3.582 0.030 . 1 . . . . 19 SER HB2 . 11381 1 141 . 1 1 19 19 SER HB3 H 1 3.582 0.030 . 1 . . . . 19 SER HB3 . 11381 1 142 . 1 1 19 19 SER C C 13 173.173 0.300 . 1 . . . . 19 SER C . 11381 1 143 . 1 1 19 19 SER CA C 13 56.883 0.300 . 1 . . . . 19 SER CA . 11381 1 144 . 1 1 19 19 SER CB C 13 65.956 0.300 . 1 . . . . 19 SER CB . 11381 1 145 . 1 1 19 19 SER N N 15 115.953 0.300 . 1 . . . . 19 SER N . 11381 1 146 . 1 1 20 20 PHE H H 1 8.780 0.030 . 1 . . . . 20 PHE H . 11381 1 147 . 1 1 20 20 PHE HA H 1 4.781 0.030 . 1 . . . . 20 PHE HA . 11381 1 148 . 1 1 20 20 PHE HB2 H 1 2.729 0.030 . 2 . . . . 20 PHE HB2 . 11381 1 149 . 1 1 20 20 PHE HB3 H 1 3.426 0.030 . 2 . . . . 20 PHE HB3 . 11381 1 150 . 1 1 20 20 PHE HD1 H 1 7.271 0.030 . 1 . . . . 20 PHE HD1 . 11381 1 151 . 1 1 20 20 PHE HD2 H 1 7.271 0.030 . 1 . . . . 20 PHE HD2 . 11381 1 152 . 1 1 20 20 PHE HE1 H 1 6.879 0.030 . 1 . . . . 20 PHE HE1 . 11381 1 153 . 1 1 20 20 PHE HE2 H 1 6.879 0.030 . 1 . . . . 20 PHE HE2 . 11381 1 154 . 1 1 20 20 PHE HZ H 1 6.392 0.030 . 1 . . . . 20 PHE HZ . 11381 1 155 . 1 1 20 20 PHE C C 13 175.351 0.300 . 1 . . . . 20 PHE C . 11381 1 156 . 1 1 20 20 PHE CA C 13 57.161 0.300 . 1 . . . . 20 PHE CA . 11381 1 157 . 1 1 20 20 PHE CB C 13 43.887 0.300 . 1 . . . . 20 PHE CB . 11381 1 158 . 1 1 20 20 PHE CD1 C 13 132.506 0.300 . 1 . . . . 20 PHE CD1 . 11381 1 159 . 1 1 20 20 PHE CD2 C 13 132.506 0.300 . 1 . . . . 20 PHE CD2 . 11381 1 160 . 1 1 20 20 PHE CE1 C 13 130.678 0.300 . 1 . . . . 20 PHE CE1 . 11381 1 161 . 1 1 20 20 PHE CE2 C 13 130.678 0.300 . 1 . . . . 20 PHE CE2 . 11381 1 162 . 1 1 20 20 PHE CZ C 13 128.811 0.300 . 1 . . . . 20 PHE CZ . 11381 1 163 . 1 1 20 20 PHE N N 15 119.075 0.300 . 1 . . . . 20 PHE N . 11381 1 164 . 1 1 21 21 ARG HA H 1 4.658 0.030 . 1 . . . . 21 ARG HA . 11381 1 165 . 1 1 21 21 ARG HB2 H 1 1.943 0.030 . 2 . . . . 21 ARG HB2 . 11381 1 166 . 1 1 21 21 ARG HB3 H 1 2.138 0.030 . 2 . . . . 21 ARG HB3 . 11381 1 167 . 1 1 21 21 ARG HD2 H 1 3.280 0.030 . 1 . . . . 21 ARG HD2 . 11381 1 168 . 1 1 21 21 ARG HD3 H 1 3.280 0.030 . 1 . . . . 21 ARG HD3 . 11381 1 169 . 1 1 21 21 ARG HG2 H 1 1.854 0.030 . 2 . . . . 21 ARG HG2 . 11381 1 170 . 1 1 21 21 ARG HG3 H 1 1.750 0.030 . 2 . . . . 21 ARG HG3 . 11381 1 171 . 1 1 21 21 ARG C C 13 175.938 0.300 . 1 . . . . 21 ARG C . 11381 1 172 . 1 1 21 21 ARG CA C 13 57.087 0.300 . 1 . . . . 21 ARG CA . 11381 1 173 . 