################################### # 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 10306 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10306 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10306 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 ASN HA H 1 4.704 0.030 . 1 . . . . 8 ASN HA . 10306 1 2 . 1 1 8 8 ASN HB2 H 1 2.701 0.030 . 2 . . . . 8 ASN HB2 . 10306 1 3 . 1 1 8 8 ASN HB3 H 1 2.759 0.030 . 2 . . . . 8 ASN HB3 . 10306 1 4 . 1 1 8 8 ASN HD21 H 1 7.519 0.030 . 2 . . . . 8 ASN HD21 . 10306 1 5 . 1 1 8 8 ASN HD22 H 1 6.873 0.030 . 2 . . . . 8 ASN HD22 . 10306 1 6 . 1 1 8 8 ASN C C 13 175.305 0.300 . 1 . . . . 8 ASN C . 10306 1 7 . 1 1 8 8 ASN CA C 13 52.979 0.300 . 1 . . . . 8 ASN CA . 10306 1 8 . 1 1 8 8 ASN CB C 13 39.296 0.300 . 1 . . . . 8 ASN CB . 10306 1 9 . 1 1 8 8 ASN ND2 N 15 112.683 0.300 . 1 . . . . 8 ASN ND2 . 10306 1 10 . 1 1 9 9 GLY H H 1 8.208 0.030 . 1 . . . . 9 GLY H . 10306 1 11 . 1 1 9 9 GLY HA2 H 1 3.778 0.030 . 1 . . . . 9 GLY HA2 . 10306 1 12 . 1 1 9 9 GLY HA3 H 1 3.778 0.030 . 1 . . . . 9 GLY HA3 . 10306 1 13 . 1 1 9 9 GLY C C 13 173.286 0.300 . 1 . . . . 9 GLY C . 10306 1 14 . 1 1 9 9 GLY CA C 13 45.474 0.300 . 1 . . . . 9 GLY CA . 10306 1 15 . 1 1 9 9 GLY N N 15 108.830 0.300 . 1 . . . . 9 GLY N . 10306 1 16 . 1 1 10 10 ALA H H 1 7.983 0.030 . 1 . . . . 10 ALA H . 10306 1 17 . 1 1 10 10 ALA HA H 1 4.249 0.030 . 1 . . . . 10 ALA HA . 10306 1 18 . 1 1 10 10 ALA HB1 H 1 1.063 0.030 . 1 . . . . 10 ALA HB . 10306 1 19 . 1 1 10 10 ALA HB2 H 1 1.063 0.030 . 1 . . . . 10 ALA HB . 10306 1 20 . 1 1 10 10 ALA HB3 H 1 1.063 0.030 . 1 . . . . 10 ALA HB . 10306 1 21 . 1 1 10 10 ALA C C 13 176.271 0.300 . 1 . . . . 10 ALA C . 10306 1 22 . 1 1 10 10 ALA CA C 13 52.346 0.300 . 1 . . . . 10 ALA CA . 10306 1 23 . 1 1 10 10 ALA CB C 13 19.835 0.300 . 1 . . . . 10 ALA CB . 10306 1 24 . 1 1 10 10 ALA N N 15 122.573 0.300 . 1 . . . . 10 ALA N . 10306 1 25 . 1 1 11 11 PHE H H 1 8.372 0.030 . 1 . . . . 11 PHE H . 10306 1 26 . 1 1 11 11 PHE HA H 1 4.645 0.030 . 1 . . . . 11 PHE HA . 10306 1 27 . 1 1 11 11 PHE HB2 H 1 2.798 0.030 . 2 . . . . 11 PHE HB2 . 10306 1 28 . 1 1 11 11 PHE HB3 H 1 2.954 0.030 . 2 . . . . 11 PHE HB3 . 10306 1 29 . 1 1 11 11 PHE HD1 H 1 7.087 0.030 . 1 . . . . 11 PHE HD1 . 10306 1 30 . 1 1 11 11 PHE HD2 H 1 7.087 0.030 . 1 . . . . 11 PHE HD2 . 10306 1 31 . 1 1 11 11 PHE HE1 H 1 7.368 0.030 . 1 . . . . 11 PHE HE1 . 10306 1 32 . 1 1 11 11 PHE HE2 H 1 7.368 0.030 . 1 . . . . 11 PHE HE2 . 10306 1 33 . 1 1 11 11 PHE HZ H 1 7.373 0.030 . 1 . . . . 11 PHE HZ . 10306 1 34 . 1 1 11 11 PHE C C 13 174.602 0.300 . 1 . . . . 11 PHE C . 10306 1 35 . 1 1 11 11 PHE CA C 13 57.211 0.300 . 1 . . . . 11 PHE CA . 10306 1 36 . 1 1 11 11 PHE CB C 13 39.588 0.300 . 1 . . . . 11 PHE CB . 10306 1 37 . 1 1 11 11 PHE CD1 C 13 131.628 0.300 . 1 . . . . 11 PHE CD1 . 10306 1 38 . 1 1 11 11 PHE CD2 C 13 131.628 0.300 . 1 . . . . 11 PHE CD2 . 10306 1 39 . 1 1 11 11 PHE CE1 C 13 131.486 0.300 . 1 . . . . 11 PHE CE1 . 10306 1 40 . 1 1 11 11 PHE CE2 C 13 131.486 0.300 . 1 . . . . 11 PHE CE2 . 10306 1 41 . 1 1 11 11 PHE CZ C 13 130.199 0.300 . 1 . . . . 11 PHE CZ . 10306 1 42 . 1 1 11 11 PHE N N 15 118.009 0.300 . 1 . . . . 11 PHE N . 10306 1 43 . 1 1 12 12 PHE H H 1 8.665 0.030 . 1 . . . . 12 PHE H . 10306 1 44 . 1 1 12 12 PHE HA H 1 4.971 0.030 . 1 . . . . 12 PHE HA . 10306 1 45 . 1 1 12 12 PHE HB2 H 1 3.003 0.030 . 2 . . . . 12 PHE HB2 . 10306 1 46 . 1 1 12 12 PHE HB3 H 1 3.044 0.030 . 2 . . . . 12 PHE HB3 . 10306 1 47 . 1 1 12 12 PHE HD1 H 1 7.161 0.030 . 1 . . . . 12 PHE HD1 . 10306 1 48 . 1 1 12 12 PHE HD2 H 1 7.161 0.030 . 