################################### # 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 11382 _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 11382 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11382 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 . . 11382 1 2 $NMRPipe . . 11382 1 3 $NMRView . . 11382 1 4 $Kujira . . 11382 1 5 $CYANA . . 11382 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 8 8 THR HA H 1 4.380 0.030 . 1 . . . . 8 THR HA . 11382 1 2 . 1 1 8 8 THR CA C 13 61.958 0.300 . 1 . . . . 8 THR CA . 11382 1 3 . 1 1 8 8 THR CB C 13 69.773 0.300 . 1 . . . . 8 THR CB . 11382 1 4 . 1 1 9 9 GLY HA2 H 1 3.946 0.030 . 1 . . . . 9 GLY HA2 . 11382 1 5 . 1 1 9 9 GLY HA3 H 1 3.946 0.030 . 1 . . . . 9 GLY HA3 . 11382 1 6 . 1 1 9 9 GLY C C 13 173.909 0.300 . 1 . . . . 9 GLY C . 11382 1 7 . 1 1 9 9 GLY CA C 13 45.463 0.300 . 1 . . . . 9 GLY CA . 11382 1 8 . 1 1 10 10 GLN H H 1 8.181 0.030 . 1 . . . . 10 GLN H . 11382 1 9 . 1 1 10 10 GLN HA H 1 4.271 0.030 . 1 . . . . 10 GLN HA . 11382 1 10 . 1 1 10 10 GLN HB2 H 1 1.942 0.030 . 2 . . . . 10 GLN HB2 . 11382 1 11 . 1 1 10 10 GLN HB3 H 1 2.055 0.030 . 2 . . . . 10 GLN HB3 . 11382 1 12 . 1 1 10 10 GLN HG2 H 1 2.329 0.030 . 1 . . . . 10 GLN HG2 . 11382 1 13 . 1 1 10 10 GLN HG3 H 1 2.329 0.030 . 1 . . . . 10 GLN HG3 . 11382 1 14 . 1 1 10 10 GLN C C 13 175.800 0.300 . 1 . . . . 10 GLN C . 11382 1 15 . 1 1 10 10 GLN CA C 13 55.882 0.300 . 1 . . . . 10 GLN CA . 11382 1 16 . 1 1 10 10 GLN CB C 13 29.638 0.300 . 1 . . . . 10 GLN CB . 11382 1 17 . 1 1 10 10 GLN CG C 13 33.882 0.300 . 1 . . . . 10 GLN CG . 11382 1 18 . 1 1 10 10 GLN N N 15 119.714 0.300 . 1 . . . . 10 GLN N . 11382 1 19 . 1 1 10 10 GLN NE2 N 15 111.000 0.300 . 1 . . . . 10 GLN NE2 . 11382 1 20 . 1 1 11 11 LYS H H 1 8.333 0.030 . 1 . . . . 11 LYS H . 11382 1 21 . 1 1 11 11 LYS HA H 1 4.519 0.030 . 1 . . . . 11 LYS HA . 11382 1 22 . 1 1 11 11 LYS HB2 H 1 1.615 0.030 . 1 . . . . 11 LYS HB2 . 11382 1 23 . 1 1 11 11 LYS HB3 H 1 1.615 0.030 . 1 . . . . 11 LYS HB3 . 11382 1 24 . 1 1 11 11 LYS HD2 H 1 1.588 0.030 . 1 . . . . 11 LYS HD2 . 11382 1 25 . 1 1 11 11 LYS HD3 H 1 1.588 0.030 . 1 . . . . 11 LYS HD3 . 11382 1 26 . 1 1 11 11 LYS HE2 H 1 2.939 0.030 . 1 . . . . 11 LYS HE2 . 11382 1 27 . 1 1 11 11 LYS HE3 H 1 2.939 0.030 . 1 . . . . 11 LYS HE3 . 11382 1 28 . 1 1 11 11 LYS HG2 H 1 1.292 0.030 . 2 . . . . 11 LYS HG2 . 11382 1 29 . 1 1 11 11 LYS HG3 H 1 1.395 0.030 . 2 . . . . 11 LYS HG3 . 11382 1 30 . 1 1 11 11 LYS C C 13 174.273 0.300 . 1 . . . . 11 LYS C . 11382 1 31 . 1 1 11 11 LYS CA C 13 54.181 0.300 . 1 . . . . 11 LYS CA . 11382 1 32 . 1 1 11 11 LYS CB C 13 32.569 0.300 . 1 . . . . 11 LYS CB . 11382 1 33 . 1 1 11 11 LYS CD C 13 29.280 0.300 . 1 . . . . 11 LYS CD . 11382 1 34 . 1 1 11 11 LYS CE C 13 42.137 0.300 . 1 . . . . 11 LYS CE . 11382 1 35 . 1 1 11 11 LYS CG C 13 24.761 0.300 . 1 . . . . 11 LYS CG . 11382 1 36 . 1 1 11 11 LYS N N 15 123.663 0.300 . 1 . . . . 11 LYS N . 11382 1 37 . 1 1 12 12 PRO HA H 1 4.299 0.030 . 1 . . . . 12 PRO HA . 11382 1 38 . 1 1 12 12 PRO HB2 H 1 2.021 0.030 . 2 . . . . 12 PRO HB2 . 11382 1 39 . 1 1 12 12 PRO HB3 H 1 1.478 0.030 . 2 . . . . 12 PRO HB3 . 11382 1 40 . 1 1 12 12 PRO HD2 H 1 3.679 0.030 . 2 . . . . 12 PRO HD2 . 11382 1 41 . 1 1 12 12 PRO HD3 H 1 3.608 0.030 . 2 . . . . 12 PRO HD3 . 11382 1 42 . 1 1 12 12 PRO HG2 H 1 1.845 0.030 . 2 . . . . 12 PRO HG2 . 11382 1 43 . 1 1 12 12 PRO HG3 H 1 1.765 0.030 . 2 . . . . 12 PRO HG3 . 11382 1 44 . 1 1 12 12 PRO C C 13 176.077 0.300 . 1 . . . . 12 PRO C . 11382 1 45 . 1 1 12 12 PRO CA C 13 63.297 0.300 . 1 . . . . 12 PRO CA . 11382 1 46 . 1 1 12 12 PRO CB C 13 32.290 0.300 . 1 . . . . 12 PRO CB . 11382 1 47 . 1 1 12 12 PRO CD C 13 50.405 0.300 . 