################################### # 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 10190 _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 10190 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10190 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 SER CA C 13 58.454 0.300 . 1 . . . . 8 SER CA . 10190 1 2 . 1 1 8 8 SER HA H 1 4.440 0.030 . 1 . . . . 8 SER HA . 10190 1 3 . 1 1 8 8 SER CB C 13 63.904 0.300 . 1 . . . . 8 SER CB . 10190 1 4 . 1 1 8 8 SER HB3 H 1 3.856 0.030 . 1 . . . . 8 SER HB3 . 10190 1 5 . 1 1 8 8 SER C C 13 175.126 0.300 . 1 . . . . 8 SER C . 10190 1 6 . 1 1 8 8 SER HB2 H 1 3.856 0.030 . 1 . . . . 8 SER HB2 . 10190 1 7 . 1 1 9 9 GLY N N 15 110.864 0.300 . 1 . . . . 9 GLY N . 10190 1 8 . 1 1 9 9 GLY H H 1 8.493 0.030 . 1 . . . . 9 GLY H . 10190 1 9 . 1 1 9 9 GLY CA C 13 45.376 0.300 . 1 . . . . 9 GLY CA . 10190 1 10 . 1 1 9 9 GLY C C 13 174.128 0.300 . 1 . . . . 9 GLY C . 10190 1 11 . 1 1 9 9 GLY HA2 H 1 3.960 0.030 . 2 . . . . 9 GLY HA2 . 10190 1 12 . 1 1 10 10 GLU N N 15 120.050 0.300 . 1 . . . . 10 GLU N . 10190 1 13 . 1 1 10 10 GLU H H 1 8.255 0.030 . 1 . . . . 10 GLU H . 10190 1 14 . 1 1 10 10 GLU CA C 13 56.893 0.300 . 1 . . . . 10 GLU CA . 10190 1 15 . 1 1 10 10 GLU HA H 1 4.236 0.030 . 1 . . . . 10 GLU HA . 10190 1 16 . 1 1 10 10 GLU CB C 13 30.417 0.300 . 1 . . . . 10 GLU CB . 10190 1 17 . 1 1 10 10 GLU HB3 H 1 2.034 0.030 . 2 . . . . 10 GLU HB3 . 10190 1 18 . 1 1 10 10 GLU CG C 13 36.351 0.300 . 1 . . . . 10 GLU CG . 10190 1 19 . 1 1 10 10 GLU HG3 H 1 2.274 0.030 . 2 . . . . 10 GLU HG3 . 10190 1 20 . 1 1 10 10 GLU C C 13 176.477 0.300 . 1 . . . . 10 GLU C . 10190 1 21 . 1 1 10 10 GLU HB2 H 1 1.922 0.030 . 2 . . . . 10 GLU HB2 . 10190 1 22 . 1 1 10 10 GLU HG2 H 1 2.244 0.030 . 2 . . . . 10 GLU HG2 . 10190 1 23 . 1 1 11 11 ARG N N 15 121.287 0.300 . 1 . . . . 11 ARG N . 10190 1 24 . 1 1 11 11 ARG H H 1 8.311 0.030 . 1 . . . . 11 ARG H . 10190 1 25 . 1 1 11 11 ARG CA C 13 53.586 0.300 . 1 . . . . 11 ARG CA . 10190 1 26 . 1 1 11 11 ARG HA H 1 4.588 0.030 . 1 . . . . 11 ARG HA . 10190 1 27 . 1 1 11 11 ARG CB C 13 30.618 0.300 . 1 . . . . 11 ARG CB . 10190 1 28 . 1 1 11 11 ARG HB3 H 1 1.465 0.030 . 2 . . . . 11 ARG HB3 . 10190 1 29 . 1 1 11 11 ARG CG C 13 26.813 0.300 . 1 . . . . 11 ARG CG . 10190 1 30 . 1 1 11 11 ARG HG3 H 1 1.386 0.030 . 2 . . . . 11 ARG HG3 . 10190 1 31 . 1 1 11 11 ARG CD C 13 43.539 0.300 . 1 . . . . 11 ARG CD . 10190 1 32 . 1 1 11 11 ARG HD3 H 1 3.077 0.030 . 1 . . . . 11 ARG HD3 . 10190 1 33 . 1 1 11 11 ARG C C 13 173.631 0.300 . 1 . . . . 11 ARG C . 10190 1 34 . 1 1 11 11 ARG HB2 H 1 1.597 0.030 . 2 . . . . 11 ARG HB2 . 10190 1 35 . 1 1 11 11 ARG HD2 H 1 3.077 0.030 . 1 . . . . 11 ARG HD2 . 10190 1 36 . 1 1 11 11 ARG HG2 H 1 1.510 0.030 . 2 . . . . 11 ARG HG2 . 10190 1 37 . 1 1 12 12 PRO CA C 13 63.542 0.300 . 1 . . . . 12 PRO CA . 10190 1 38 . 1 1 12 12 PRO HA H 1 4.349 0.030 . 1 . . . . 12 PRO HA . 10190 1 39 . 1 1 12 12 PRO CB C 13 32.216 0.300 . 1 . . . . 