1 . . . . 12 PHE HD2 . 10306 1 49 . 1 1 12 12 PHE HE1 H 1 7.267 0.030 . 1 . . . . 12 PHE HE1 . 10306 1 50 . 1 1 12 12 PHE HE2 H 1 7.267 0.030 . 1 . . . . 12 PHE HE2 . 10306 1 51 . 1 1 12 12 PHE HZ H 1 7.229 0.030 . 1 . . . . 12 PHE HZ . 10306 1 52 . 1 1 12 12 PHE C C 13 174.245 0.300 . 1 . . . . 12 PHE C . 10306 1 53 . 1 1 12 12 PHE CA C 13 56.601 0.300 . 1 . . . . 12 PHE CA . 10306 1 54 . 1 1 12 12 PHE CB C 13 40.635 0.300 . 1 . . . . 12 PHE CB . 10306 1 55 . 1 1 12 12 PHE CD1 C 13 132.044 0.300 . 1 . . . . 12 PHE CD1 . 10306 1 56 . 1 1 12 12 PHE CD2 C 13 132.044 0.300 . 1 . . . . 12 PHE CD2 . 10306 1 57 . 1 1 12 12 PHE CE1 C 13 131.139 0.300 . 1 . . . . 12 PHE CE1 . 10306 1 58 . 1 1 12 12 PHE CE2 C 13 131.139 0.300 . 1 . . . . 12 PHE CE2 . 10306 1 59 . 1 1 12 12 PHE CZ C 13 129.644 0.300 . 1 . . . . 12 PHE CZ . 10306 1 60 . 1 1 12 12 PHE N N 15 122.793 0.300 . 1 . . . . 12 PHE N . 10306 1 61 . 1 1 13 13 CYS H H 1 8.432 0.030 . 1 . . . . 13 CYS H . 10306 1 62 . 1 1 13 13 CYS HA H 1 4.489 0.030 . 1 . . . . 13 CYS HA . 10306 1 63 . 1 1 13 13 CYS HB2 H 1 3.331 0.030 . 2 . . . . 13 CYS HB2 . 10306 1 64 . 1 1 13 13 CYS HB3 H 1 2.670 0.030 . 2 . . . . 13 CYS HB3 . 10306 1 65 . 1 1 13 13 CYS C C 13 175.524 0.300 . 1 . . . . 13 CYS C . 10306 1 66 . 1 1 13 13 CYS CA C 13 59.872 0.300 . 1 . . . . 13 CYS CA . 10306 1 67 . 1 1 13 13 CYS CB C 13 29.494 0.300 . 1 . . . . 13 CYS CB . 10306 1 68 . 1 1 13 13 CYS N N 15 124.080 0.300 . 1 . . . . 13 CYS N . 10306 1 69 . 1 1 14 14 ASN H H 1 8.911 0.030 . 1 . . . . 14 ASN H . 10306 1 70 . 1 1 14 14 ASN HA H 1 4.801 0.030 . 1 . . . . 14 ASN HA . 10306 1 71 . 1 1 14 14 ASN HB2 H 1 2.920 0.030 . 1 . . . . 14 ASN HB2 . 10306 1 72 . 1 1 14 14 ASN HB3 H 1 2.920 0.030 . 1 . . . . 14 ASN HB3 . 10306 1 73 . 1 1 14 14 ASN HD21 H 1 7.651 0.030 . 2 . . . . 14 ASN HD21 . 10306 1 74 . 1 1 14 14 ASN HD22 H 1 6.955 0.030 . 2 . . . . 14 ASN HD22 . 10306 1 75 . 1 1 14 14 ASN C C 13 175.769 0.300 . 1 . . . . 14 ASN C . 10306 1 76 . 1 1 14 14 ASN CA C 13 54.791 0.300 . 1 . . . . 14 ASN CA . 10306 1 77 . 1 1 14 14 ASN CB C 13 38.946 0.300 . 1 . . . . 14 ASN CB . 10306 1 78 . 1 1 14 14 ASN N N 15 125.593 0.300 . 1 . . . . 14 ASN N . 10306 1 79 . 1 1 14 14 ASN ND2 N 15 112.919 0.300 . 1 . . . . 14 ASN ND2 . 10306 1 80 . 1 1 15 15 GLU H H 1 9.367 0.030 . 1 . . . . 15 GLU H . 10306 1 81 . 1 1 15 15 GLU HA H 1 4.387 0.030 . 1 . . . . 15 GLU HA . 10306 1 82 . 1 1 15 15 GLU HB2 H 1 1.594 0.030 . 2 . . . . 15 GLU HB2 . 10306 1 83 . 1 1 15 15 GLU HB3 H 1 0.730 0.030 . 2 . . . . 15 GLU HB3 . 10306 1 84 . 1 1 15 15 GLU HG2 H 1 1.913 0.030 . 1 . . . . 15 GLU HG2 . 10306 1 85 . 1 1 15 15 GLU HG3 H 1 1.913 0.030 . 1 . . . . 15 GLU HG3 . 10306 1 86 . 1 1 15 15 GLU C C 13 175.728 0.300 . 1 . . . . 15 GLU C . 10306 1 87 . 1 1 15 15 GLU CA C 13 57.090 0.300 . 1 . . . . 15 GLU CA . 10306 1 88 . 1 1 15 15 GLU CB C 13 30.512 0.300 . 1 . . . . 15 GLU CB . 10306 1 89 . 1 1 15 15 GLU CG C 13 36.632 0.300 . 1 . . . . 15 GLU CG . 10306 1 90 . 1 1 15 15 GLU N N 15 121.450 0.300 . 1 . . . . 15 GLU N . 10306 1 91 . 1 1 16 16 CYS H H 1 7.976 0.030 . 1 . . . . 16 CYS H . 10306 1 92 . 1 1 16 16 CYS HA H 1 4.931 0.030 . 1 . . . . 16 CYS HA . 10306 1 93 . 1 1 16 16 CYS HB2 H 1 3.294 0.030 . 2 . . . . 16 CYS HB2 . 10306 1 94 . 1 1 16 16 CYS HB3 H 1 3.370 0.030 . 2 . . . . 16 CYS HB3 . 10306 1 95 . 1 1 16 16 CYS C C 13 173.444 0.300 . 1 . . . . 16 CYS C . 10306 1 96 . 1 1 16 16 CYS CA C 13 58.791 0.300 . 1 . . . . 16 CYS CA . 10306 1 97 . 1 1 16 16 CYS CB C 13 30.453 0.300 . 1 . . . . 16 CYS CB . 10306 1 98 . 1 1 16 16 CYS N N 15 119.139 0.300 . 1 . . . . 16 CYS N . 10306 1 99 . 