1 . . . . 12 PRO CD . 11382 1 48 . 1 1 12 12 PRO CG C 13 26.978 0.300 . 1 . . . . 12 PRO CG . 11382 1 49 . 1 1 13 13 PHE H H 1 8.257 0.030 . 1 . . . . 13 PHE H . 11382 1 50 . 1 1 13 13 PHE HA H 1 4.658 0.030 . 1 . . . . 13 PHE HA . 11382 1 51 . 1 1 13 13 PHE HB2 H 1 2.977 0.030 . 2 . . . . 13 PHE HB2 . 11382 1 52 . 1 1 13 13 PHE HB3 H 1 3.087 0.030 . 2 . . . . 13 PHE HB3 . 11382 1 53 . 1 1 13 13 PHE HD1 H 1 7.187 0.030 . 1 . . . . 13 PHE HD1 . 11382 1 54 . 1 1 13 13 PHE HD2 H 1 7.187 0.030 . 1 . . . . 13 PHE HD2 . 11382 1 55 . 1 1 13 13 PHE HE1 H 1 7.436 0.030 . 1 . . . . 13 PHE HE1 . 11382 1 56 . 1 1 13 13 PHE HE2 H 1 7.436 0.030 . 1 . . . . 13 PHE HE2 . 11382 1 57 . 1 1 13 13 PHE HZ H 1 7.409 0.030 . 1 . . . . 13 PHE HZ . 11382 1 58 . 1 1 13 13 PHE C C 13 174.565 0.300 . 1 . . . . 13 PHE C . 11382 1 59 . 1 1 13 13 PHE CA C 13 57.315 0.300 . 1 . . . . 13 PHE CA . 11382 1 60 . 1 1 13 13 PHE CB C 13 39.461 0.300 . 1 . . . . 13 PHE CB . 11382 1 61 . 1 1 13 13 PHE CD1 C 13 131.794 0.300 . 1 . . . . 13 PHE CD1 . 11382 1 62 . 1 1 13 13 PHE CD2 C 13 131.794 0.300 . 1 . . . . 13 PHE CD2 . 11382 1 63 . 1 1 13 13 PHE CE1 C 13 131.753 0.300 . 1 . . . . 13 PHE CE1 . 11382 1 64 . 1 1 13 13 PHE CE2 C 13 131.753 0.300 . 1 . . . . 13 PHE CE2 . 11382 1 65 . 1 1 13 13 PHE CZ C 13 130.119 0.300 . 1 . . . . 13 PHE CZ . 11382 1 66 . 1 1 13 13 PHE N N 15 118.589 0.300 . 1 . . . . 13 PHE N . 11382 1 67 . 1 1 14 14 GLU H H 1 8.509 0.030 . 1 . . . . 14 GLU H . 11382 1 68 . 1 1 14 14 GLU HA H 1 4.865 0.030 . 1 . . . . 14 GLU HA . 11382 1 69 . 1 1 14 14 GLU HB2 H 1 1.840 0.030 . 1 . . . . 14 GLU HB2 . 11382 1 70 . 1 1 14 14 GLU HB3 H 1 1.840 0.030 . 1 . . . . 14 GLU HB3 . 11382 1 71 . 1 1 14 14 GLU HG2 H 1 1.998 0.030 . 2 . . . . 14 GLU HG2 . 11382 1 72 . 1 1 14 14 GLU HG3 H 1 1.934 0.030 . 2 . . . . 14 GLU HG3 . 11382 1 73 . 1 1 14 14 GLU C C 13 175.162 0.300 . 1 . . . . 14 GLU C . 11382 1 74 . 1 1 14 14 GLU CA C 13 55.122 0.300 . 1 . . . . 14 GLU CA . 11382 1 75 . 1 1 14 14 GLU CB C 13 32.883 0.300 . 1 . . . . 14 GLU CB . 11382 1 76 . 1 1 14 14 GLU CG C 13 36.536 0.300 . 1 . . . . 14 GLU CG . 11382 1 77 . 1 1 14 14 GLU N N 15 123.739 0.300 . 1 . . . . 14 GLU N . 11382 1 78 . 1 1 15 15 CYS H H 1 9.236 0.030 . 1 . . . . 15 CYS H . 11382 1 79 . 1 1 15 15 CYS HA H 1 4.687 0.030 . 1 . . . . 15 CYS HA . 11382 1 80 . 1 1 15 15 CYS HB2 H 1 3.503 0.030 . 2 . . . . 15 CYS HB2 . 11382 1 81 . 1 1 15 15 CYS HB3 H 1 2.932 0.030 . 2 . . . . 15 CYS HB3 . 11382 1 82 . 1 1 15 15 CYS C C 13 177.694 0.300 . 1 . . . . 15 CYS C . 11382 1 83 . 1 1 15 15 CYS CA C 13 59.448 0.300 . 1 . . . . 15 CYS CA . 11382 1 84 . 1 1 15 15 CYS CB C 13 29.849 0.300 . 1 . . . . 15 CYS CB . 11382 1 85 . 1 1 15 15 CYS N N 15 126.575 0.300 . 1 . . . . 15 CYS N . 11382 1 86 . 1 1 16 16 THR H H 1 8.977 0.030 . 1 . . . . 16 THR H . 11382 1 87 . 1 1 16 16 THR HA H 1 4.151 0.030 . 1 . . . . 16 THR HA . 11382 1 88 . 1 1 16 16 THR HB H 1 4.203 0.030 . 1 . . . . 16 THR HB . 11382 1 89 . 1 1 16 16 THR HG21 H 1 1.236 0.030 . 1 . . . . 16 THR HG2 . 11382 1 90 . 1 1 16 16 THR HG22 H 1 1.236 0.030 . 1 . . . . 16 THR HG2 . 11382 1 91 . 1 1 16 16 THR HG23 H 1 1.236 0.030 . 1 . . . . 16 THR HG2 . 11382 1 92 . 1 1 16 16 THR C C 13 174.661 0.300 . 1 . . . . 16 THR C . 11382 1 93 . 1 1 16 16 THR CA C 13 64.319 0.300 . 1 . . . . 16 THR CA . 11382 1 94 . 1 1 16 16 THR CB C 13 68.701 0.300 . 1 . . . . 16 THR CB . 11382 1 95 . 1 1 16 16 THR CG2 C 13 21.717 0.300 . 1 . . . . 16 THR CG2 . 11382 1 96 . 1 1 16 16 THR N N 15 124.566 0.300 . 1 . . . . 16 THR N . 11382 1 97 . 1 1 17 17 HIS H H 1 8.620 0.030 . 1 . . . . 17 HIS H . 11382 1 98 . 1 1 17 17 HIS HA H 1 4.360 0.030 . 1 . . . . 17 HIS HA . 11382 1 99 . 