1 1 21 21 ARG CB C 13 30.999 0.300 . 1 . . . . 21 ARG CB . 11381 1 174 . 1 1 21 21 ARG CD C 13 43.165 0.300 . 1 . . . . 21 ARG CD . 11381 1 175 . 1 1 21 21 ARG CG C 13 27.925 0.300 . 1 . . . . 21 ARG CG . 11381 1 176 . 1 1 22 22 GLN H H 1 7.544 0.030 . 1 . . . . 22 GLN H . 11381 1 177 . 1 1 22 22 GLN HA H 1 4.749 0.030 . 1 . . . . 22 GLN HA . 11381 1 178 . 1 1 22 22 GLN HB2 H 1 2.055 0.030 . 2 . . . . 22 GLN HB2 . 11381 1 179 . 1 1 22 22 GLN HB3 H 1 2.230 0.030 . 2 . . . . 22 GLN HB3 . 11381 1 180 . 1 1 22 22 GLN HE21 H 1 6.952 0.030 . 2 . . . . 22 GLN HE21 . 11381 1 181 . 1 1 22 22 GLN HE22 H 1 7.575 0.030 . 2 . . . . 22 GLN HE22 . 11381 1 182 . 1 1 22 22 GLN HG2 H 1 2.433 0.030 . 1 . . . . 22 GLN HG2 . 11381 1 183 . 1 1 22 22 GLN HG3 H 1 2.433 0.030 . 1 . . . . 22 GLN HG3 . 11381 1 184 . 1 1 22 22 GLN C C 13 175.829 0.300 . 1 . . . . 22 GLN C . 11381 1 185 . 1 1 22 22 GLN CA C 13 54.080 0.300 . 1 . . . . 22 GLN CA . 11381 1 186 . 1 1 22 22 GLN CB C 13 31.335 0.300 . 1 . . . . 22 GLN CB . 11381 1 187 . 1 1 22 22 GLN CG C 13 33.750 0.300 . 1 . . . . 22 GLN CG . 11381 1 188 . 1 1 22 22 GLN N N 15 114.301 0.300 . 1 . . . . 22 GLN N . 11381 1 189 . 1 1 22 22 GLN NE2 N 15 112.315 0.300 . 1 . . . . 22 GLN NE2 . 11381 1 190 . 1 1 23 23 LYS H H 1 8.563 0.030 . 1 . . . . 23 LYS H . 11381 1 191 . 1 1 23 23 LYS HA H 1 3.012 0.030 . 1 . . . . 23 LYS HA . 11381 1 192 . 1 1 23 23 LYS HB2 H 1 1.453 0.030 . 2 . . . . 23 LYS HB2 . 11381 1 193 . 1 1 23 23 LYS HB3 H 1 1.040 0.030 . 2 . . . . 23 LYS HB3 . 11381 1 194 . 1 1 23 23 LYS HD2 H 1 1.576 0.030 . 2 . . . . 23 LYS HD2 . 11381 1 195 . 1 1 23 23 LYS HD3 H 1 1.464 0.030 . 2 . . . . 23 LYS HD3 . 11381 1 196 . 1 1 23 23 LYS HE2 H 1 2.878 0.030 . 1 . . . . 23 LYS HE2 . 11381 1 197 . 1 1 23 23 LYS HE3 H 1 2.878 0.030 . 1 . . . . 23 LYS HE3 . 11381 1 198 . 1 1 23 23 LYS HG2 H 1 1.179 0.030 . 2 . . . . 23 LYS HG2 . 11381 1 199 . 1 1 23 23 LYS HG3 H 1 1.009 0.030 . 2 . . . . 23 LYS HG3 . 11381 1 200 . 1 1 23 23 LYS C C 13 178.561 0.300 . 1 . . . . 23 LYS C . 11381 1 201 . 1 1 23 23 LYS CA C 13 59.252 0.300 . 1 . . . . 23 LYS CA . 11381 1 202 . 1 1 23 23 LYS CB C 13 31.724 0.300 . 1 . . . . 23 LYS CB . 11381 1 203 . 1 1 23 23 LYS CD C 13 28.816 0.300 . 1 . . . . 23 LYS CD . 11381 1 204 . 1 1 23 23 LYS CE C 13 42.224 0.300 . 1 . . . . 23 LYS CE . 11381 1 205 . 1 1 23 23 LYS CG C 13 24.746 0.300 . 1 . . . . 23 LYS CG . 