1 1 17 17 ASP H H 1 8.140 0.030 . 1 . . . . 17 ASP H . 10306 1 100 . 1 1 17 17 ASP HA H 1 4.746 0.030 . 1 . . . . 17 ASP HA . 10306 1 101 . 1 1 17 17 ASP HB2 H 1 2.756 0.030 . 2 . . . . 17 ASP HB2 . 10306 1 102 . 1 1 17 17 ASP HB3 H 1 2.857 0.030 . 2 . . . . 17 ASP HB3 . 10306 1 103 . 1 1 17 17 ASP C C 13 176.536 0.300 . 1 . . . . 17 ASP C . 10306 1 104 . 1 1 17 17 ASP CA C 13 54.996 0.300 . 1 . . . . 17 ASP CA . 10306 1 105 . 1 1 17 17 ASP CB C 13 40.571 0.300 . 1 . . . . 17 ASP CB . 10306 1 106 . 1 1 17 17 ASP N N 15 116.601 0.300 . 1 . . . . 17 ASP N . 10306 1 107 . 1 1 18 18 CYS H H 1 8.346 0.030 . 1 . . . . 18 CYS H . 10306 1 108 . 1 1 18 18 CYS HA H 1 4.188 0.030 . 1 . . . . 18 CYS HA . 10306 1 109 . 1 1 18 18 CYS HB2 H 1 2.247 0.030 . 2 . . . . 18 CYS HB2 . 10306 1 110 . 1 1 18 18 CYS HB3 H 1 2.331 0.030 . 2 . . . . 18 CYS HB3 . 10306 1 111 . 1 1 18 18 CYS C C 13 172.969 0.300 . 1 . . . . 18 CYS C . 10306 1 112 . 1 1 18 18 CYS CA C 13 61.885 0.300 . 1 . . . . 18 CYS CA . 10306 1 113 . 1 1 18 18 CYS CB C 13 29.122 0.300 . 1 . . . . 18 CYS CB . 10306 1 114 . 1 1 18 18 CYS N N 15 119.739 0.300 . 1 . . . . 18 CYS N . 10306 1 115 . 1 1 19 19 ARG H H 1 7.825 0.030 . 1 . . . . 19 ARG H . 10306 1 116 . 1 1 19 19 ARG HA H 1 4.770 0.030 . 1 . . . . 19 ARG HA . 10306 1 117 . 1 1 19 19 ARG HB2 H 1 1.252 0.030 . 2 . . . . 19 ARG HB2 . 10306 1 118 . 1 1 19 19 ARG HB3 H 1 1.457 0.030 . 2 . . . . 19 ARG HB3 . 10306 1 119 . 1 1 19 19 ARG HD2 H 1 2.918 0.030 . 2 . . . . 19 ARG HD2 . 10306 1 120 . 1 1 19 19 ARG HD3 H 1 2.957 0.030 . 2 . . . . 19 ARG HD3 . 10306 1 121 . 1 1 19 19 ARG HG2 H 1 1.159 0.030 . 2 . . . . 19 ARG HG2 . 10306 1 122 . 1 1 19 19 ARG HG3 H 1 1.229 0.030 . 2 . . . . 19 ARG HG3 . 10306 1 123 . 1 1 19 19 ARG C C 13 174.153 0.300 . 1 . . . . 19 ARG C . 10306 1 124 . 1 1 19 19 ARG CA C 13 54.520 0.300 . 1 . . . . 19 ARG CA . 10306 1 125 . 1 1 19 19 ARG CB C 13 33.473 0.300 . 1 . . . . 19 ARG CB . 10306 1 126 . 1 1 19 19 ARG CD C 13 43.593 0.300 . 1 . . . . 19 ARG CD . 10306 1 127 . 1 1 19 19 ARG CG C 13 26.444 0.300 . 1 . . . . 19 ARG CG . 10306 1 128 . 1 1 19 19 ARG N N 15 120.755 0.300 . 1 . . . . 19 ARG N . 10306 1 129 . 1 1 20 20 PHE H H 1 8.702 0.030 . 1 . . . . 20 PHE H . 10306 1 130 . 1 1 20 20 PHE HA H 1 4.827 0.030 . 1 . . . . 20 PHE HA . 10306 1 131 . 1 1 20 20 PHE HB2 H 1 2.597 0.030 . 2 . . . . 20 PHE HB2 . 10306 1 132 . 1 1 20 20 PHE HB3 H 1 3.450 0.030 . 2 . . . . 20 PHE HB3 . 10306 1 133 . 1 1 20 20 PHE HD1 H 1 7.135 0.030 . 1 . . . . 20 PHE HD1 . 10306 1 134 . 1 1 20 20 PHE HD2 H 1 7.135 0.030 . 1 . . . . 20 PHE HD2 . 10306 1 135 . 1 1 20 20 PHE HE1 H 1 6.836 0.030 . 1 . . . . 20 PHE HE1 . 10306 1 136 . 1 1 20 20 PHE HE2 H 1 6.836 0.030 . 1 . . . . 20 PHE HE2 . 10306 1 137 . 1 1 20 20 PHE HZ H 1 6.306 0.030 . 1 . . . . 20 PHE HZ . 10306 1 138 . 1 1 20 20 PHE C C 13 175.353 0.300 . 1 . . . . 20 PHE C . 10306 1 139 . 1 1 20 20 PHE CA C 13 57.130 0.300 . 1 . . . . 20 PHE CA . 10306 1 140 . 1 1 20 20 PHE CB C 13 43.835 0.300 . 1 . . . . 20 PHE CB . 10306 1 141 . 1 1 20 20 PHE CD1 C 13 132.337 0.300 . 1 . . . . 20 PHE CD1 . 10306 1 142 . 1 1 20 20 PHE CD2 C 13 132.337 0.300 . 1 . . . . 20 PHE CD2 . 10306 1 143 . 1 1 20 20 PHE CE1 C 13 130.762 0.300 . 1 . . . . 20 PHE CE1 . 10306 1 144 . 1 1 20 20 PHE CE2 C 13 130.762 0.300 . 1 . . . . 20 PHE CE2 . 10306 1 145 . 1 1 20 20 PHE CZ C 13 129.149 0.300 . 1 . . . . 20 PHE CZ . 10306 1 146 . 1 1 20 20 PHE N N 15 117.760 0.300 . 1 . . . . 20 PHE N . 10306 1 147 . 1 1 21 21 SER HA H 1 4.812 0.030 . 1 . . . . 21 SER HA . 10306 1 148 . 1 1 21 21 SER HB2 H 1 4.011 0.030 . 2 . . . . 21 SER HB2 . 