12 PRO CB . 10190 1 40 . 1 1 12 12 PRO HB3 H 1 2.017 0.030 . 2 . . . . 12 PRO HB3 . 10190 1 41 . 1 1 12 12 PRO CG C 13 26.534 0.300 . 1 . . . . 12 PRO CG . 10190 1 42 . 1 1 12 12 PRO HG3 H 1 1.502 0.030 . 2 . . . . 12 PRO HG3 . 10190 1 43 . 1 1 12 12 PRO CD C 13 50.192 0.300 . 1 . . . . 12 PRO CD . 10190 1 44 . 1 1 12 12 PRO HD3 H 1 3.575 0.030 . 1 . . . . 12 PRO HD3 . 10190 1 45 . 1 1 12 12 PRO C C 13 176.387 0.300 . 1 . . . . 12 PRO C . 10190 1 46 . 1 1 12 12 PRO HB2 H 1 1.384 0.030 . 2 . . . . 12 PRO HB2 . 10190 1 47 . 1 1 12 12 PRO HD2 H 1 3.575 0.030 . 1 . . . . 12 PRO HD2 . 10190 1 48 . 1 1 12 12 PRO HG2 H 1 1.802 0.030 . 2 . . . . 12 PRO HG2 . 10190 1 49 . 1 1 13 13 TYR N N 15 119.060 0.300 . 1 . . . . 13 TYR N . 10190 1 50 . 1 1 13 13 TYR H H 1 8.102 0.030 . 1 . . . . 13 TYR H . 10190 1 51 . 1 1 13 13 TYR CA C 13 56.965 0.300 . 1 . . . . 13 TYR CA . 10190 1 52 . 1 1 13 13 TYR HA H 1 4.754 0.030 . 1 . . . . 13 TYR HA . 10190 1 53 . 1 1 13 13 TYR CB C 13 38.432 0.300 . 1 . . . . 13 TYR CB . 10190 1 54 . 1 1 13 13 TYR HB3 H 1 2.942 0.030 . 2 . . . . 13 TYR HB3 . 10190 1 55 . 1 1 13 13 TYR CD1 C 13 133.127 0.300 . 1 . . . . 13 TYR CD1 . 10190 1 56 . 1 1 13 13 TYR HD1 H 1 7.068 0.030 . 1 . . . . 13 TYR HD1 . 10190 1 57 . 1 1 13 13 TYR CD2 C 13 133.127 0.300 . 1 . . . . 13 TYR CD2 . 10190 1 58 . 1 1 13 13 TYR HD2 H 1 7.068 0.030 . 1 . . . . 13 TYR HD2 . 10190 1 59 . 1 1 13 13 TYR CE1 C 13 118.432 0.300 . 1 . . . . 13 TYR CE1 . 10190 1 60 . 1 1 13 13 TYR HE1 H 1 6.847 0.030 . 1 . . . . 13 TYR HE1 . 10190 1 61 . 1 1 13 13 TYR CE2 C 13 118.432 0.300 . 1 . . . . 13 TYR CE2 . 10190 1 62 . 1 1 13 13 TYR HE2 H 1 6.847 0.030 . 1 . . . . 13 TYR HE2 . 10190 1 63 . 1 1 13 13 TYR C C 13 175.135 0.300 . 1 . . . . 13 TYR C . 10190 1 64 . 1 1 13 13 TYR HB2 H 1 3.065 0.030 . 2 . . . . 13 TYR HB2 . 10190 1 65 . 1 1 14 14 GLY N N 15 111.562 0.300 . 1 . . . . 14 GLY N . 10190 1 66 . 1 1 14 14 GLY H H 1 8.513 0.030 . 1 . . . . 14 GLY H . 10190 1 67 . 1 1 14 14 GLY CA C 13 45.058 0.300 . 1 . . . . 14 GLY CA . 10190 1 68 . 1 1 14 14 GLY HA3 H 1 4.932 0.030 . 2 . . . . 14 GLY HA3 . 10190 1 69 . 1 1 14 14 GLY C C 13 172.508 0.300 . 1 . . . . 14 GLY C . 10190 1 70 . 1 1 14 14 GLY HA2 H 1 3.638 0.030 . 2 . . . . 14 GLY HA2 . 10190 1 71 . 1 1 15 15 CYS N N 15 124.194 0.300 . 1 . . . . 15 CYS N . 10190 1 72 . 1 1 15 15 CYS H H 1 9.008 0.030 . 1 . . . . 15 CYS H . 10190 1 73 . 1 1 15 15 CYS CA C 13 58.959 0.300 . 1 . . . . 15 CYS CA . 10190 1 74 . 1 1 15 15 CYS HA H 1 4.695 0.030 . 1 . . . . 15 CYS HA . 10190 1 75 . 1 1 15 15 CYS CB C 13 30.119 0.300 . 1 . . . . 15 CYS CB . 10190 1 76 . 1 1 15 15 CYS HB3 H 1 3.392 0.030 . 2 . . . . 15 CYS HB3 . 10190 1 77 . 1 1 15 15 CYS C C 13 177.447 0.300 . 1 . . . . 15 CYS C . 10190 1 78 . 1 1 15 15 CYS HB2 H 1 2.817 0.030 . 2 . . . . 15 CYS HB2 . 10190 1 79 . 1 1 16 16 ASN N N 15 129.997 0.300 . 1 . . . . 16 ASN N . 10190 1 80 . 1 1 16 16 ASN H H 1 9.480 0.030 . 1 . . . . 16 ASN H . 10190 1 81 . 