11381 1 206 . 1 1 23 23 LYS N N 15 126.738 0.300 . 1 . . . . 23 LYS N . 11381 1 207 . 1 1 24 24 GLY HA2 H 1 3.736 0.030 . 2 . . . . 24 GLY HA2 . 11381 1 208 . 1 1 24 24 GLY HA3 H 1 3.830 0.030 . 2 . . . . 24 GLY HA3 . 11381 1 209 . 1 1 24 24 GLY C C 13 176.660 0.300 . 1 . . . . 24 GLY C . 11381 1 210 . 1 1 24 24 GLY CA C 13 46.899 0.300 . 1 . . . . 24 GLY CA . 11381 1 211 . 1 1 25 25 SER H H 1 7.026 0.030 . 1 . . . . 25 SER H . 11381 1 212 . 1 1 25 25 SER HA H 1 4.191 0.030 . 1 . . . . 25 SER HA . 11381 1 213 . 1 1 25 25 SER HB2 H 1 4.002 0.030 . 2 . . . . 25 SER HB2 . 11381 1 214 . 1 1 25 25 SER HB3 H 1 3.922 0.030 . 2 . . . . 25 SER HB3 . 11381 1 215 . 1 1 25 25 SER C C 13 176.137 0.300 . 1 . . . . 25 SER C . 11381 1 216 . 1 1 25 25 SER CA C 13 60.933 0.300 . 1 . . . . 25 SER CA . 11381 1 217 . 1 1 25 25 SER CB C 13 62.547 0.300 . 1 . . . . 25 SER CB . 11381 1 218 . 1 1 25 25 SER N N 15 115.603 0.300 . 1 . . . . 25 SER N . 11381 1 219 . 1 1 26 26 LEU H H 1 6.991 0.030 . 1 . . . . 26 LEU H . 11381 1 220 . 1 1 26 26 LEU HA H 1 3.316 0.030 . 1 . . . . 26 LEU HA . 11381 1 221 . 1 1 26 26 LEU HB2 H 1 2.075 0.030 . 2 . . . . 26 LEU HB2 . 11381 1 222 . 1 1 26 26 LEU HB3 H 1 1.221 0.030 . 2 . . . . 26 LEU HB3 . 11381 1 223 . 1 1 26 26 LEU HD11 H 1 0.992 0.030 . 1 . . . . 26 LEU HD1 . 11381 1 224 . 1 1 26 26 LEU HD12 H 1 0.992 0.030 . 1 . . . . 26 LEU HD1 . 11381 1 225 . 1 1 26 26 LEU HD13 H 1 0.992 0.030 . 1 . . . . 26 LEU HD1 . 11381 1 226 . 1 1 26 26 LEU HD21 H 1 1.062 0.030 . 1 . . . . 26 LEU HD2 . 11381 1 227 . 1 1 26 26 LEU HD22 H 1 1.062 0.030 . 1 . . . . 26 LEU HD2 . 11381 1 228 . 1 1 26 26 LEU HD23 H 1 1.062 0.030 . 1 . . . . 26 LEU HD2 . 11381 1 229 . 1 1 26 26 LEU HG H 1 1.585 0.030 . 1 . . . . 26 LEU HG . 11381 1 230 . 1 1 26 26 LEU C C 13 177.359 0.300 . 1 . . . . 26 LEU C . 11381 1 231 . 1 1 26 26 LEU CA C 13 57.938 0.300 . 1 . . . . 26 LEU CA . 11381 1 232 . 1 1 26 26 LEU CB C 13 39.670 0.300 . 1 . . . . 26 LEU CB . 11381 1 233 . 1 1 26 26 LEU CD1 C 13 26.906 0.300 . 2 . . . . 26 LEU CD1 . 11381 1 234 . 1 1 26 26 LEU CD2 C 13 22.840 0.300 . 2 . . . . 26 LEU CD2 . 11381 1 235 . 1 1 26 26 LEU CG C 13 27.463 0.300 . 1 . . . . 26 LEU CG . 11381 1 236 . 1 1 26 26 LEU N N 15 124.572 0.300 . 1 . . . . 26 LEU N . 11381 1 237 . 1 1 27 27 THR H H 1 8.325 0.030 . 1 . . . . 27 THR H . 11381 1 238 . 1 1 27 27 THR HA H 1 3.952 0.030 . 1 . . . . 27 THR HA . 