10306 1 149 . 1 1 21 21 SER HB3 H 1 4.133 0.030 . 2 . . . . 21 SER HB3 . 10306 1 150 . 1 1 21 21 SER C C 13 174.026 0.300 . 1 . . . . 21 SER C . 10306 1 151 . 1 1 21 21 SER CA C 13 59.351 0.300 . 1 . . . . 21 SER CA . 10306 1 152 . 1 1 21 21 SER CB C 13 64.080 0.300 . 1 . . . . 21 SER CB . 10306 1 153 . 1 1 22 22 GLU H H 1 7.358 0.030 . 1 . . . . 22 GLU H . 10306 1 154 . 1 1 22 22 GLU HA H 1 4.525 0.030 . 1 . . . . 22 GLU HA . 10306 1 155 . 1 1 22 22 GLU HB2 H 1 2.231 0.030 . 2 . . . . 22 GLU HB2 . 10306 1 156 . 1 1 22 22 GLU HB3 H 1 2.008 0.030 . 2 . . . . 22 GLU HB3 . 10306 1 157 . 1 1 22 22 GLU HG2 H 1 2.260 0.030 . 1 . . . . 22 GLU HG2 . 10306 1 158 . 1 1 22 22 GLU HG3 H 1 2.260 0.030 . 1 . . . . 22 GLU HG3 . 10306 1 159 . 1 1 22 22 GLU C C 13 175.475 0.300 . 1 . . . . 22 GLU C . 10306 1 160 . 1 1 22 22 GLU CA C 13 54.589 0.300 . 1 . . . . 22 GLU CA . 10306 1 161 . 1 1 22 22 GLU CB C 13 31.572 0.300 . 1 . . . . 22 GLU CB . 10306 1 162 . 1 1 22 22 GLU CG C 13 35.477 0.300 . 1 . . . . 22 GLU CG . 10306 1 163 . 1 1 22 22 GLU N N 15 116.066 0.300 . 1 . . . . 22 GLU N . 10306 1 164 . 1 1 23 23 GLU H H 1 8.349 0.030 . 1 . . . . 23 GLU H . 10306 1 165 . 1 1 23 23 GLU HA H 1 2.908 0.030 . 1 . . . . 23 GLU HA . 10306 1 166 . 1 1 23 23 GLU HB2 H 1 1.624 0.030 . 2 . . . . 23 GLU HB2 . 10306 1 167 . 1 1 23 23 GLU HB3 H 1 1.399 0.030 . 2 . . . . 23 GLU HB3 . 10306 1 168 . 1 1 23 23 GLU HG2 H 1 1.915 0.030 . 1 . . . . 23 GLU HG2 . 10306 1 169 . 1 1 23 23 GLU HG3 H 1 1.915 0.030 . 1 . . . . 23 GLU HG3 . 10306 1 170 . 1 1 23 23 GLU C C 13 178.532 0.300 . 1 . . . . 23 GLU C . 10306 1 171 . 1 1 23 23 GLU CA C 13 59.461 0.300 . 1 . . . . 23 GLU CA . 10306 1 172 . 1 1 23 23 GLU CB C 13 29.411 0.300 . 1 . . . . 23 GLU CB . 10306 1 173 . 1 1 23 23 GLU CG C 13 36.501 0.300 . 1 . . . . 23 GLU CG . 10306 1 174 . 1 1 23 23 GLU N N 15 125.063 0.300 . 1 . . . . 23 GLU N . 10306 1 175 . 1 1 24 24 ALA H H 1 8.709 0.030 . 1 . . . . 24 ALA H . 10306 1 176 . 1 1 24 24 ALA HA H 1 3.944 0.030 . 1 . . . . 24 ALA HA . 10306 1 177 . 1 1 24 24 ALA HB1 H 1 1.373 0.030 . 1 . . . . 24 ALA HB . 10306 1 178 . 1 1 24 24 ALA HB2 H 1 1.373 0.030 . 1 . . . . 24 ALA HB . 10306 1 179 . 1 1 24 24 ALA HB3 H 1 1.373 0.030 . 1 . . . . 24 ALA HB . 10306 1 180 . 1 1 24 24 ALA C C 13 180.840 0.300 . 1 . . . . 24 ALA C . 10306 1 181 . 1 1 24 24 ALA CA C 13 55.339 0.300 . 1 . . . . 24 ALA CA . 10306 1 182 . 1 1 24 24 ALA CB C 13 18.078 0.300 . 1 . . . . 24 ALA CB . 10306 1 183 . 1 1 24 24 ALA N N 15 120.407 0.300 . 1 . . . . 24 ALA N . 10306 1 184 . 1 1 25 25 SER H H 1 7.482 0.030 . 1 . . . . 25 SER H . 10306 1 185 . 1 1 25 25 SER HA H 1 4.100 0.030 . 1 . . . . 25 SER HA . 10306 1 186 . 1 1 25 25 SER HB2 H 1 4.014 0.030 . 2 . . . . 25 SER HB2 . 10306 1 187 . 1 1 25 25 SER HB3 H 1 3.897 0.030 . 2 . . . . 25 SER HB3 . 10306 1 188 . 1 1 25 25 SER C C 13 176.290 0.300 . 1 . . . . 25 SER C . 10306 1 189 . 1 1 25 25 SER CA C 13 61.169 0.300 . 1 . . . . 25 SER CA . 10306 1 190 . 1 1 25 25 SER CB C 13 62.296 0.300 . 1 . . . . 25 SER CB . 10306 1 191 . 1 1 25 25 SER N N 15 113.501 0.300 . 1 . . . . 25 SER N . 10306 1 192 . 1 1 26 26 LEU H H 1 6.817 0.030 . 1 . . . . 26 LEU H . 10306 1 193 . 1 1 26 26 LEU HA H 1 3.140 0.030 . 1 . . . . 26 LEU HA . 10306 1 194 . 1 1 26 26 LEU HB2 H 1 1.950 0.030 . 2 . . . . 26 LEU HB2 . 10306 1 195 . 1 1 26 26 LEU HB3 H 1 1.167 0.030 . 2 . . . . 26 LEU HB3 . 10306 1 196 . 1 1 26 26 LEU HD11 H 1 1.044 0.030 . 1 . . . . 26 LEU HD1 . 10306 1 197 . 1 1 26 26 LEU HD12 H 1 1.044 0.030 . 1 . . . . 26 LEU HD1 . 10306 1 198 . 1 1 26 26 LEU HD13 H 1 1.044 0.030 . 1 . . . . 26 LEU HD1 . 