1 1 16 16 ASN CA C 13 55.267 0.300 . 1 . . . . 16 ASN CA . 10190 1 82 . 1 1 16 16 ASN HA H 1 4.625 0.030 . 1 . . . . 16 ASN HA . 10190 1 83 . 1 1 16 16 ASN CB C 13 38.516 0.300 . 1 . . . . 16 ASN CB . 10190 1 84 . 1 1 16 16 ASN HB3 H 1 2.915 0.030 . 1 . . . . 16 ASN HB3 . 10190 1 85 . 1 1 16 16 ASN ND2 N 15 113.191 0.300 . 1 . . . . 16 ASN ND2 . 10190 1 86 . 1 1 16 16 ASN HD21 H 1 7.703 0.030 . 2 . . . . 16 ASN HD21 . 10190 1 87 . 1 1 16 16 ASN HD22 H 1 6.997 0.030 . 2 . . . . 16 ASN HD22 . 10190 1 88 . 1 1 16 16 ASN C C 13 175.463 0.300 . 1 . . . . 16 ASN C . 10190 1 89 . 1 1 16 16 ASN HB2 H 1 2.915 0.030 . 1 . . . . 16 ASN HB2 . 10190 1 90 . 1 1 17 17 GLU N N 15 121.690 0.300 . 1 . . . . 17 GLU N . 10190 1 91 . 1 1 17 17 GLU H H 1 9.024 0.030 . 1 . . . . 17 GLU H . 10190 1 92 . 1 1 17 17 GLU CA C 13 58.253 0.300 . 1 . . . . 17 GLU CA . 10190 1 93 . 1 1 17 17 GLU HA H 1 4.239 0.030 . 1 . . . . 17 GLU HA . 10190 1 94 . 1 1 17 17 GLU CB C 13 29.490 0.300 . 1 . . . . 17 GLU CB . 10190 1 95 . 1 1 17 17 GLU HB3 H 1 1.371 0.030 . 2 . . . . 17 GLU HB3 . 10190 1 96 . 1 1 17 17 GLU CG C 13 35.473 0.300 . 1 . . . . 17 GLU CG . 10190 1 97 . 1 1 17 17 GLU HG3 H 1 1.842 0.030 . 2 . . . . 17 GLU HG3 . 10190 1 98 . 1 1 17 17 GLU C C 13 177.355 0.300 . 1 . . . . 17 GLU C . 10190 1 99 . 1 1 17 17 GLU HB2 H 1 1.439 0.030 . 2 . . . . 17 GLU HB2 . 10190 1 100 . 1 1 17 17 GLU HG2 H 1 1.885 0.030 . 2 . . . . 17 GLU HG2 . 10190 1 101 . 1 1 18 18 CYS N N 15 115.999 0.300 . 1 . . . . 18 CYS N . 10190 1 102 . 1 1 18 18 CYS H H 1 8.351 0.030 . 1 . . . . 18 CYS H . 10190 1 103 . 1 1 18 18 CYS CA C 13 58.536 0.300 . 1 . . . . 18 CYS CA . 10190 1 104 . 1 1 18 18 CYS HA H 1 5.170 0.030 . 1 . . . . 18 CYS HA . 10190 1 105 . 1 1 18 18 CYS CB C 13 32.295 0.300 . 1 . . . . 18 CYS CB . 10190 1 106 . 1 1 18 18 CYS HB3 H 1 3.419 0.030 . 2 . . . . 18 CYS HB3 . 10190 1 107 . 1 1 18 18 CYS C C 13 176.224 0.300 . 1 . . . . 18 CYS C . 10190 1 108 . 1 1 18 18 CYS HB2 H 1 2.904 0.030 . 2 . . . . 18 CYS HB2 . 10190 1 109 . 1 1 19 19 GLY N N 15 112.718 0.300 . 1 . . . . 19 GLY N . 10190 1 110 . 1 1 19 19 GLY H H 1 8.032 0.030 . 1 . . . . 19 GLY H . 10190 1 111 . 1 1 19 19 GLY CA C 13 46.253 0.300 . 1 . . . . 19 GLY CA . 10190 1 112 . 1 1 19 19 GLY HA3 H 1 4.228 0.030 . 2 . . . . 19 GLY HA3 . 10190 1 113 . 1 1 19 19 GLY C C 13 174.201 0.300 . 1 . . . . 19 GLY C . 10190 1 114 . 1 1 19 19 GLY HA2 H 1 3.901 0.030 . 2 . . . . 19 GLY HA2 . 10190 1 115 . 1 1 20 20 LYS N N 15 122.353 0.300 . 1 . . . . 20 LYS N . 10190 1 116 . 1 1 20 20 LYS H H 1 7.856 0.030 . 1 . . . . 20 LYS H . 10190 1 117 . 1 1 20 20 LYS CA C 13 57.657 0.300 . 1 . . . . 20 LYS CA . 10190 1 118 . 1 1 20 20 LYS HA H 1 4.043 0.030 . 1 . . . . 20 LYS HA . 10190 1 119 . 1 1 20 20 LYS CB C 13 34.015 0.300 . 1 . . . . 20 LYS CB . 10190 1 120 . 1 1 20 20 LYS HB3 H 1 1.388 0.030 . 2 . . . . 20 LYS HB3 . 10190 1 121 . 1 1 20 20 LYS CG C 13 26.261 0.300 . 1 . . . . 20 LYS CG . 10190 1 122 . 1 1 20 20 LYS HG3 H 1 1.159 0.030 . 2 . . . . 