11381 1 239 . 1 1 27 27 THR HB H 1 4.084 0.030 . 1 . . . . 27 THR HB . 11381 1 240 . 1 1 27 27 THR HG21 H 1 1.200 0.030 . 1 . . . . 27 THR HG2 . 11381 1 241 . 1 1 27 27 THR HG22 H 1 1.200 0.030 . 1 . . . . 27 THR HG2 . 11381 1 242 . 1 1 27 27 THR HG23 H 1 1.200 0.030 . 1 . . . . 27 THR HG2 . 11381 1 243 . 1 1 27 27 THR C C 13 176.766 0.300 . 1 . . . . 27 THR C . 11381 1 244 . 1 1 27 27 THR CA C 13 66.393 0.300 . 1 . . . . 27 THR CA . 11381 1 245 . 1 1 27 27 THR CB C 13 68.558 0.300 . 1 . . . . 27 THR CB . 11381 1 246 . 1 1 27 27 THR CG2 C 13 22.176 0.300 . 1 . . . . 27 THR CG2 . 11381 1 247 . 1 1 27 27 THR N N 15 116.148 0.300 . 1 . . . . 27 THR N . 11381 1 248 . 1 1 28 28 LEU H H 1 7.338 0.030 . 1 . . . . 28 LEU H . 11381 1 249 . 1 1 28 28 LEU HA H 1 4.001 0.030 . 1 . . . . 28 LEU HA . 11381 1 250 . 1 1 28 28 LEU HB2 H 1 1.545 0.030 . 2 . . . . 28 LEU HB2 . 11381 1 251 . 1 1 28 28 LEU HB3 H 1 1.654 0.030 . 2 . . . . 28 LEU HB3 . 11381 1 252 . 1 1 28 28 LEU HD11 H 1 0.872 0.030 . 1 . . . . 28 LEU HD1 . 11381 1 253 . 1 1 28 28 LEU HD12 H 1 0.872 0.030 . 1 . . . . 28 LEU HD1 . 11381 1 254 . 1 1 28 28 LEU HD13 H 1 0.872 0.030 . 1 . . . . 28 LEU HD1 . 11381 1 255 . 1 1 28 28 LEU HD21 H 1 0.842 0.030 . 1 . . . . 28 LEU HD2 . 11381 1 256 . 1 1 28 28 LEU HD22 H 1 0.842 0.030 . 1 . . . . 28 LEU HD2 . 11381 1 257 . 1 1 28 28 LEU HD23 H 1 0.842 0.030 . 1 . . . . 28 LEU HD2 . 11381 1 258 . 1 1 28 28 LEU HG H 1 1.661 0.030 . 1 . . . . 28 LEU HG . 11381 1 259 . 1 1 28 28 LEU C C 13 179.433 0.300 . 1 . . . . 28 LEU C . 11381 1 260 . 1 1 28 28 LEU CA C 13 57.888 0.300 . 1 . . . . 28 LEU CA . 11381 1 261 . 1 1 28 28 LEU CB C 13 42.023 0.300 . 1 . . . . 28 LEU CB . 11381 1 262 . 1 1 28 28 LEU CD1 C 13 24.681 0.300 . 2 . . . . 28 LEU CD1 . 11381 1 263 . 1 1 28 28 LEU CD2 C 13 23.420 0.300 . 2 . . . . 28 LEU CD2 . 11381 1 264 . 1 1 28 28 LEU CG C 13 26.982 0.300 . 1 . . . . 28 LEU CG . 11381 1 265 . 1 1 28 28 LEU N N 15 119.463 0.300 . 1 . . . . 28 LEU N . 11381 1 266 . 1 1 29 29 HIS H H 1 7.496 0.030 . 1 . . . . 29 HIS H . 11381 1 267 . 1 1 29 29 HIS HA H 1 4.168 0.030 . 1 . . . . 29 HIS HA . 11381 1 268 . 1 1 29 29 HIS HB2 H 1 2.953 0.030 . 2 . . . . 29 HIS HB2 . 11381 1 269 . 1 1 29 29 HIS HB3 H 1 3.240 0.030 . 2 . . . . 29 HIS HB3 . 11381 1 270 . 1 1 29 29 HIS HD2 H 1 7.017 0.030 . 1 . . . . 29 HIS HD2 . 11381 1 271 . 1 1 29 29 HIS HE1 H 1 8.032 0.030 . 