10306 1 199 . 1 1 26 26 LEU HD21 H 1 0.952 0.030 . 1 . . . . 26 LEU HD2 . 10306 1 200 . 1 1 26 26 LEU HD22 H 1 0.952 0.030 . 1 . . . . 26 LEU HD2 . 10306 1 201 . 1 1 26 26 LEU HD23 H 1 0.952 0.030 . 1 . . . . 26 LEU HD2 . 10306 1 202 . 1 1 26 26 LEU HG H 1 1.578 0.030 . 1 . . . . 26 LEU HG . 10306 1 203 . 1 1 26 26 LEU C C 13 177.653 0.300 . 1 . . . . 26 LEU C . 10306 1 204 . 1 1 26 26 LEU CA C 13 57.785 0.300 . 1 . . . . 26 LEU CA . 10306 1 205 . 1 1 26 26 LEU CB C 13 40.289 0.300 . 1 . . . . 26 LEU CB . 10306 1 206 . 1 1 26 26 LEU CD1 C 13 26.861 0.300 . 2 . . . . 26 LEU CD1 . 10306 1 207 . 1 1 26 26 LEU CD2 C 13 22.430 0.300 . 2 . . . . 26 LEU CD2 . 10306 1 208 . 1 1 26 26 LEU CG C 13 27.621 0.300 . 1 . . . . 26 LEU CG . 10306 1 209 . 1 1 26 26 LEU N N 15 124.744 0.300 . 1 . . . . 26 LEU N . 10306 1 210 . 1 1 27 27 LYS H H 1 8.205 0.030 . 1 . . . . 27 LYS H . 10306 1 211 . 1 1 27 27 LYS HA H 1 3.980 0.030 . 1 . . . . 27 LYS HA . 10306 1 212 . 1 1 27 27 LYS HB2 H 1 1.803 0.030 . 1 . . . . 27 LYS HB2 . 10306 1 213 . 1 1 27 27 LYS HB3 H 1 1.803 0.030 . 1 . . . . 27 LYS HB3 . 10306 1 214 . 1 1 27 27 LYS HD2 H 1 1.620 0.030 . 1 . . . . 27 LYS HD2 . 10306 1 215 . 1 1 27 27 LYS HD3 H 1 1.620 0.030 . 1 . . . . 27 LYS HD3 . 10306 1 216 . 1 1 27 27 LYS HE2 H 1 2.890 0.030 . 1 . . . . 27 LYS HE2 . 10306 1 217 . 1 1 27 27 LYS HE3 H 1 2.890 0.030 . 1 . . . . 27 LYS HE3 . 10306 1 218 . 1 1 27 27 LYS HG2 H 1 1.391 0.030 . 2 . . . . 27 LYS HG2 . 10306 1 219 . 1 1 27 27 LYS HG3 H 1 1.481 0.030 . 2 . . . . 27 LYS HG3 . 10306 1 220 . 1 1 27 27 LYS C C 13 178.983 0.300 . 1 . . . . 27 LYS C . 10306 1 221 . 1 1 27 27 LYS CA C 13 59.718 0.300 . 1 . . . . 27 LYS CA . 10306 1 222 . 1 1 27 27 LYS CB C 13 31.751 0.300 . 1 . . . . 27 LYS CB . 10306 1 223 . 1 1 27 27 LYS CD C 13 28.951 0.300 . 1 . . . . 27 LYS CD . 10306 1 224 . 1 1 27 27 LYS CE C 13 42.052 0.300 . 1 . . . . 27 LYS CE . 10306 1 225 . 1 1 27 27 LYS CG C 13 25.274 0.300 . 1 . . . . 27 LYS CG . 10306 1 226 . 1 1 27 27 LYS N N 15 120.149 0.300 . 1 . . . . 27 LYS N . 10306 1 227 . 1 1 28 28 ARG H H 1 7.659 0.030 . 1 . . . . 28 ARG H . 10306 1 228 . 1 1 28 28 ARG HA H 1 3.969 0.030 . 1 . . . . 28 ARG HA . 10306 1 229 . 1 1 28 28 ARG HB2 H 1 1.761 0.030 . 2 . . . . 28 ARG HB2 . 10306 1 230 . 1 1 28 28 ARG HB3 H 1 1.814 0.030 . 2 . . . . 28 ARG HB3 . 10306 1 231 . 1 1 28 28 ARG HD2 H 1 3.223 0.030 . 2 . . . . 28 ARG HD2 . 10306 1 232 . 1 1 28 28 ARG HD3 H 1 3.171 0.030 . 2 . . . . 28 ARG HD3 . 10306 1 233 . 1 1 28 28 ARG HG2 H 1 1.525 0.030 . 2 . . . . 28 ARG HG2 . 10306 1 234 . 1 1 28 28 ARG HG3 H 1 1.725 0.030 . 2 . . . . 28 ARG HG3 . 10306 1 235 . 1 1 28 28 ARG C C 13 177.870 0.300 . 1 . . . . 28 ARG C . 10306 1 236 . 1 1 28 28 ARG CA C 13 59.583 0.300 . 1 . . . . 28 ARG CA . 10306 1 237 . 1 1 28 28 ARG CB C 13 30.106 0.300 . 1 . . . . 28 ARG CB . 10306 1 238 . 1 1 28 28 ARG CD C 13 43.360 0.300 . 1 . . . . 28 ARG CD . 10306 1 239 . 1 1 28 28 ARG CG C 13 27.527 0.300 . 1 . . . . 28 ARG CG . 10306 1 240 . 1 1 28 28 ARG N N 15 118.404 0.300 . 1 . . . . 28 ARG N . 10306 1 241 . 1 1 29 29 HIS H H 1 7.608 0.030 . 1 . . . . 29 HIS H . 10306 1 242 . 1 1 29 29 HIS HA H 1 4.310 0.030 . 1 . . . . 29 HIS HA . 10306 1 243 . 1 1 29 29 HIS HB2 H 1 3.279 0.030 . 2 . . . . 29 HIS HB2 . 10306 1 244 . 1 1 29 29 HIS HB3 H 1 2.946 0.030 . 2 . . . . 29 HIS HB3 . 10306 1 245 . 1 1 29 29 HIS HD2 H 1 7.121 0.030 . 1 . . . . 29 HIS HD2 . 10306 1 246 . 1 1 29 29 HIS HE1 H 1 8.082 0.030 . 1 . . . . 29 HIS HE1 . 10306 1 247 . 1 1 29 29 HIS C C 13 177.871 0.300 . 1 . . . . 29 HIS C . 10306 1 248 . 1 1 29 29 HIS CA C 13 59.501 0.300 . 1 . . . . 