20 LYS HG3 . 10190 1 123 . 1 1 20 20 LYS CD C 13 29.225 0.300 . 1 . . . . 20 LYS CD . 10190 1 124 . 1 1 20 20 LYS HD3 H 1 1.534 0.030 . 1 . . . . 20 LYS HD3 . 10190 1 125 . 1 1 20 20 LYS CE C 13 42.261 0.300 . 1 . . . . 20 LYS CE . 10190 1 126 . 1 1 20 20 LYS HE3 H 1 2.944 0.030 . 2 . . . . 20 LYS HE3 . 10190 1 127 . 1 1 20 20 LYS C C 13 173.954 0.300 . 1 . . . . 20 LYS C . 10190 1 128 . 1 1 20 20 LYS HB2 H 1 1.237 0.030 . 2 . . . . 20 LYS HB2 . 10190 1 129 . 1 1 20 20 LYS HD2 H 1 1.534 0.030 . 1 . . . . 20 LYS HD2 . 10190 1 130 . 1 1 20 20 LYS HE2 H 1 2.997 0.030 . 2 . . . . 20 LYS HE2 . 10190 1 131 . 1 1 20 20 LYS HG2 H 1 1.464 0.030 . 2 . . . . 20 LYS HG2 . 10190 1 132 . 1 1 21 21 ASN N N 15 117.851 0.300 . 1 . . . . 21 ASN N . 10190 1 133 . 1 1 21 21 ASN H H 1 7.905 0.030 . 1 . . . . 21 ASN H . 10190 1 134 . 1 1 21 21 ASN CA C 13 51.903 0.300 . 1 . . . . 21 ASN CA . 10190 1 135 . 1 1 21 21 ASN HA H 1 5.337 0.030 . 1 . . . . 21 ASN HA . 10190 1 136 . 1 1 21 21 ASN CB C 13 41.671 0.300 . 1 . . . . 21 ASN CB . 10190 1 137 . 1 1 21 21 ASN HB3 H 1 2.498 0.030 . 2 . . . . 21 ASN HB3 . 10190 1 138 . 1 1 21 21 ASN ND2 N 15 112.750 0.300 . 1 . . . . 21 ASN ND2 . 10190 1 139 . 1 1 21 21 ASN HD21 H 1 7.304 0.030 . 2 . . . . 21 ASN HD21 . 10190 1 140 . 1 1 21 21 ASN HD22 H 1 6.761 0.030 . 2 . . . . 21 ASN HD22 . 10190 1 141 . 1 1 21 21 ASN C C 13 174.118 0.300 . 1 . . . . 21 ASN C . 10190 1 142 . 1 1 21 21 ASN HB2 H 1 2.622 0.030 . 2 . . . . 21 ASN HB2 . 10190 1 143 . 1 1 22 22 PHE N N 15 117.132 0.300 . 1 . . . . 22 PHE N . 10190 1 144 . 1 1 22 22 PHE H H 1 8.604 0.030 . 1 . . . . 22 PHE H . 10190 1 145 . 1 1 22 22 PHE CA C 13 57.519 0.300 . 1 . . . . 22 PHE CA . 10190 1 146 . 1 1 22 22 PHE HA H 1 4.753 0.030 . 1 . . . . 22 PHE HA . 10190 1 147 . 1 1 22 22 PHE CB C 13 43.604 0.300 . 1 . . . . 22 PHE CB . 10190 1 148 . 1 1 22 22 PHE HB3 H 1 3.478 0.030 . 2 . . . . 22 PHE HB3 . 10190 1 149 . 1 1 22 22 PHE CD1 C 13 132.208 0.300 . 1 . . . . 22 PHE CD1 . 10190 1 150 . 1 1 22 22 PHE HD1 H 1 7.316 0.030 . 1 . . . . 22 PHE HD1 . 10190 1 151 . 1 1 22 22 PHE CD2 C 13 132.208 0.300 . 1 . . . . 22 PHE CD2 . 10190 1 152 . 1 1 22 22 PHE HD2 H 1 7.316 0.030 . 1 . . . . 22 PHE HD2 . 10190 1 153 . 1 1 22 22 PHE CE1 C 13 130.654 0.300 . 1 . . . . 22 PHE CE1 . 10190 1 154 . 1 1 22 22 PHE HE1 H 1 6.823 0.030 . 1 . . . . 22 PHE HE1 . 10190 1 155 . 1 1 22 22 PHE CE2 C 13 130.654 0.300 . 1 . . . . 22 PHE CE2 . 10190 1 156 . 1 1 22 22 PHE HE2 H 1 6.823 0.030 . 1 . . . . 22 PHE HE2 . 10190 1 157 . 1 1 22 22 PHE CZ C 13 128.660 0.300 . 1 . . . . 22 PHE CZ . 10190 1 158 . 1 1 22 22 PHE HZ H 1 6.114 0.030 . 1 . . . . 22 PHE HZ . 10190 1 159 . 1 1 22 22 PHE C C 13 175.478 0.300 . 1 . . . . 22 PHE C . 10190 1 160 . 1 1 22 22 PHE HB2 H 1 2.894 0.030 . 2 . . . . 22 PHE HB2 . 10190 1 161 . 1 1 23 23 GLY CA C 13 45.805 0.300 . 1 . . . . 23 GLY CA . 10190 1 162 . 1 1 23 23 GLY HA3 H 1 4.493 0.030 . 2 . . . . 23 GLY HA3 . 10190 1 163 . 1 1 23 23 GLY HA2 H 1 4.065 0.030 . 