1 1 17 17 HIS HB2 H 1 2.392 0.030 . 2 . . . . 17 HIS HB2 . 11382 1 100 . 1 1 17 17 HIS HB3 H 1 2.154 0.030 . 2 . . . . 17 HIS HB3 . 11382 1 101 . 1 1 17 17 HIS HD2 H 1 6.794 0.030 . 1 . . . . 17 HIS HD2 . 11382 1 102 . 1 1 17 17 HIS HE1 H 1 7.693 0.030 . 1 . . . . 17 HIS HE1 . 11382 1 103 . 1 1 17 17 HIS C C 13 176.667 0.300 . 1 . . . . 17 HIS C . 11382 1 104 . 1 1 17 17 HIS CA C 13 58.577 0.300 . 1 . . . . 17 HIS CA . 11382 1 105 . 1 1 17 17 HIS CB C 13 30.371 0.300 . 1 . . . . 17 HIS CB . 11382 1 106 . 1 1 17 17 HIS CD2 C 13 119.445 0.300 . 1 . . . . 17 HIS CD2 . 11382 1 107 . 1 1 17 17 HIS CE1 C 13 138.824 0.300 . 1 . . . . 17 HIS CE1 . 11382 1 108 . 1 1 17 17 HIS N N 15 122.119 0.300 . 1 . . . . 17 HIS N . 11382 1 109 . 1 1 18 18 CYS H H 1 7.927 0.030 . 1 . . . . 18 CYS H . 11382 1 110 . 1 1 18 18 CYS HA H 1 5.199 0.030 . 1 . . . . 18 CYS HA . 11382 1 111 . 1 1 18 18 CYS HB2 H 1 3.487 0.030 . 2 . . . . 18 CYS HB2 . 11382 1 112 . 1 1 18 18 CYS HB3 H 1 2.914 0.030 . 2 . . . . 18 CYS HB3 . 11382 1 113 . 1 1 18 18 CYS C C 13 176.050 0.300 . 1 . . . . 18 CYS C . 11382 1 114 . 1 1 18 18 CYS CA C 13 58.426 0.300 . 1 . . . . 18 CYS CA . 11382 1 115 . 1 1 18 18 CYS CB C 13 32.754 0.300 . 1 . . . . 18 CYS CB . 11382 1 116 . 1 1 18 18 CYS N N 15 114.191 0.300 . 1 . . . . 18 CYS N . 11382 1 117 . 1 1 19 19 GLY H H 1 8.264 0.030 . 1 . . . . 19 GLY H . 11382 1 118 . 1 1 19 19 GLY HA2 H 1 4.245 0.030 . 2 . . . . 19 GLY HA2 . 11382 1 119 . 1 1 19 19 GLY HA3 H 1 3.908 0.030 . 2 . . . . 19 GLY HA3 . 11382 1 120 . 1 1 19 19 GLY C C 13 173.759 0.300 . 1 . . . . 19 GLY C . 11382 1 121 . 1 1 19 19 GLY CA C 13 46.263 0.300 . 1 . . . . 19 GLY CA . 11382 1 122 . 1 1 19 19 GLY N N 15 113.250 0.300 . 1 . . . . 19 GLY N . 11382 1 123 . 1 1 20 20 LYS H H 1 8.035 0.030 . 1 . . . . 20 LYS H . 11382 1 124 . 1 1 20 20 LYS HA H 1 4.077 0.030 . 1 . . . . 20 LYS HA . 11382 1 125 . 1 1 20 20 LYS HB2 H 1 1.278 0.030 . 2 . . . . 20 LYS HB2 . 11382 1 126 . 1 1 20 20 LYS HB3 H 1 1.493 0.030 . 2 . . . . 20 LYS HB3 . 11382 1 127 . 1 1 20 20 LYS HD2 H 1 1.541 0.030 . 2 . . . . 20 LYS HD2 . 11382 1 128 . 1 1 20 20 LYS HD3 H 1 1.463 0.030 . 2 . . . . 20 LYS HD3 . 11382 1 129 . 1 1 20 20 LYS HE2 H 1 2.932 0.030 . 2 . . . . 20 LYS HE2 . 11382 1 130 . 1 1 20 20 LYS HE3 H 1 3.004 0.030 . 2 . . . . 20 LYS HE3 . 11382 1 131 . 1 1 20 20 LYS HG2 H 1 1.469 0.030 . 2 . . . . 20 LYS HG2 . 11382 1 132 . 1 1 20 20 LYS HG3 H 1 1.136 0.030 . 2 . . . . 20 LYS HG3 . 11382 1 133 . 1 1 20 20 LYS C C 13 174.270 0.300 . 1 . . . . 20 LYS C . 11382 1 134 . 1 1 20 20 LYS CA C 13 58.003 0.300 . 1 . . . . 20 LYS CA . 11382 1 135 . 1 1 20 20 LYS CB C 13 33.879 0.300 . 1 . . . . 20 LYS CB . 11382 1 136 . 1 1 20 20 LYS CD C 13 29.293 0.300 . 1 . . . . 20 LYS CD . 11382 1 137 . 1 1 20 20 LYS CE C 13 42.246 0.300 . 1 . . . . 20 LYS CE . 11382 1 138 . 1 1 20 20 LYS CG C 13 26.244 0.300 . 1 . . . . 20 LYS CG . 11382 1 139 . 1 1 20 20 LYS N N 15 122.962 0.300 . 1 . . . . 20 LYS N . 11382 1 140 . 1 1 21 21 SER H H 1 7.895 0.030 . 1 . . . . 21 SER H . 11382 1 141 . 1 1 21 21 SER HA H 1 5.261 0.030 . 1 . . . . 21 SER HA . 11382 1 142 . 1 1 21 21 SER HB2 H 1 3.638 0.030 . 1 . . . . 21 SER HB2 . 11382 1 143 . 1 1 21 21 SER HB3 H 1 3.638 0.030 . 1 . . . . 21 SER HB3 . 11382 1 144 . 1 1 21 21 SER C C 13 173.188 0.300 . 1 . . . . 21 SER C . 11382 1 145 . 1 1 21 21 SER CA C 13 56.858 0.300 . 1 . . . . 21 SER CA . 11382 1 146 . 1 1 21 21 SER CB C 13 65.888 0.300 . 1 . . . . 21 SER CB . 11382 1 147 . 1 1 21 21 SER N N 15 115.533 0.300 . 1 . . . . 21 SER N . 11382 1 148 . 1 1 22 22 PHE H H 1 8.681 0.030 . 1 . . . . 22 PHE H . 11382 1 149 . 1 1 22 22 PHE HA H 1 4.755 0.030 . 1 . . . . 22 PHE HA . 11382 1 150 . 1 1 22 22 PHE HB2 H 1 2.685 0.030 . 