29 HIS CA . 10306 1 249 . 1 1 29 29 HIS CB C 13 28.649 0.300 . 1 . . . . 29 HIS CB . 10306 1 250 . 1 1 29 29 HIS CD2 C 13 127.409 0.300 . 1 . . . . 29 HIS CD2 . 10306 1 251 . 1 1 29 29 HIS CE1 C 13 140.576 0.300 . 1 . . . . 29 HIS CE1 . 10306 1 252 . 1 1 29 29 HIS N N 15 118.255 0.300 . 1 . . . . 29 HIS N . 10306 1 253 . 1 1 30 30 THR H H 1 8.941 0.030 . 1 . . . . 30 THR H . 10306 1 254 . 1 1 30 30 THR HA H 1 3.635 0.030 . 1 . . . . 30 THR HA . 10306 1 255 . 1 1 30 30 THR HB H 1 4.294 0.030 . 1 . . . . 30 THR HB . 10306 1 256 . 1 1 30 30 THR HG21 H 1 1.398 0.030 . 1 . . . . 30 THR HG2 . 10306 1 257 . 1 1 30 30 THR HG22 H 1 1.398 0.030 . 1 . . . . 30 THR HG2 . 10306 1 258 . 1 1 30 30 THR HG23 H 1 1.398 0.030 . 1 . . . . 30 THR HG2 . 10306 1 259 . 1 1 30 30 THR C C 13 176.615 0.300 . 1 . . . . 30 THR C . 10306 1 260 . 1 1 30 30 THR CA C 13 67.803 0.300 . 1 . . . . 30 THR CA . 10306 1 261 . 1 1 30 30 THR CB C 13 68.650 0.300 . 1 . . . . 30 THR CB . 10306 1 262 . 1 1 30 30 THR CG2 C 13 22.166 0.300 . 1 . . . . 30 THR CG2 . 10306 1 263 . 1 1 30 30 THR N N 15 118.436 0.300 . 1 . . . . 30 THR N . 10306 1 264 . 1 1 31 31 LEU H H 1 7.749 0.030 . 1 . . . . 31 LEU H . 10306 1 265 . 1 1 31 31 LEU HA H 1 4.068 0.030 . 1 . . . . 31 LEU HA . 10306 1 266 . 1 1 31 31 LEU HB2 H 1 1.628 0.030 . 2 . . . . 31 LEU HB2 . 10306 1 267 . 1 1 31 31 LEU HB3 H 1 1.768 0.030 . 2 . . . . 31 LEU HB3 . 10306 1 268 . 1 1 31 31 LEU HD11 H 1 0.866 0.030 . 1 . . . . 31 LEU HD1 . 10306 1 269 . 1 1 31 31 LEU HD12 H 1 0.866 0.030 . 1 . . . . 31 LEU HD1 . 10306 1 270 . 1 1 31 31 LEU HD13 H 1 0.866 0.030 . 1 . . . . 31 LEU HD1 . 10306 1 271 . 1 1 31 31 LEU HD21 H 1 0.871 0.030 . 1 . . . . 31 LEU HD2 . 10306 1 272 . 1 1 31 31 LEU HD22 H 1 0.871 0.030 . 1 . . . . 31 LEU HD2 . 10306 1 273 . 1 1 31 31 LEU HD23 H 1 0.871 0.030 . 1 . . . . 31 LEU HD2 . 10306 1 274 . 1 1 31 31 LEU HG H 1 1.669 0.030 . 1 . . . . 31 LEU HG . 10306 1 275 . 1 1 31 31 LEU C C 13 178.775 0.300 . 1 . . . . 31 LEU C . 10306 1 276 . 1 1 31 31 LEU CA C 13 57.690 0.300 . 1 . . . . 31 LEU CA . 10306 1 277 . 1 1 31 31 LEU CB C 13 42.228 0.300 . 1 . . . . 31 LEU CB . 10306 1 278 . 1 1 31 31 LEU CD1 C 13 23.872 0.300 . 2 . . . . 31 LEU CD1 . 10306 1 279 . 1 1 31 31 LEU CD2 C 13 24.697 0.300 . 2 . . . . 31 LEU CD2 . 10306 1 280 . 1 1 31 31 LEU CG C 13 26.961 0.300 . 1 . . . . 31 LEU CG . 10306 1 281 . 1 1 31 31 LEU N N 15 121.775 0.300 . 1 . . . . 31 LEU N . 10306 1 282 . 1 1 32 32 GLN H H 1 7.928 0.030 . 1 . . . . 32 GLN H . 10306 1 283 . 1 1 32 32 GLN HA H 1 4.129 0.030 . 1 . . . . 32 GLN HA . 10306 1 284 . 1 1 32 32 GLN HB2 H 1 2.031 0.030 . 1 . . . . 32 GLN HB2 . 10306 1 285 . 1 1 32 32 GLN HB3 H 1 2.031 0.030 . 1 . . . . 32 GLN HB3 . 10306 1 286 . 1 1 32 32 GLN HE21 H 1 7.423 0.030 . 2 . . . . 32 GLN HE21 . 10306 1 287 . 1 1 32 32 GLN HE22 H 1 6.808 0.030 . 2 . . . . 32 GLN HE22 . 10306 1 288 . 1 1 32 32 GLN HG2 H 1 2.344 0.030 . 2 . . . . 32 GLN HG2 . 10306 1 289 . 1 1 32 32 GLN HG3 H 1 2.487 0.030 . 2 . . . . 32 GLN HG3 . 10306 1 290 . 1 1 32 32 GLN C C 13 177.768 0.300 . 1 . . . . 32 GLN C . 10306 1 291 . 1 1 32 32 GLN CA C 13 57.811 0.300 . 1 . . . . 32 GLN CA . 10306 1 292 . 1 1 32 32 GLN CB C 13 29.591 0.300 . 1 . . . . 32 GLN CB . 10306 1 293 . 1 1 32 32 GLN CG C 13 34.130 0.300 . 1 . . . . 32 GLN CG . 10306 1 294 . 1 1 32 32 GLN N N 15 114.842 0.300 . 1 . . . . 32 GLN N . 10306 1 295 . 1 1 32 32 GLN NE2 N 15 111.208 0.300 . 1 . . . . 32 GLN NE2 . 10306 1 296 . 1 1 33 33 THR H H 1 7.944 0.030 . 1 . . . . 33 THR H . 10306 1 297 . 1 1 33 33 THR HA H 1 4.125 0.030 . 1 . . . . 33 THR HA . 10306 1 298 . 