2 . . . . 23 GLY HA2 . 10190 1 164 . 1 1 24 24 ARG N N 15 115.504 0.300 . 1 . . . . 24 ARG N . 10190 1 165 . 1 1 24 24 ARG H H 1 7.280 0.030 . 1 . . . . 24 ARG H . 10190 1 166 . 1 1 24 24 ARG CA C 13 53.903 0.300 . 1 . . . . 24 ARG CA . 10190 1 167 . 1 1 24 24 ARG HA H 1 4.647 0.030 . 1 . . . . 24 ARG HA . 10190 1 168 . 1 1 24 24 ARG CB C 13 33.063 0.300 . 1 . . . . 24 ARG CB . 10190 1 169 . 1 1 24 24 ARG HB3 H 1 0.961 0.030 . 2 . . . . 24 ARG HB3 . 10190 1 170 . 1 1 24 24 ARG CG C 13 26.699 0.300 . 1 . . . . 24 ARG CG . 10190 1 171 . 1 1 24 24 ARG HG3 H 1 1.460 0.030 . 1 . . . . 24 ARG HG3 . 10190 1 172 . 1 1 24 24 ARG CD C 13 43.218 0.300 . 1 . . . . 24 ARG CD . 10190 1 173 . 1 1 24 24 ARG HD3 H 1 2.899 0.030 . 2 . . . . 24 ARG HD3 . 10190 1 174 . 1 1 24 24 ARG HB2 H 1 1.642 0.030 . 2 . . . . 24 ARG HB2 . 10190 1 175 . 1 1 24 24 ARG HD2 H 1 2.980 0.030 . 2 . . . . 24 ARG HD2 . 10190 1 176 . 1 1 24 24 ARG HG2 H 1 1.460 0.030 . 1 . . . . 24 ARG HG2 . 10190 1 177 . 1 1 25 25 HIS N N 15 112.630 0.300 . 1 . . . . 25 HIS N . 10190 1 178 . 1 1 25 25 HIS H H 1 8.702 0.030 . 1 . . . . 25 HIS H . 10190 1 179 . 1 1 25 25 HIS CA C 13 60.282 0.300 . 1 . . . . 25 HIS CA . 10190 1 180 . 1 1 25 25 HIS HA H 1 3.275 0.030 . 1 . . . . 25 HIS HA . 10190 1 181 . 1 1 25 25 HIS CB C 13 30.569 0.300 . 1 . . . . 25 HIS CB . 10190 1 182 . 1 1 25 25 HIS HB3 H 1 2.479 0.030 . 2 . . . . 25 HIS HB3 . 10190 1 183 . 1 1 25 25 HIS CD2 C 13 118.432 0.300 . 1 . . . . 25 HIS CD2 . 10190 1 184 . 1 1 25 25 HIS HD2 H 1 6.844 0.030 . 1 . . . . 25 HIS HD2 . 10190 1 185 . 1 1 25 25 HIS CE1 C 13 138.215 0.300 . 1 . . . . 25 HIS CE1 . 10190 1 186 . 1 1 25 25 HIS HE1 H 1 7.697 0.030 . 1 . . . . 25 HIS HE1 . 10190 1 187 . 1 1 25 25 HIS HB2 H 1 2.798 0.030 . 2 . . . . 25 HIS HB2 . 10190 1 188 . 1 1 26 26 SER CA C 13 61.201 0.300 . 1 . . . . 26 SER CA . 10190 1 189 . 1 1 26 26 SER HA H 1 3.832 0.030 . 1 . . . . 26 SER HA . 10190 1 190 . 1 1 26 26 SER CB C 13 61.402 0.300 . 1 . . . . 26 SER CB . 10190 1 191 . 1 1 26 26 SER HB3 H 1 3.871 0.030 . 1 . . . . 26 SER HB3 . 10190 1 192 . 1 1 26 26 SER C C 13 176.998 0.300 . 1 . . . . 26 SER C . 10190 1 193 . 1 1 26 26 SER HB2 H 1 3.871 0.030 . 1 . . . . 26 SER HB2 . 10190 1 194 . 1 1 27 27 HIS N N 15 120.791 0.300 . 1 . . . . 27 HIS N . 10190 1 195 . 1 1 27 27 HIS H H 1 6.716 0.030 . 1 . . . . 27 HIS H . 10190 1 196 . 1 1 27 27 HIS CA C 13 56.885 0.300 . 1 . . . . 27 HIS CA . 10190 1 197 . 1 1 27 27 HIS HA H 1 4.438 0.030 . 1 . . . . 27 HIS HA . 10190 1 198 . 1 1 27 27 HIS CB C 13 31.710 0.300 . 1 . . . . 27 HIS CB . 10190 1 199 . 1 1 27 27 HIS HB3 H 1 3.359 0.030 . 2 . . . . 27 HIS HB3 . 10190 1 200 . 1 1 27 27 HIS CD2 C 13 116.802 0.300 . 1 . . . . 27 HIS CD2 . 10190 1 201 . 1 1 27 27 HIS HD2 H 1 6.967 0.030 . 1 . . . . 27 HIS HD2 . 10190 1 202 . 1 1 27 27 HIS CE1 C 13 139.025 0.300 . 1 . . . . 27 HIS CE1 . 10190 1 203 . 1 1 27 27 HIS HE1 H 1 7.831 0.030 . 1 . . . . 27 HIS HE1 . 10190 1 204 . 1 1 27 27 HIS C C 13 178.259 0.300 . 