2 . . . . 22 PHE HB2 . 11382 1 151 . 1 1 22 22 PHE HB3 H 1 3.428 0.030 . 2 . . . . 22 PHE HB3 . 11382 1 152 . 1 1 22 22 PHE HD1 H 1 7.302 0.030 . 1 . . . . 22 PHE HD1 . 11382 1 153 . 1 1 22 22 PHE HD2 H 1 7.302 0.030 . 1 . . . . 22 PHE HD2 . 11382 1 154 . 1 1 22 22 PHE HE1 H 1 6.874 0.030 . 1 . . . . 22 PHE HE1 . 11382 1 155 . 1 1 22 22 PHE HE2 H 1 6.874 0.030 . 1 . . . . 22 PHE HE2 . 11382 1 156 . 1 1 22 22 PHE HZ H 1 6.213 0.030 . 1 . . . . 22 PHE HZ . 11382 1 157 . 1 1 22 22 PHE C C 13 175.040 0.300 . 1 . . . . 22 PHE C . 11382 1 158 . 1 1 22 22 PHE CA C 13 57.431 0.300 . 1 . . . . 22 PHE CA . 11382 1 159 . 1 1 22 22 PHE CB C 13 43.711 0.300 . 1 . . . . 22 PHE CB . 11382 1 160 . 1 1 22 22 PHE CD1 C 13 132.325 0.300 . 1 . . . . 22 PHE CD1 . 11382 1 161 . 1 1 22 22 PHE CD2 C 13 132.325 0.300 . 1 . . . . 22 PHE CD2 . 11382 1 162 . 1 1 22 22 PHE CE1 C 13 130.726 0.300 . 1 . . . . 22 PHE CE1 . 11382 1 163 . 1 1 22 22 PHE CE2 C 13 130.726 0.300 . 1 . . . . 22 PHE CE2 . 11382 1 164 . 1 1 22 22 PHE CZ C 13 128.786 0.300 . 1 . . . . 22 PHE CZ . 11382 1 165 . 1 1 22 22 PHE N N 15 118.616 0.300 . 1 . . . . 22 PHE N . 11382 1 166 . 1 1 23 23 ARG HA H 1 4.470 0.030 . 1 . . . . 23 ARG HA . 11382 1 167 . 1 1 23 23 ARG HB2 H 1 1.955 0.030 . 2 . . . . 23 ARG HB2 . 11382 1 168 . 1 1 23 23 ARG HB3 H 1 2.038 0.030 . 2 . . . . 23 ARG HB3 . 11382 1 169 . 1 1 23 23 ARG HD2 H 1 3.276 0.030 . 1 . . . . 23 ARG HD2 . 11382 1 170 . 1 1 23 23 ARG HD3 H 1 3.276 0.030 . 1 . . . . 23 ARG HD3 . 11382 1 171 . 1 1 23 23 ARG HG2 H 1 1.808 0.030 . 2 . . . . 23 ARG HG2 . 11382 1 172 . 1 1 23 23 ARG HG3 H 1 1.767 0.030 . 2 . . . . 23 ARG HG3 . 11382 1 173 . 1 1 23 23 ARG C C 13 175.612 0.300 . 1 . . . . 23 ARG C . 11382 1 174 . 1 1 23 23 ARG CA C 13 57.580 0.300 . 1 . . . . 23 ARG CA . 11382 1 175 . 1 1 23 23 ARG CB C 13 30.919 0.300 . 1 . . . . 23 ARG CB . 11382 1 176 . 1 1 23 23 ARG CD C 13 43.339 0.300 . 1 . . . . 23 ARG CD . 11382 1 177 . 1 1 23 23 ARG CG C 13 27.713 0.300 . 1 . . . . 23 ARG CG . 11382 1 178 . 1 1 24 24 ALA H H 1 7.730 0.030 . 1 . . . . 24 ALA H . 11382 1 179 . 1 1 24 24 ALA HA H 1 4.694 0.030 . 1 . . . . 24 ALA HA . 11382 1 180 . 1 1 24 24 ALA HB1 H 1 1.436 0.030 . 1 . . . . 24 ALA HB . 11382 1 181 . 1 1 24 24 ALA HB2 H 1 1.436 0.030 . 1 . . . . 24 ALA HB . 11382 1 182 . 1 1 24 24 ALA HB3 H 1 1.436 0.030 . 1 . . . . 24 ALA HB . 11382 1 183 . 1 1 24 24 ALA C C 13 177.017 0.300 . 1 . . . . 24 ALA C . 11382 1 184 . 1 1 24 24 ALA CA C 13 50.498 0.300 . 1 . . . . 24 ALA CA . 11382 1 185 . 1 1 24 24 ALA CB C 13 21.366 0.300 . 1 . . . . 24 ALA CB . 11382 1 186 . 1 1 24 24 ALA N N 15 119.648 0.300 . 1 . . . . 24 ALA N . 11382 1 187 . 1 1 25 25 LYS H H 1 8.399 0.030 . 1 . . . . 25 LYS H . 11382 1 188 . 1 1 25 25 LYS HA H 1 2.992 0.030 . 1 . . . . 25 LYS HA . 11382 1 189 . 1 1 25 25 LYS HB2 H 1 1.125 0.030 . 2 . . . . 25 LYS HB2 . 11382 1 190 . 1 1 25 25 LYS HB3 H 1 1.425 0.030 . 2 . . . . 25 LYS HB3 . 11382 1 191 . 1 1 25 25 LYS HD2 H 1 1.576 0.030 . 2 . . . . 25 LYS HD2 . 11382 1 192 . 1 1 25 25 LYS HD3 H 1 1.500 0.030 . 2 . . . . 25 LYS HD3 . 11382 1 193 . 1 1 25 25 LYS HE2 H 1 2.829 0.030 . 2 . . . . 25 LYS HE2 . 11382 1 194 . 1 1 25 25 LYS HE3 H 1 2.890 0.030 . 2 . . . . 25 LYS HE3 . 11382 1 195 . 1 1 25 25 LYS HG2 H 1 1.018 0.030 . 2 . . . . 25 LYS HG2 . 11382 1 196 . 1 1 25 25 LYS HG3 H 1 1.212 0.030 . 2 . . . . 25 LYS HG3 . 11382 1 197 . 1 1 25 25 LYS C C 13 178.550 0.300 . 1 . . . . 25 LYS C . 11382 1 198 . 1 1 25 25 LYS CA C 13 59.273 0.300 . 1 . . . . 25 LYS CA . 11382 1 199 . 1 1 25 25 LYS CB C 13 31.936 0.300 . 1 . . . . 25 LYS CB . 11382 1 200 . 1 1 25 25 LYS CD C 13 29.053 0.300 . 1 . . . . 25 LYS CD . 11382 1 201 . 