1 . . . . 29 HIS HE1 . 11381 1 272 . 1 1 29 29 HIS C C 13 176.236 0.300 . 1 . . . . 29 HIS C . 11381 1 273 . 1 1 29 29 HIS CA C 13 59.409 0.300 . 1 . . . . 29 HIS CA . 11381 1 274 . 1 1 29 29 HIS CB C 13 28.730 0.300 . 1 . . . . 29 HIS CB . 11381 1 275 . 1 1 29 29 HIS CD2 C 13 127.394 0.300 . 1 . . . . 29 HIS CD2 . 11381 1 276 . 1 1 29 29 HIS CE1 C 13 139.553 0.300 . 1 . . . . 29 HIS CE1 . 11381 1 277 . 1 1 29 29 HIS N N 15 119.747 0.300 . 1 . . . . 29 HIS N . 11381 1 278 . 1 1 30 30 GLU H H 1 8.575 0.030 . 1 . . . . 30 GLU H . 11381 1 279 . 1 1 30 30 GLU HA H 1 3.697 0.030 . 1 . . . . 30 GLU HA . 11381 1 280 . 1 1 30 30 GLU HB2 H 1 2.299 0.030 . 2 . . . . 30 GLU HB2 . 11381 1 281 . 1 1 30 30 GLU HB3 H 1 2.157 0.030 . 2 . . . . 30 GLU HB3 . 11381 1 282 . 1 1 30 30 GLU HG2 H 1 2.747 0.030 . 2 . . . . 30 GLU HG2 . 11381 1 283 . 1 1 30 30 GLU HG3 H 1 2.638 0.030 . 2 . . . . 30 GLU HG3 . 11381 1 284 . 1 1 30 30 GLU C C 13 178.027 0.300 . 1 . . . . 30 GLU C . 11381 1 285 . 1 1 30 30 GLU CA C 13 59.892 0.300 . 1 . . . . 30 GLU CA . 11381 1 286 . 1 1 30 30 GLU CB C 13 29.902 0.300 . 1 . . . . 30 GLU CB . 11381 1 287 . 1 1 30 30 GLU CG C 13 37.830 0.300 . 1 . . . . 30 GLU CG . 11381 1 288 . 1 1 30 30 GLU N N 15 116.256 0.300 . 1 . . . . 30 GLU N . 11381 1 289 . 1 1 31 31 ARG H H 1 7.082 0.030 . 1 . . . . 31 ARG H . 11381 1 290 . 1 1 31 31 ARG HA H 1 4.141 0.030 . 1 . . . . 31 ARG HA . 11381 1 291 . 1 1 31 31 ARG HB2 H 1 1.897 0.030 . 2 . . . . 31 ARG HB2 . 11381 1 292 . 1 1 31 31 ARG HB3 H 1 1.808 0.030 . 2 . . . . 31 ARG HB3 . 11381 1 293 . 1 1 31 31 ARG HD2 H 1 3.202 0.030 . 1 . . . . 31 ARG HD2 . 11381 1 294 . 1 1 31 31 ARG HD3 H 1 3.202 0.030 . 1 . . . . 31 ARG HD3 . 11381 1 295 . 1 1 31 31 ARG HG2 H 1 1.723 0.030 . 2 . . . . 31 ARG HG2 . 11381 1 296 . 1 1 31 31 ARG HG3 H 1 1.887 0.030 . 2 . . . . 31 ARG HG3 . 11381 1 297 . 1 1 31 31 ARG C C 13 178.665 0.300 . 1 . . . . 31 ARG C . 11381 1 298 . 1 1 31 31 ARG CA C 13 58.263 0.300 . 1 . . . . 31 ARG CA . 11381 1 299 . 1 1 31 31 ARG CB C 13 30.174 0.300 . 1 . . . . 31 ARG CB . 11381 1 300 . 1 1 31 31 ARG CD C 13 43.622 0.300 . 1 . . . . 31 ARG CD . 11381 1 301 . 1 1 31 31 ARG CG C 13 27.215 0.300 . 1 . . . . 31 ARG CG . 11381 1 302 . 1 1 31 31 ARG N N 15 116.796 0.300 . 1 . . . . 31 ARG N . 11381 1 303 . 1 1 32 32 ILE H H 1 7.903 0.030 . 1 . . . . 32 ILE H . 11381 1 304 . 1 1 32 32 ILE HA H 1 3.976 0.030 . 