1 . . . . 27 HIS C . 10190 1 205 . 1 1 27 27 HIS HB2 H 1 3.175 0.030 . 2 . . . . 27 HIS HB2 . 10190 1 206 . 1 1 28 28 LEU N N 15 121.891 0.300 . 1 . . . . 28 LEU N . 10190 1 207 . 1 1 28 28 LEU H H 1 7.048 0.030 . 1 . . . . 28 LEU H . 10190 1 208 . 1 1 28 28 LEU CA C 13 57.858 0.300 . 1 . . . . 28 LEU CA . 10190 1 209 . 1 1 28 28 LEU HA H 1 3.316 0.030 . 1 . . . . 28 LEU HA . 10190 1 210 . 1 1 28 28 LEU CB C 13 40.235 0.300 . 1 . . . . 28 LEU CB . 10190 1 211 . 1 1 28 28 LEU HB3 H 1 2.031 0.030 . 2 . . . . 28 LEU HB3 . 10190 1 212 . 1 1 28 28 LEU CG C 13 27.815 0.300 . 1 . . . . 28 LEU CG . 10190 1 213 . 1 1 28 28 LEU HG H 1 1.498 0.030 . 1 . . . . 28 LEU HG . 10190 1 214 . 1 1 28 28 LEU CD1 C 13 22.622 0.300 . 2 . . . . 28 LEU CD1 . 10190 1 215 . 1 1 28 28 LEU HD11 H 1 0.997 0.030 . 1 . . . . 28 LEU HD1 . 10190 1 216 . 1 1 28 28 LEU HD12 H 1 0.997 0.030 . 1 . . . . 28 LEU HD1 . 10190 1 217 . 1 1 28 28 LEU HD13 H 1 0.997 0.030 . 1 . . . . 28 LEU HD1 . 10190 1 218 . 1 1 28 28 LEU CD2 C 13 26.290 0.300 . 2 . . . . 28 LEU CD2 . 10190 1 219 . 1 1 28 28 LEU HD21 H 1 1.090 0.030 . 1 . . . . 28 LEU HD2 . 10190 1 220 . 1 1 28 28 LEU HD22 H 1 1.090 0.030 . 1 . . . . 28 LEU HD2 . 10190 1 221 . 1 1 28 28 LEU HD23 H 1 1.090 0.030 . 1 . . . . 28 LEU HD2 . 10190 1 222 . 1 1 28 28 LEU C C 13 177.276 0.300 . 1 . . . . 28 LEU C . 10190 1 223 . 1 1 28 28 LEU HB2 H 1 1.322 0.030 . 2 . . . . 28 LEU HB2 . 10190 1 224 . 1 1 29 29 ILE N N 15 118.247 0.300 . 1 . . . . 29 ILE N . 10190 1 225 . 1 1 29 29 ILE H H 1 7.890 0.030 . 1 . . . . 29 ILE H . 10190 1 226 . 1 1 29 29 ILE CA C 13 63.737 0.300 . 1 . . . . 29 ILE CA . 10190 1 227 . 1 1 29 29 ILE HA H 1 3.547 0.030 . 1 . . . . 29 ILE HA . 10190 1 228 . 1 1 29 29 ILE CB C 13 36.186 0.300 . 1 . . . . 29 ILE CB . 10190 1 229 . 1 1 29 29 ILE HB H 1 1.846 0.030 . 1 . . . . 29 ILE HB . 10190 1 230 . 1 1 29 29 ILE CG1 C 13 27.282 0.300 . 1 . . . . 29 ILE CG1 . 10190 1 231 . 1 1 29 29 ILE HG13 H 1 1.145 0.030 . 2 . . . . 29 ILE HG13 . 10190 1 232 . 1 1 29 29 ILE CG2 C 13 17.276 0.300 . 1 . . . . 29 ILE CG2 . 10190 1 233 . 1 1 29 29 ILE HG21 H 1 0.814 0.030 . 1 . . . . 29 ILE HG2 . 10190 1 234 . 1 1 29 29 ILE HG22 H 1 0.814 0.030 . 1 . . . . 29 ILE HG2 . 10190 1 235 . 1 1 29 29 ILE HG23 H 1 0.814 0.030 . 1 . . . . 29 ILE HG2 . 10190 1 236 . 1 1 29 29 ILE CD1 C 13 10.226 0.300 . 1 . . . . 29 ILE CD1 . 10190 1 237 . 1 1 29 29 ILE HD11 H 1 0.540 0.030 . 1 . . . . 29 ILE HD1 . 10190 1 238 . 1 1 29 29 ILE HD12 H 1 0.540 0.030 . 1 . . . . 29 ILE HD1 . 10190 1 239 . 1 1 29 29 ILE HD13 H 1 0.540 0.030 . 1 . . . . 29 ILE HD1 . 10190 1 240 . 1 1 29 29 ILE C C 13 178.830 0.300 . 1 . . . . 29 ILE C . 10190 1 241 . 1 1 29 29 ILE HG12 H 1 0.970 0.030 . 2 . . . . 29 ILE HG12 . 10190 1 242 . 1 1 30 30 GLU N N 15 117.991 0.300 . 1 . . . . 30 GLU N . 10190 1 243 . 1 1 30 30 GLU H H 1 7.499 0.030 . 1 . . . . 30 GLU H . 10190 1 244 . 1 1 30 30 GLU CA C 13 59.104 0.300 . 1 . . . . 30 GLU CA . 10190 1 245 . 