1 1 25 25 LYS CE C 13 42.110 0.300 . 1 . . . . 25 LYS CE . 11382 1 202 . 1 1 25 25 LYS CG C 13 24.737 0.300 . 1 . . . . 25 LYS CG . 11382 1 203 . 1 1 25 25 LYS N N 15 125.614 0.300 . 1 . . . . 25 LYS N . 11382 1 204 . 1 1 26 26 GLY H H 1 8.818 0.030 . 1 . . . . 26 GLY H . 11382 1 205 . 1 1 26 26 GLY HA2 H 1 3.676 0.030 . 2 . . . . 26 GLY HA2 . 11382 1 206 . 1 1 26 26 GLY HA3 H 1 3.799 0.030 . 2 . . . . 26 GLY HA3 . 11382 1 207 . 1 1 26 26 GLY C C 13 176.127 0.300 . 1 . . . . 26 GLY C . 11382 1 208 . 1 1 26 26 GLY CA C 13 47.055 0.300 . 1 . . . . 26 GLY CA . 11382 1 209 . 1 1 26 26 GLY N N 15 104.522 0.300 . 1 . . . . 26 GLY N . 11382 1 210 . 1 1 27 27 ASN H H 1 6.988 0.030 . 1 . . . . 27 ASN H . 11382 1 211 . 1 1 27 27 ASN HA H 1 4.513 0.030 . 1 . . . . 27 ASN HA . 11382 1 212 . 1 1 27 27 ASN HB2 H 1 2.915 0.030 . 1 . . . . 27 ASN HB2 . 11382 1 213 . 1 1 27 27 ASN HB3 H 1 2.915 0.030 . 1 . . . . 27 ASN HB3 . 11382 1 214 . 1 1 27 27 ASN HD21 H 1 6.872 0.030 . 2 . . . . 27 ASN HD21 . 11382 1 215 . 1 1 27 27 ASN HD22 H 1 7.560 0.030 . 2 . . . . 27 ASN HD22 . 11382 1 216 . 1 1 27 27 ASN C C 13 177.207 0.300 . 1 . . . . 27 ASN C . 11382 1 217 . 1 1 27 27 ASN CA C 13 55.176 0.300 . 1 . . . . 27 ASN CA . 11382 1 218 . 1 1 27 27 ASN CB C 13 38.641 0.300 . 1 . . . . 27 ASN CB . 11382 1 219 . 1 1 27 27 ASN N N 15 116.758 0.300 . 1 . . . . 27 ASN N . 11382 1 220 . 1 1 27 27 ASN ND2 N 15 112.813 0.300 . 1 . . . . 27 ASN ND2 . 11382 1 221 . 1 1 28 28 LEU H H 1 7.011 0.030 . 1 . . . . 28 LEU H . 11382 1 222 . 1 1 28 28 LEU HA H 1 3.213 0.030 . 1 . . . . 28 LEU HA . 11382 1 223 . 1 1 28 28 LEU HB2 H 1 2.108 0.030 . 2 . . . . 28 LEU HB2 . 11382 1 224 . 1 1 28 28 LEU HB3 H 1 1.238 0.030 . 2 . . . . 28 LEU HB3 . 11382 1 225 . 1 1 28 28 LEU HD11 H 1 1.020 0.030 . 1 . . . . 28 LEU HD1 . 11382 1 226 . 1 1 28 28 LEU HD12 H 1 1.020 0.030 . 1 . . . . 28 LEU HD1 . 11382 1 227 . 1 1 28 28 LEU HD13 H 1 1.020 0.030 . 1 . . . . 28 LEU HD1 . 11382 1 228 . 1 1 28 28 LEU HD21 H 1 1.038 0.030 . 1 . . . . 28 LEU HD2 . 11382 1 229 . 1 1 28 28 LEU HD22 H 1 1.038 0.030 . 1 . . . . 28 LEU HD2 . 11382 1 230 . 1 1 28 28 LEU HD23 H 1 1.038 0.030 . 1 . . . . 28 LEU HD2 . 11382 1 231 . 1 1 28 28 LEU HG H 1 1.524 0.030 . 1 . . . . 28 LEU HG . 11382 1 232 . 1 1 28 28 LEU C C 13 177.450 0.300 . 1 . . . . 28 LEU C . 11382 1 233 . 1 1 28 28 LEU CA C 13 58.006 0.300 . 1 . . . . 28 LEU CA . 11382 1 234 . 1 1 28 28 LEU CB C 13 40.404 0.300 . 1 . . . . 28 LEU CB . 11382 1 235 . 1 1 28 28 LEU CD1 C 13 26.541 0.300 . 2 . . . . 28 LEU CD1 . 11382 1 236 . 1 1 28 28 LEU CD2 C 13 23.044 0.300 . 2 . . . . 28 LEU CD2 . 11382 1 237 . 1 1 28 28 LEU CG C 13 27.529 0.300 . 1 . . . . 28 LEU CG . 11382 1 238 . 1 1 28 28 LEU N N 15 122.775 0.300 . 1 . . . . 28 LEU N . 11382 1 239 . 1 1 29 29 VAL H H 1 8.109 0.030 . 1 . . . . 29 VAL H . 11382 1 240 . 1 1 29 29 VAL HA H 1 3.637 0.030 . 1 . . . . 29 VAL HA . 11382 1 241 . 1 1 29 29 VAL HB H 1 2.055 0.030 . 1 . . . . 29 VAL HB . 11382 1 242 . 1 1 29 29 VAL HG11 H 1 0.897 0.030 . 1 . . . . 29 VAL HG1 . 11382 1 243 . 1 1 29 29 VAL HG12 H 1 0.897 0.030 . 1 . . . . 29 VAL HG1 . 11382 1 244 . 1 1 29 29 VAL HG13 H 1 0.897 0.030 . 1 . . . . 29 VAL HG1 . 11382 1 245 . 1 1 29 29 VAL HG21 H 1 0.987 0.030 . 1 . . . . 29 VAL HG2 . 11382 1 246 . 1 1 29 29 VAL HG22 H 1 0.987 0.030 . 1 . . . . 29 VAL HG2 . 11382 1 247 . 1 1 29 29 VAL HG23 H 1 0.987 0.030 . 1 . . . . 29 VAL HG2 . 11382 1 248 . 1 1 29 29 VAL C C 13 179.346 0.300 . 1 . . . . 29 VAL C . 11382 1 249 . 1 1 29 29 VAL CA C 13 66.694 0.300 . 1 . . . . 29 VAL CA . 11382 1 250 . 1 1 29 29 VAL CB C 13 31.605 0.300 . 1 . . . . 29 VAL CB . 11382 1 251 . 1 1 29 29 VAL CG1 C 13 20.964 0.300 . 2 . . . . 29 VAL CG1 . 11382 1 252 . 