1 1 33 33 THR HB H 1 2.695 0.030 . 1 . . . . 33 THR HB . 10306 1 299 . 1 1 33 33 THR HG21 H 1 0.710 0.030 . 1 . . . . 33 THR HG2 . 10306 1 300 . 1 1 33 33 THR HG22 H 1 0.710 0.030 . 1 . . . . 33 THR HG2 . 10306 1 301 . 1 1 33 33 THR HG23 H 1 0.710 0.030 . 1 . . . . 33 THR HG2 . 10306 1 302 . 1 1 33 33 THR C C 13 174.140 0.300 . 1 . . . . 33 THR C . 10306 1 303 . 1 1 33 33 THR CA C 13 64.315 0.300 . 1 . . . . 33 THR CA . 10306 1 304 . 1 1 33 33 THR CB C 13 69.889 0.300 . 1 . . . . 33 THR CB . 10306 1 305 . 1 1 33 33 THR CG2 C 13 21.822 0.300 . 1 . . . . 33 THR CG2 . 10306 1 306 . 1 1 33 33 THR N N 15 112.017 0.300 . 1 . . . . 33 THR N . 10306 1 307 . 1 1 34 34 HIS H H 1 7.619 0.030 . 1 . . . . 34 HIS H . 10306 1 308 . 1 1 34 34 HIS HA H 1 5.236 0.030 . 1 . . . . 34 HIS HA . 10306 1 309 . 1 1 34 34 HIS HB2 H 1 3.425 0.030 . 2 . . . . 34 HIS HB2 . 10306 1 310 . 1 1 34 34 HIS HB3 H 1 3.091 0.030 . 2 . . . . 34 HIS HB3 . 10306 1 311 . 1 1 34 34 HIS HD2 H 1 6.640 0.030 . 1 . . . . 34 HIS HD2 . 10306 1 312 . 1 1 34 34 HIS HE1 H 1 7.906 0.030 . 1 . . . . 34 HIS HE1 . 10306 1 313 . 1 1 34 34 HIS C C 13 175.084 0.300 . 1 . . . . 34 HIS C . 10306 1 314 . 1 1 34 34 HIS CA C 13 53.809 0.300 . 1 . . . . 34 HIS CA . 10306 1 315 . 1 1 34 34 HIS CB C 13 29.267 0.300 . 1 . . . . 34 HIS CB . 10306 1 316 . 1 1 34 34 HIS CD2 C 13 127.769 0.300 . 1 . . . . 34 HIS CD2 . 10306 1 317 . 1 1 34 34 HIS CE1 C 13 139.629 0.300 . 1 . . . . 34 HIS CE1 . 10306 1 318 . 1 1 34 34 HIS N N 15 117.860 0.300 . 1 . . . . 34 HIS N . 10306 1 319 . 1 1 35 35 SER H H 1 7.904 0.030 . 1 . . . . 35 SER H . 10306 1 320 . 1 1 35 35 SER HA H 1 4.506 0.030 . 1 . . . . 35 SER HA . 10306 1 321 . 1 1 35 35 SER HB2 H 1 3.969 0.030 . 1 . . . . 35 SER HB2 . 10306 1 322 . 1 1 35 35 SER HB3 H 1 3.969 0.030 . 1 . . . . 35 SER HB3 . 10306 1 323 . 1 1 35 35 SER C C 13 174.284 0.300 . 1 . . . . 35 SER C . 10306 1 324 . 1 1 35 35 SER CA C 13 59.035 0.300 . 1 . . . . 35 SER CA . 10306 1 325 . 1 1 35 35 SER CB C 13 63.953 0.300 . 1 . . . . 35 SER CB . 10306 1 326 . 1 1 35 35 SER N N 15 115.279 0.300 . 1 . . . . 35 SER N . 10306 1 327 . 1 1 36 36 ASP H H 1 8.540 0.030 . 1 . . . . 36 ASP H . 10306 1 328 . 1 1 36 36 ASP HA H 1 4.590 0.030 . 1 . . . . 36 ASP HA . 10306 1 329 . 1 1 36 36 ASP HB2 H 1 2.698 0.030 . 1 . . . . 36 ASP HB2 . 10306 1 330 . 1 1 36 36 ASP HB3 H 1 2.698 0.030 . 1 . . . . 36 ASP HB3 . 10306 1 331 . 1 1 36 36 ASP C C 13 176.471 0.300 . 1 . . . . 36 ASP C . 10306 1 332 . 1 1 36 36 ASP CA C 13 54.500 0.300 . 1 . . . . 36 ASP CA . 10306 1 333 . 1 1 36 36 ASP CB C 13 40.788 0.300 . 1 . . . . 36 ASP CB . 10306 1 334 . 1 1 36 36 ASP N N 15 121.908 0.300 . 1 . . . . 36 ASP N . 10306 1 335 . 1 1 37 37 LYS H H 1 8.274 0.030 . 1 . . . . 37 LYS H . 10306 1 336 . 1 1 37 37 LYS HA H 1 4.398 0.030 . 1 . . . . 37 LYS HA . 10306 1 337 . 1 1 37 37 LYS HB2 H 1 1.756 0.030 . 2 . . . . 37 LYS HB2 . 10306 1 338 . 1 1 37 37 LYS HB3 H 1 1.927 0.030 . 2 . . . . 37 LYS HB3 . 10306 1 339 . 1 1 37 37 LYS HD2 H 1 1.657 0.030 . 1 . . . . 37 LYS HD2 . 10306 1 340 . 1 1 37 37 LYS HD3 H 1 1.657 0.030 . 1 . . . . 37 LYS HD3 . 10306 1 341 . 1 1 37 37 LYS HE2 H 1 3.003 0.030 . 1 . . . . 37 LYS HE2 . 10306 1 342 . 1 1 37 37 LYS HE3 H 1 3.003 0.030 . 1 . . . . 37 LYS HE3 . 10306 1 343 . 1 1 37 37 LYS HG2 H 1 1.435 0.030 . 1 . . . . 37 LYS HG2 . 10306 1 344 . 1 1 37 37 LYS HG3 H 1 1.435 0.030 . 1 . . . . 37 LYS HG3 . 10306 1 345 . 1 1 37 37 LYS C C 13 176.740 0.300 . 1 . . . . 37 LYS C . 10306 1 346 . 1 1 37 37 LYS CA C 13 56.004 0.300 . 1 . . . . 37 LYS CA . 10306 1 347 . 1 1 37 37 LYS CB C 13 32.587 0.300 . 1 . . . . 37 LYS CB . 10306 1 348 . 