1 . . . . 32 ILE HA . 11381 1 305 . 1 1 32 32 ILE HB H 1 1.691 0.030 . 1 . . . . 32 ILE HB . 11381 1 306 . 1 1 32 32 ILE HD11 H 1 0.702 0.030 . 1 . . . . 32 ILE HD1 . 11381 1 307 . 1 1 32 32 ILE HD12 H 1 0.702 0.030 . 1 . . . . 32 ILE HD1 . 11381 1 308 . 1 1 32 32 ILE HD13 H 1 0.702 0.030 . 1 . . . . 32 ILE HD1 . 11381 1 309 . 1 1 32 32 ILE HG12 H 1 0.935 0.030 . 2 . . . . 32 ILE HG12 . 11381 1 310 . 1 1 32 32 ILE HG13 H 1 0.709 0.030 . 2 . . . . 32 ILE HG13 . 11381 1 311 . 1 1 32 32 ILE HG21 H 1 0.579 0.030 . 1 . . . . 32 ILE HG2 . 11381 1 312 . 1 1 32 32 ILE HG22 H 1 0.579 0.030 . 1 . . . . 32 ILE HG2 . 11381 1 313 . 1 1 32 32 ILE HG23 H 1 0.579 0.030 . 1 . . . . 32 ILE HG2 . 11381 1 314 . 1 1 32 32 ILE C C 13 177.295 0.300 . 1 . . . . 32 ILE C . 11381 1 315 . 1 1 32 32 ILE CA C 13 63.085 0.300 . 1 . . . . 32 ILE CA . 11381 1 316 . 1 1 32 32 ILE CB C 13 37.708 0.300 . 1 . . . . 32 ILE CB . 11381 1 317 . 1 1 32 32 ILE CD1 C 13 14.463 0.300 . 1 . . . . 32 ILE CD1 . 11381 1 318 . 1 1 32 32 ILE CG1 C 13 26.573 0.300 . 1 . . . . 32 ILE CG1 . 11381 1 319 . 1 1 32 32 ILE CG2 C 13 16.469 0.300 . 1 . . . . 32 ILE CG2 . 11381 1 320 . 1 1 32 32 ILE N N 15 116.261 0.300 . 1 . . . . 32 ILE N . 11381 1 321 . 1 1 33 33 HIS H H 1 7.235 0.030 . 1 . . . . 33 HIS H . 11381 1 322 . 1 1 33 33 HIS HA H 1 4.859 0.030 . 1 . . . . 33 HIS HA . 11381 1 323 . 1 1 33 33 HIS HB2 H 1 3.366 0.030 . 2 . . . . 33 HIS HB2 . 11381 1 324 . 1 1 33 33 HIS HB3 H 1 3.260 0.030 . 2 . . . . 33 HIS HB3 . 11381 1 325 . 1 1 33 33 HIS HD2 H 1 6.789 0.030 . 1 . . . . 33 HIS HD2 . 11381 1 326 . 1 1 33 33 HIS HE1 H 1 8.070 0.030 . 1 . . . . 33 HIS HE1 . 11381 1 327 . 1 1 33 33 HIS C C 13 175.527 0.300 . 1 . . . . 33 HIS C . 11381 1 328 . 1 1 33 33 HIS CA C 13 55.184 0.300 . 1 . . . . 33 HIS CA . 11381 1 329 . 1 1 33 33 HIS CB C 13 28.588 0.300 . 1 . . . . 33 HIS CB . 11381 1 330 . 1 1 33 33 HIS CD2 C 13 127.882 0.300 . 1 . . . . 33 HIS CD2 . 11381 1 331 . 1 1 33 33 HIS CE1 C 13 140.037 0.300 . 1 . . . . 33 HIS CE1 . 11381 1 332 . 1 1 33 33 HIS N N 15 117.759 0.300 . 1 . . . . 33 HIS N . 11381 1 333 . 1 1 34 34 THR H H 1 7.759 0.030 . 1 . . . . 34 THR H . 11381 1 334 . 1 1 34 34 THR HA H 1 4.391 0.030 . 1 . . . . 34 THR HA . 11381 1 335 . 1 1 34 34 THR HB H 1 4.329 0.030 . 1 . . . . 34 THR HB . 11381 1 336 . 1 1 34 34 THR HG21 H 1 1.256 0.030 . 1 . . . . 34 THR HG2 . 11381 1 337 . 