1 1 29 29 VAL CG2 C 13 22.471 0.300 . 2 . . . . 29 VAL CG2 . 11382 1 253 . 1 1 29 29 VAL N N 15 119.544 0.300 . 1 . . . . 29 VAL N . 11382 1 254 . 1 1 30 30 THR H H 1 7.759 0.030 . 1 . . . . 30 THR H . 11382 1 255 . 1 1 30 30 THR HA H 1 3.816 0.030 . 1 . . . . 30 THR HA . 11382 1 256 . 1 1 30 30 THR HB H 1 4.062 0.030 . 1 . . . . 30 THR HB . 11382 1 257 . 1 1 30 30 THR HG21 H 1 1.223 0.030 . 1 . . . . 30 THR HG2 . 11382 1 258 . 1 1 30 30 THR HG22 H 1 1.223 0.030 . 1 . . . . 30 THR HG2 . 11382 1 259 . 1 1 30 30 THR HG23 H 1 1.223 0.030 . 1 . . . . 30 THR HG2 . 11382 1 260 . 1 1 30 30 THR C C 13 176.801 0.300 . 1 . . . . 30 THR C . 11382 1 261 . 1 1 30 30 THR CA C 13 66.334 0.300 . 1 . . . . 30 THR CA . 11382 1 262 . 1 1 30 30 THR CB C 13 68.697 0.300 . 1 . . . . 30 THR CB . 11382 1 263 . 1 1 30 30 THR CG2 C 13 22.159 0.300 . 1 . . . . 30 THR CG2 . 11382 1 264 . 1 1 30 30 THR N N 15 114.834 0.300 . 1 . . . . 30 THR N . 11382 1 265 . 1 1 31 31 HIS H H 1 7.503 0.030 . 1 . . . . 31 HIS H . 11382 1 266 . 1 1 31 31 HIS HA H 1 4.207 0.030 . 1 . . . . 31 HIS HA . 11382 1 267 . 1 1 31 31 HIS HB2 H 1 2.950 0.030 . 2 . . . . 31 HIS HB2 . 11382 1 268 . 1 1 31 31 HIS HB3 H 1 3.147 0.030 . 2 . . . . 31 HIS HB3 . 11382 1 269 . 1 1 31 31 HIS HD2 H 1 7.007 0.030 . 1 . . . . 31 HIS HD2 . 11382 1 270 . 1 1 31 31 HIS HE1 H 1 8.095 0.030 . 1 . . . . 31 HIS HE1 . 11382 1 271 . 1 1 31 31 HIS C C 13 176.075 0.300 . 1 . . . . 31 HIS C . 11382 1 272 . 1 1 31 31 HIS CA C 13 59.359 0.300 . 1 . . . . 31 HIS CA . 11382 1 273 . 1 1 31 31 HIS CB C 13 28.604 0.300 . 1 . . . . 31 HIS CB . 11382 1 274 . 1 1 31 31 HIS CD2 C 13 127.400 0.300 . 1 . . . . 31 HIS CD2 . 11382 1 275 . 1 1 31 31 HIS CE1 C 13 139.720 0.300 . 1 . . . . 31 HIS CE1 . 11382 1 276 . 1 1 31 31 HIS N N 15 121.308 0.300 . 1 . . . . 31 HIS N . 11382 1 277 . 1 1 32 32 GLN H H 1 8.458 0.030 . 1 . . . . 32 GLN H . 11382 1 278 . 1 1 32 32 GLN HA H 1 3.714 0.030 . 1 . . . . 32 GLN HA . 11382 1 279 . 1 1 32 32 GLN HB2 H 1 2.368 0.030 . 2 . . . . 32 GLN HB2 . 11382 1 280 . 1 1 32 32 GLN HB3 H 1 2.244 0.030 . 2 . . . . 32 GLN HB3 . 11382 1 281 . 1 1 32 32 GLN HE21 H 1 7.573 0.030 . 2 . . . . 32 GLN HE21 . 11382 1 282 . 1 1 32 32 GLN HE22 H 1 7.092 0.030 . 2 . . . . 32 GLN HE22 . 11382 1 283 . 1 1 32 32 GLN HG2 H 1 2.892 0.030 . 1 . . . . 32 GLN HG2 . 11382 1 284 . 1 1 32 32 GLN HG3 H 1 2.892 0.030 . 1 . . . . 32 GLN HG3 . 11382 1 285 . 1 1 32 32 GLN C C 13 177.342 0.300 . 1 . . . . 32 GLN C . 11382 1 286 . 1 1 32 32 GLN CA C 13 59.331 0.300 . 1 . . . . 32 GLN CA . 11382 1 287 . 1 1 32 32 GLN CB C 13 28.338 0.300 . 1 . . . . 32 GLN CB . 11382 1 288 . 1 1 32 32 GLN CG C 13 35.525 0.300 . 1 . . . . 32 GLN CG . 11382 1 289 . 1 1 32 32 GLN N N 15 114.918 0.300 . 1 . . . . 32 GLN N . 11382 1 290 . 1 1 32 32 GLN NE2 N 15 111.904 0.300 . 1 . . . . 32 GLN NE2 . 11382 1 291 . 1 1 33 33 ARG H H 1 7.143 0.030 . 1 . . . . 33 ARG H . 11382 1 292 . 1 1 33 33 ARG HA H 1 4.123 0.030 . 1 . . . . 33 ARG HA . 11382 1 293 . 1 1 33 33 ARG HB2 H 1 1.888 0.030 . 2 . . . . 33 ARG HB2 . 11382 1 294 . 1 1 33 33 ARG HB3 H 1 1.801 0.030 . 2 . . . . 33 ARG HB3 . 11382 1 295 . 1 1 33 33 ARG HD2 H 1 3.210 0.030 . 1 . . . . 33 ARG HD2 . 11382 1 296 . 1 1 33 33 ARG HD3 H 1 3.210 0.030 . 1 . . . . 33 ARG HD3 . 11382 1 297 . 1 1 33 33 ARG HG2 H 1 1.671 0.030 . 2 . . . . 33 ARG HG2 . 11382 1 298 . 1 1 33 33 ARG HG3 H 1 1.854 0.030 . 2 . . . . 33 ARG HG3 . 11382 1 299 . 1 1 33 33 ARG C C 13 178.540 0.300 . 1 . . . . 33 ARG C . 11382 1 300 . 1 1 33 33 ARG CA C 13 58.542 0.300 . 1 . . . . 33 ARG CA . 11382 1 301 . 1 1 33 33 ARG CB C 13 30.109 0.300 . 1 . . . . 33 ARG CB . 11382 1 302 . 1 1 33 33 ARG CD C 13 43.643 0.300 . 1 . . . . 33 ARG CD . 11382 1 303 . 