1 1 37 37 LYS CD C 13 28.816 0.300 . 1 . . . . 37 LYS CD . 10306 1 349 . 1 1 37 37 LYS CE C 13 42.233 0.300 . 1 . . . . 37 LYS CE . 10306 1 350 . 1 1 37 37 LYS CG C 13 24.552 0.300 . 1 . . . . 37 LYS CG . 10306 1 351 . 1 1 37 37 LYS N N 15 121.853 0.300 . 1 . . . . 37 LYS N . 10306 1 352 . 1 1 38 38 SER H H 1 8.297 0.030 . 1 . . . . 38 SER H . 10306 1 353 . 1 1 38 38 SER HA H 1 4.472 0.030 . 1 . . . . 38 SER HA . 10306 1 354 . 1 1 38 38 SER HB2 H 1 3.876 0.030 . 1 . . . . 38 SER HB2 . 10306 1 355 . 1 1 38 38 SER HB3 H 1 3.876 0.030 . 1 . . . . 38 SER HB3 . 10306 1 356 . 1 1 38 38 SER C C 13 174.611 0.300 . 1 . . . . 38 SER C . 10306 1 357 . 1 1 38 38 SER CA C 13 58.676 0.300 . 1 . . . . 38 SER CA . 10306 1 358 . 1 1 38 38 SER CB C 13 64.008 0.300 . 1 . . . . 38 SER CB . 10306 1 359 . 1 1 38 38 SER N N 15 116.619 0.300 . 1 . . . . 38 SER N . 10306 1 360 . 1 1 39 39 GLY H H 1 8.229 0.030 . 1 . . . . 39 GLY H . 10306 1 361 . 1 1 39 39 GLY HA2 H 1 4.177 0.030 . 2 . . . . 39 GLY HA2 . 10306 1 362 . 1 1 39 39 GLY HA3 H 1 4.078 0.030 . 2 . . . . 39 GLY HA3 . 10306 1 363 . 1 1 39 39 GLY C C 13 171.790 0.300 . 1 . . . . 39 GLY C . 10306 1 364 . 1 1 39 39 GLY CA C 13 44.715 0.300 . 1 . . . . 39 GLY CA . 10306 1 365 . 1 1 39 39 GLY N N 15 110.648 0.300 . 1 . . . . 39 GLY N . 10306 1 366 . 1 1 40 40 PRO HA H 1 4.484 0.030 . 1 . . . . 40 PRO HA . 10306 1 367 . 1 1 40 40 PRO HB2 H 1 2.299 0.030 . 2 . . . . 40 PRO HB2 . 10306 1 368 . 1 1 40 40 PRO HB3 H 1 1.976 0.030 . 2 . . . . 40 PRO HB3 . 10306 1 369 . 1 1 40 40 PRO HD2 H 1 3.637 0.030 . 1 . . . . 40 PRO HD2 . 10306 1 370 . 1 1 40 40 PRO HD3 H 1 3.637 0.030 . 1 . . . . 40 PRO HD3 . 10306 1 371 . 1 1 40 40 PRO HG2 H 1 2.021 0.030 . 1 . . . . 40 PRO HG2 . 10306 1 372 . 1 1 40 40 PRO HG3 H 1 2.021 0.030 . 1 . . . . 40 PRO HG3 . 10306 1 373 . 1 1 40 40 PRO C C 13 177.416 0.300 . 1 . . . . 40 PRO C . 10306 1 374 . 1 1 40 40 PRO CA C 13 63.265 0.300 . 1 . . . . 40 PRO CA . 10306 1 375 . 1 1 40 40 PRO CB C 13 32.219 0.300 . 1 . . . . 40 PRO CB . 10306 1 376 . 1 1 40 40 PRO CD C 13 49.842 0.300 . 1 . . . . 40 PRO CD . 10306 1 377 . 1 1 40 40 PRO CG C 13 27.174 0.300 . 1 . . . . 40 PRO CG . 10306 1 378 . 1 1 41 41 SER H H 1 8.521 0.030 . 1 . . . . 41 SER H . 10306 1 379 . 1 1 41 41 SER HA H 1 4.510 0.030 . 1 . . . . 41 SER HA . 10306 1 380 . 1 1 41 41 SER HB2 H 1 3.900 0.030 . 1 . . . . 41 SER HB2 . 10306 1 381 . 1 1 41 41 SER HB3 H 1 3.900 0.030 . 1 . . . . 41 SER HB3 . 10306 1 382 . 1 1 41 41 SER C C 13 174.698 0.300 . 1 . . . . 41 SER C . 10306 1 383 . 1 1 41 41 SER CA C 13 58.354 0.300 . 1 . . . . 41 SER CA . 10306 1 384 . 1 1 41 41 SER CB C 13 63.971 0.300 . 1 . . . . 41 SER CB . 10306 1 385 . 1 1 41 41 SER N N 15 116.426 0.300 . 1 . . . . 41 SER N . 10306 1 386 . 1 1 42 42 SER HA H 1 4.502 0.030 . 1 . . . . 42 SER HA . 10306 1 387 . 1 1 42 42 SER HB2 H 1 3.876 0.030 . 1 . . . . 42 SER HB2 . 10306 1 388 . 1 1 42 42 SER HB3 H 1 3.876 0.030 . 1 . . . . 42 SER HB3 . 10306 1 389 . 1 1 42 42 SER C C 13 173.915 0.300 . 1 . . . . 42 SER C . 10306 1 390 . 1 1 42 42 SER CA C 13 58.372 0.300 . 1 . . . . 42 SER CA . 10306 1 391 . 1 1 42 42 SER CB C 13 64.043 0.300 . 1 . . . . 42 SER CB . 10306 1 392 . 1 1 43 43 GLY H H 1 8.045 0.030 . 1 . . . . 43 GLY H . 10306 1 393 . 1 1 43 43 GLY HA2 H 1 3.757 0.030 . 2 . . . . 43 GLY HA2 . 10306 1 394 . 1 1 43 43 GLY HA3 H 1 3.798 0.030 . 2 . . . . 43 GLY HA3 . 10306 1 395 . 1 1 43 43 GLY C C 13 178.972 0.300 . 1 . . . . 43 GLY C . 10306 1 396 . 1 1 43 43 GLY CA C 13 46.222 0.300 . 1 . . . . 43 GLY CA . 10306 1 397 . 1 1 43 43 GLY N N 15 116.884 0.300 . 1 . . . . 43 GLY N . 10306 1 stop_ save_