1 1 30 30 GLU HA H 1 3.959 0.030 . 1 . . . . 30 GLU HA . 10190 1 246 . 1 1 30 30 GLU CB C 13 29.435 0.300 . 1 . . . . 30 GLU CB . 10190 1 247 . 1 1 30 30 GLU HB3 H 1 1.985 0.030 . 1 . . . . 30 GLU HB3 . 10190 1 248 . 1 1 30 30 GLU CG C 13 35.642 0.300 . 1 . . . . 30 GLU CG . 10190 1 249 . 1 1 30 30 GLU HG3 H 1 2.325 0.030 . 1 . . . . 30 GLU HG3 . 10190 1 250 . 1 1 30 30 GLU C C 13 178.622 0.300 . 1 . . . . 30 GLU C . 10190 1 251 . 1 1 30 30 GLU HB2 H 1 1.985 0.030 . 1 . . . . 30 GLU HB2 . 10190 1 252 . 1 1 30 30 GLU HG2 H 1 2.325 0.030 . 1 . . . . 30 GLU HG2 . 10190 1 253 . 1 1 31 31 HIS N N 15 119.737 0.300 . 1 . . . . 31 HIS N . 10190 1 254 . 1 1 31 31 HIS H H 1 7.541 0.030 . 1 . . . . 31 HIS H . 10190 1 255 . 1 1 31 31 HIS CA C 13 59.599 0.300 . 1 . . . . 31 HIS CA . 10190 1 256 . 1 1 31 31 HIS HA H 1 4.113 0.030 . 1 . . . . 31 HIS HA . 10190 1 257 . 1 1 31 31 HIS CB C 13 28.503 0.300 . 1 . . . . 31 HIS CB . 10190 1 258 . 1 1 31 31 HIS HB3 H 1 3.208 0.030 . 2 . . . . 31 HIS HB3 . 10190 1 259 . 1 1 31 31 HIS CD2 C 13 127.288 0.300 . 1 . . . . 31 HIS CD2 . 10190 1 260 . 1 1 31 31 HIS HD2 H 1 7.001 0.030 . 1 . . . . 31 HIS HD2 . 10190 1 261 . 1 1 31 31 HIS CE1 C 13 138.978 0.300 . 1 . . . . 31 HIS CE1 . 10190 1 262 . 1 1 31 31 HIS HE1 H 1 7.995 0.030 . 1 . . . . 31 HIS HE1 . 10190 1 263 . 1 1 31 31 HIS C C 13 177.036 0.300 . 1 . . . . 31 HIS C . 10190 1 264 . 1 1 31 31 HIS HB2 H 1 2.762 0.030 . 2 . . . . 31 HIS HB2 . 10190 1 265 . 1 1 32 32 LEU N N 15 118.963 0.300 . 1 . . . . 32 LEU N . 10190 1 266 . 1 1 32 32 LEU H H 1 8.669 0.030 . 1 . . . . 32 LEU H . 10190 1 267 . 1 1 32 32 LEU CA C 13 58.231 0.300 . 1 . . . . 32 LEU CA . 10190 1 268 . 1 1 32 32 LEU HA H 1 3.868 0.030 . 1 . . . . 32 LEU HA . 10190 1 269 . 1 1 32 32 LEU CB C 13 41.914 0.300 . 1 . . . . 32 LEU CB . 10190 1 270 . 1 1 32 32 LEU HB3 H 1 1.979 0.030 . 2 . . . . 32 LEU HB3 . 10190 1 271 . 1 1 32 32 LEU CG C 13 27.018 0.300 . 1 . . . . 32 LEU CG . 10190 1 272 . 1 1 32 32 LEU HG H 1 2.034 0.030 . 1 . . . . 32 LEU HG . 10190 1 273 . 1 1 32 32 LEU CD1 C 13 25.799 0.300 . 2 . . . . 32 LEU CD1 . 10190 1 274 . 1 1 32 32 LEU HD11 H 1 1.030 0.030 . 1 . . . . 32 LEU HD1 . 10190 1 275 . 1 1 32 32 LEU HD12 H 1 1.030 0.030 . 1 . . . . 32 LEU HD1 . 10190 1 276 . 1 1 32 32 LEU HD13 H 1 1.030 0.030 . 1 . . . . 32 LEU HD1 . 10190 1 277 . 1 1 32 32 LEU CD2 C 13 24.563 0.300 . 2 . . . . 32 LEU CD2 . 10190 1 278 . 1 1 32 32 LEU HD21 H 1 1.299 0.030 . 1 . . . . 32 LEU HD2 . 10190 1 279 . 1 1 32 32 LEU HD22 H 1 1.299 0.030 . 1 . . . . 32 LEU HD2 . 10190 1 280 . 1 1 32 32 LEU HD23 H 1 1.299 0.030 . 1 . . . . 32 LEU HD2 . 10190 1 281 . 1 1 32 32 LEU C C 13 179.605 0.300 . 1 . . . . 32 LEU C . 10190 1 282 . 1 1 32 32 LEU HB2 H 1 1.556 0.030 . 2 . . . . 32 LEU HB2 . 10190 1 283 . 1 1 33 33 LYS N N 15 117.980 0.300 . 1 . . . . 33 LYS N . 10190 1 284 . 1 1 33 33 LYS H H 1 7.426 0.030 . 1 . . . . 33 LYS H . 10190 1 285 . 1 1 33 33 LYS CA C 13 59.259 0.300 . 1 . . . . 33 LYS CA . 10190 1 286 . 