1 1 33 33 ARG CG C 13 27.699 0.300 . 1 . . . . 33 ARG CG . 11382 1 304 . 1 1 33 33 ARG N N 15 117.815 0.300 . 1 . . . . 33 ARG N . 11382 1 305 . 1 1 34 34 ILE H H 1 7.745 0.030 . 1 . . . . 34 ILE H . 11382 1 306 . 1 1 34 34 ILE HA H 1 3.962 0.030 . 1 . . . . 34 ILE HA . 11382 1 307 . 1 1 34 34 ILE HB H 1 1.654 0.030 . 1 . . . . 34 ILE HB . 11382 1 308 . 1 1 34 34 ILE HD11 H 1 0.686 0.030 . 1 . . . . 34 ILE HD1 . 11382 1 309 . 1 1 34 34 ILE HD12 H 1 0.686 0.030 . 1 . . . . 34 ILE HD1 . 11382 1 310 . 1 1 34 34 ILE HD13 H 1 0.686 0.030 . 1 . . . . 34 ILE HD1 . 11382 1 311 . 1 1 34 34 ILE HG12 H 1 0.637 0.030 . 2 . . . . 34 ILE HG12 . 11382 1 312 . 1 1 34 34 ILE HG13 H 1 0.895 0.030 . 2 . . . . 34 ILE HG13 . 11382 1 313 . 1 1 34 34 ILE HG21 H 1 0.564 0.030 . 1 . . . . 34 ILE HG2 . 11382 1 314 . 1 1 34 34 ILE HG22 H 1 0.564 0.030 . 1 . . . . 34 ILE HG2 . 11382 1 315 . 1 1 34 34 ILE HG23 H 1 0.564 0.030 . 1 . . . . 34 ILE HG2 . 11382 1 316 . 1 1 34 34 ILE C C 13 177.206 0.300 . 1 . . . . 34 ILE C . 11382 1 317 . 1 1 34 34 ILE CA C 13 63.112 0.300 . 1 . . . . 34 ILE CA . 11382 1 318 . 1 1 34 34 ILE CB C 13 37.738 0.300 . 1 . . . . 34 ILE CB . 11382 1 319 . 1 1 34 34 ILE CD1 C 13 14.489 0.300 . 1 . . . . 34 ILE CD1 . 11382 1 320 . 1 1 34 34 ILE CG1 C 13 26.426 0.300 . 1 . . . . 34 ILE CG1 . 11382 1 321 . 1 1 34 34 ILE CG2 C 13 16.393 0.300 . 1 . . . . 34 ILE CG2 . 11382 1 322 . 1 1 34 34 ILE N N 15 115.847 0.300 . 1 . . . . 34 ILE N . 11382 1 323 . 1 1 35 35 HIS H H 1 7.180 0.030 . 1 . . . . 35 HIS H . 11382 1 324 . 1 1 35 35 HIS HA H 1 4.736 0.030 . 1 . . . . 35 HIS HA . 11382 1 325 . 1 1 35 35 HIS HB2 H 1 2.698 0.030 . 2 . . . . 35 HIS HB2 . 11382 1 326 . 1 1 35 35 HIS HB3 H 1 2.809 0.030 . 2 . . . . 35 HIS HB3 . 11382 1 327 . 1 1 35 35 HIS HD2 H 1 6.683 0.030 . 1 . . . . 35 HIS HD2 . 11382 1 328 . 1 1 35 35 HIS HE1 H 1 8.093 0.030 . 1 . . . . 35 HIS HE1 . 11382 1 329 . 1 1 35 35 HIS C C 13 175.559 0.300 . 1 . . . . 35 HIS C . 11382 1 330 . 1 1 35 35 HIS CA C 13 54.791 0.300 . 1 . . . . 35 HIS CA . 11382 1 331 . 1 1 35 35 HIS CB C 13 28.143 0.300 . 1 . . . . 35 HIS CB . 11382 1 332 . 1 1 35 35 HIS CD2 C 13 128.094 0.300 . 1 . . . . 35 HIS CD2 . 11382 1 333 . 1 1 35 35 HIS CE1 C 13 140.265 0.300 . 1 . . . . 35 HIS CE1 . 11382 1 334 . 1 1 35 35 HIS N N 15 117.323 0.300 . 1 . . . . 35 HIS N . 11382 1 335 . 1 1 36 36 THR H H 1 7.644 0.030 . 1 . . . . 36 THR H . 11382 1 336 . 1 1 36 36 THR HA H 1 4.278 0.030 . 1 . . . . 36 THR HA . 11382 1 337 . 1 1 36 36 THR HB H 1 4.297 0.030 . 1 . . . . 36 THR HB . 11382 1 338 . 1 1 36 36 THR HG21 H 1 1.210 0.030 . 1 . . . . 36 THR HG2 . 11382 1 339 . 1 1 36 36 THR HG22 H 1 1.210 0.030 . 1 . . . . 36 THR HG2 . 11382 1 340 . 1 1 36 36 THR HG23 H 1 1.210 0.030 . 1 . . . . 36 THR HG2 . 11382 1 341 . 1 1 36 36 THR C C 13 175.344 0.300 . 1 . . . . 36 THR C . 11382 1 342 . 1 1 36 36 THR CA C 13 62.663 0.300 . 1 . . . . 36 THR CA . 11382 1 343 . 1 1 36 36 THR CB C 13 69.805 0.300 . 1 . . . . 36 THR CB . 11382 1 344 . 1 1 36 36 THR CG2 C 13 21.557 0.300 . 1 . . . . 36 THR CG2 . 11382 1 345 . 1 1 36 36 THR N N 15 112.107 0.300 . 1 . . . . 36 THR N . 11382 1 346 . 1 1 37 37 GLY H H 1 8.293 0.030 . 1 . . . . 37 GLY H . 11382 1 347 . 1 1 37 37 GLY HA2 H 1 3.958 0.030 . 2 . . . . 37 GLY HA2 . 11382 1 348 . 1 1 37 37 GLY HA3 H 1 4.003 0.030 . 2 . . . . 37 GLY HA3 . 11382 1 349 . 1 1 37 37 GLY C C 13 174.151 0.300 . 1 . . . . 37 GLY C . 11382 1 350 . 1 1 37 37 GLY CA C 13 45.467 0.300 . 1 . . . . 37 GLY CA . 11382 1 351 . 1 1 37 37 GLY N N 15 111.018 0.300 . 1 . . . . 37 GLY N . 11382 1 352 . 1 1 38 38 GLU H H 1 8.087 0.030 . 1 . . . . 38 GLU H . 11382 1 353 . 1 1 38 38 GLU HA H 1 4.261 0.030 . 1 . . . . 38 GLU HA . 11382 1 354 . 