1 1 34 34 THR HG22 H 1 1.256 0.030 . 1 . . . . 34 THR HG2 . 11381 1 338 . 1 1 34 34 THR HG23 H 1 1.256 0.030 . 1 . . . . 34 THR HG2 . 11381 1 339 . 1 1 34 34 THR C C 13 175.382 0.300 . 1 . . . . 34 THR C . 11381 1 340 . 1 1 34 34 THR CA C 13 62.376 0.300 . 1 . . . . 34 THR CA . 11381 1 341 . 1 1 34 34 THR CB C 13 69.950 0.300 . 1 . . . . 34 THR CB . 11381 1 342 . 1 1 34 34 THR CG2 C 13 21.585 0.300 . 1 . . . . 34 THR CG2 . 11381 1 343 . 1 1 34 34 THR N N 15 111.730 0.300 . 1 . . . . 34 THR N . 11381 1 344 . 1 1 35 35 GLY H H 1 8.308 0.030 . 1 . . . . 35 GLY H . 11381 1 345 . 1 1 35 35 GLY HA2 H 1 4.152 0.030 . 2 . . . . 35 GLY HA2 . 11381 1 346 . 1 1 35 35 GLY HA3 H 1 4.098 0.030 . 2 . . . . 35 GLY HA3 . 11381 1 347 . 1 1 35 35 GLY C C 13 171.702 0.300 . 1 . . . . 35 GLY C . 11381 1 348 . 1 1 35 35 GLY CA C 13 44.729 0.300 . 1 . . . . 35 GLY CA . 11381 1 349 . 1 1 35 35 GLY N N 15 110.799 0.300 . 1 . . . . 35 GLY N . 11381 1 350 . 1 1 38 38 PRO HA H 1 4.484 0.030 . 1 . . . . 38 PRO HA . 11381 1 351 . 1 1 38 38 PRO HB2 H 1 2.300 0.030 . 2 . . . . 38 PRO HB2 . 11381 1 352 . 1 1 38 38 PRO HB3 H 1 1.986 0.030 . 2 . . . . 38 PRO HB3 . 11381 1 353 . 1 1 38 38 PRO HD2 H 1 3.634 0.030 . 1 . . . . 38 PRO HD2 . 11381 1 354 . 1 1 38 38 PRO HD3 H 1 3.634 0.030 . 1 . . . . 38 PRO HD3 . 11381 1 355 . 1 1 38 38 PRO HG2 H 1 2.024 0.030 . 1 . . . . 38 PRO HG2 . 11381 1 356 . 1 1 38 38 PRO HG3 H 1 2.024 0.030 . 1 . . . . 38 PRO HG3 . 11381 1 357 . 1 1 38 38 PRO C C 13 177.346 0.300 . 1 . . . . 38 PRO C . 11381 1 358 . 1 1 38 38 PRO CA C 13 63.272 0.300 . 1 . . . . 38 PRO CA . 11381 1 359 . 1 1 38 38 PRO CB C 13 32.229 0.300 . 1 . . . . 38 PRO CB . 11381 1 360 . 1 1 38 38 PRO CD C 13 49.810 0.300 . 1 . . . . 38 PRO CD . 11381 1 361 . 1 1 38 38 PRO CG C 13 27.194 0.300 . 1 . . . . 38 PRO CG . 11381 1 362 . 1 1 39 39 SER H H 1 8.517 0.030 . 1 . . . . 39 SER H . 11381 1 363 . 1 1 39 39 SER HA H 1 4.531 0.030 . 1 . . . . 39 SER HA . 11381 1 364 . 1 1 39 39 SER HB2 H 1 3.877 0.030 . 2 . . . . 39 SER HB2 . 11381 1 365 . 1 1 39 39 SER HB3 H 1 3.918 0.030 . 2 . . . . 39 SER HB3 . 11381 1 366 . 1 1 39 39 SER C C 13 174.631 0.300 . 1 . . . . 39 SER C . 11381 1 367 . 1 1 39 39 SER CA C 13 58.410 0.300 . 1 . . . . 39 SER CA . 11381 1 368 . 1 1 39 39 SER CB C 13 63.988 0.300 . 1 . . . . 39 SER CB . 11381 1 369 . 1 1 39 39 SER N N 15 116.389 0.300 . 1 . . . . 39 SER N . 11381 1 stop_ save_