1 1 38 38 GLU HB2 H 1 1.940 0.030 . 2 . . . . 38 GLU HB2 . 11382 1 355 . 1 1 38 38 GLU HB3 H 1 2.036 0.030 . 2 . . . . 38 GLU HB3 . 11382 1 356 . 1 1 38 38 GLU HG2 H 1 2.256 0.030 . 1 . . . . 38 GLU HG2 . 11382 1 357 . 1 1 38 38 GLU HG3 H 1 2.256 0.030 . 1 . . . . 38 GLU HG3 . 11382 1 358 . 1 1 38 38 GLU C C 13 176.603 0.300 . 1 . . . . 38 GLU C . 11382 1 359 . 1 1 38 38 GLU CA C 13 56.714 0.300 . 1 . . . . 38 GLU CA . 11382 1 360 . 1 1 38 38 GLU CB C 13 30.401 0.300 . 1 . . . . 38 GLU CB . 11382 1 361 . 1 1 38 38 GLU CG C 13 36.317 0.300 . 1 . . . . 38 GLU CG . 11382 1 362 . 1 1 38 38 GLU N N 15 120.721 0.300 . 1 . . . . 38 GLU N . 11382 1 363 . 1 1 39 39 LYS H H 1 8.423 0.030 . 1 . . . . 39 LYS H . 11382 1 364 . 1 1 39 39 LYS HA H 1 4.380 0.030 . 1 . . . . 39 LYS HA . 11382 1 365 . 1 1 39 39 LYS HB2 H 1 1.772 0.030 . 2 . . . . 39 LYS HB2 . 11382 1 366 . 1 1 39 39 LYS HB3 H 1 1.877 0.030 . 2 . . . . 39 LYS HB3 . 11382 1 367 . 1 1 39 39 LYS HD2 H 1 1.680 0.030 . 1 . . . . 39 LYS HD2 . 11382 1 368 . 1 1 39 39 LYS HD3 H 1 1.680 0.030 . 1 . . . . 39 LYS HD3 . 11382 1 369 . 1 1 39 39 LYS HE2 H 1 2.984 0.030 . 1 . . . . 39 LYS HE2 . 11382 1 370 . 1 1 39 39 LYS HE3 H 1 2.984 0.030 . 1 . . . . 39 LYS HE3 . 11382 1 371 . 1 1 39 39 LYS HG2 H 1 1.447 0.030 . 1 . . . . 39 LYS HG2 . 11382 1 372 . 1 1 39 39 LYS HG3 H 1 1.447 0.030 . 1 . . . . 39 LYS HG3 . 11382 1 373 . 1 1 39 39 LYS C C 13 176.499 0.300 . 1 . . . . 39 LYS C . 11382 1 374 . 1 1 39 39 LYS CA C 13 56.188 0.300 . 1 . . . . 39 LYS CA . 11382 1 375 . 1 1 39 39 LYS CB C 13 32.989 0.300 . 1 . . . . 39 LYS CB . 11382 1 376 . 1 1 39 39 LYS CD C 13 29.032 0.300 . 1 . . . . 39 LYS CD . 11382 1 377 . 1 1 39 39 LYS CE C 13 42.160 0.300 . 1 . . . . 39 LYS CE . 11382 1 378 . 1 1 39 39 LYS CG C 13 24.712 0.300 . 1 . . . . 39 LYS CG . 11382 1 379 . 1 1 39 39 LYS N N 15 122.483 0.300 . 1 . . . . 39 LYS N . 11382 1 380 . 1 1 40 40 SER H H 1 8.319 0.030 . 1 . . . . 40 SER H . 11382 1 381 . 1 1 40 40 SER HA H 1 4.490 0.030 . 1 . . . . 40 SER HA . 11382 1 382 . 1 1 40 40 SER HB2 H 1 3.873 0.030 . 2 . . . . 40 SER HB2 . 11382 1 383 . 1 1 40 40 SER HB3 H 1 3.941 0.030 . 2 . . . . 40 SER HB3 . 11382 1 384 . 1 1 40 40 SER C C 13 174.419 0.300 . 1 . . . . 40 SER C . 11382 1 385 . 1 1 40 40 SER CA C 13 58.222 0.300 . 1 . . . . 40 SER CA . 11382 1 386 . 1 1 40 40 SER CB C 13 64.114 0.300 . 1 . . . . 40 SER CB . 11382 1 387 . 1 1 40 40 SER N N 15 117.067 0.300 . 1 . . . . 40 SER N . 11382 1 388 . 1 1 41 41 GLY H H 1 8.258 0.030 . 1 . . . . 41 GLY H . 11382 1 389 . 1 1 41 41 GLY HA2 H 1 4.167 0.030 . 2 . . . . 41 GLY HA2 . 11382 1 390 . 1 1 41 41 GLY HA3 H 1 4.102 0.030 . 2 . . . . 41 GLY HA3 . 11382 1 391 . 1 1 41 41 GLY C C 13 171.590 0.300 . 1 . . . . 41 GLY C . 11382 1 392 . 1 1 41 41 GLY CA C 13 44.728 0.300 . 1 . . . . 41 GLY CA . 11382 1 393 . 1 1 41 41 GLY N N 15 110.718 0.300 . 1 . . . . 41 GLY N . 11382 1 394 . 1 1 42 42 PRO HA H 1 4.483 0.030 . 1 . . . . 42 PRO HA . 11382 1 395 . 1 1 42 42 PRO HB2 H 1 2.303 0.030 . 2 . . . . 42 PRO HB2 . 11382 1 396 . 1 1 42 42 PRO HB3 H 1 1.983 0.030 . 2 . . . . 42 PRO HB3 . 11382 1 397 . 1 1 42 42 PRO HD2 H 1 3.631 0.030 . 1 . . . . 42 PRO HD2 . 11382 1 398 . 1 1 42 42 PRO HD3 H 1 3.631 0.030 . 1 . . . . 42 PRO HD3 . 11382 1 399 . 1 1 42 42 PRO HG2 H 1 2.023 0.030 . 1 . . . . 42 PRO HG2 . 11382 1 400 . 1 1 42 42 PRO HG3 H 1 2.023 0.030 . 1 . . . . 42 PRO HG3 . 11382 1 401 . 1 1 42 42 PRO CA C 13 63.307 0.300 . 1 . . . . 42 PRO CA . 11382 1 402 . 1 1 42 42 PRO CB C 13 32.229 0.300 . 1 . . . . 42 PRO CB . 11382 1 403 . 1 1 42 42 PRO CD C 13 49.837 0.300 . 1 . . . . 42 PRO CD . 11382 1 404 . 1 1 42 42 PRO CG C 13 27.141 0.300 . 1 . . . . 42 PRO CG . 11382 1 stop_ save_