1 1 33 33 LYS HA H 1 3.964 0.030 . 1 . . . . 33 LYS HA . 10190 1 287 . 1 1 33 33 LYS CB C 13 32.436 0.300 . 1 . . . . 33 LYS CB . 10190 1 288 . 1 1 33 33 LYS HB3 H 1 1.870 0.030 . 1 . . . . 33 LYS HB3 . 10190 1 289 . 1 1 33 33 LYS CG C 13 25.671 0.300 . 1 . . . . 33 LYS CG . 10190 1 290 . 1 1 33 33 LYS HG3 H 1 1.402 0.030 . 2 . . . . 33 LYS HG3 . 10190 1 291 . 1 1 33 33 LYS CD C 13 29.690 0.300 . 1 . . . . 33 LYS CD . 10190 1 292 . 1 1 33 33 LYS HD3 H 1 1.675 0.030 . 1 . . . . 33 LYS HD3 . 10190 1 293 . 1 1 33 33 LYS CE C 13 42.194 0.300 . 1 . . . . 33 LYS CE . 10190 1 294 . 1 1 33 33 LYS HE3 H 1 2.838 0.030 . 2 . . . . 33 LYS HE3 . 10190 1 295 . 1 1 33 33 LYS C C 13 178.878 0.300 . 1 . . . . 33 LYS C . 10190 1 296 . 1 1 33 33 LYS HB2 H 1 1.870 0.030 . 1 . . . . 33 LYS HB2 . 10190 1 297 . 1 1 33 33 LYS HD2 H 1 1.675 0.030 . 1 . . . . 33 LYS HD2 . 10190 1 298 . 1 1 33 33 LYS HE2 H 1 2.924 0.030 . 2 . . . . 33 LYS HE2 . 10190 1 299 . 1 1 33 33 LYS HG2 H 1 1.673 0.030 . 2 . . . . 33 LYS HG2 . 10190 1 300 . 1 1 34 34 ARG N N 15 117.379 0.300 . 1 . . . . 34 ARG N . 10190 1 301 . 1 1 34 34 ARG H H 1 7.659 0.030 . 1 . . . . 34 ARG H . 10190 1 302 . 1 1 34 34 ARG CA C 13 57.923 0.300 . 1 . . . . 34 ARG CA . 10190 1 303 . 1 1 34 34 ARG HA H 1 4.030 0.030 . 1 . . . . 34 ARG HA . 10190 1 304 . 1 1 34 34 ARG CB C 13 29.157 0.300 . 1 . . . . 34 ARG CB . 10190 1 305 . 1 1 34 34 ARG HB3 H 1 1.589 0.030 . 2 . . . . 34 ARG HB3 . 10190 1 306 . 1 1 34 34 ARG CG C 13 27.134 0.300 . 1 . . . . 34 ARG CG . 10190 1 307 . 1 1 34 34 ARG HG3 H 1 1.493 0.030 . 2 . . . . 34 ARG HG3 . 10190 1 308 . 1 1 34 34 ARG CD C 13 43.422 0.300 . 1 . . . . 34 ARG CD . 10190 1 309 . 1 1 34 34 ARG HD3 H 1 3.075 0.030 . 1 . . . . 34 ARG HD3 . 10190 1 310 . 1 1 34 34 ARG C C 13 178.055 0.300 . 1 . . . . 34 ARG C . 10190 1 311 . 1 1 34 34 ARG HB2 H 1 1.692 0.030 . 2 . . . . 34 ARG HB2 . 10190 1 312 . 1 1 34 34 ARG HD2 H 1 3.075 0.030 . 1 . . . . 34 ARG HD2 . 10190 1 313 . 1 1 34 34 ARG HG2 H 1 1.539 0.030 . 2 . . . . 34 ARG HG2 . 10190 1 314 . 1 1 35 35 HIS N N 15 115.913 0.300 . 1 . . . . 35 HIS N . 10190 1 315 . 1 1 35 35 HIS H H 1 7.257 0.030 . 1 . . . . 35 HIS H . 10190 1 316 . 1 1 35 35 HIS CA C 13 56.578 0.300 . 1 . . . . 35 HIS CA . 10190 1 317 . 1 1 35 35 HIS HA H 1 4.629 0.030 . 1 . . . . 35 HIS HA . 10190 1 318 . 1 1 35 35 HIS CB C 13 28.654 0.300 . 1 . . . . 35 HIS CB . 10190 1 319 . 1 1 35 35 HIS HB3 H 1 3.057 0.030 . 1 . . . . 35 HIS HB3 . 10190 1 320 . 1 1 35 35 HIS CD2 C 13 127.061 0.300 . 1 . . . . 35 HIS CD2 . 10190 1 321 . 1 1 35 35 HIS HD2 H 1 6.641 0.030 . 1 . . . . 35 HIS HD2 . 10190 1 322 . 1 1 35 35 HIS CE1 C 13 139.771 0.300 . 1 . . . . 35 HIS CE1 . 10190 1 323 . 1 1 35 35 HIS HE1 H 1 7.990 0.030 . 1 . . . . 35 HIS HE1 . 10190 1 324 . 1 1 35 35 HIS C C 13 175.953 0.300 . 1 . . . . 35 HIS C . 10190 1 325 . 1 1 35 35 HIS HB2 H 1 3.057 0.030 . 1 . . . . 35 HIS HB2 . 10190 1 326 . 1 1 36 36 PHE N N 15 119.384 0.300 . 1 . . . . 36 PHE N . 10190 1 327 . 1 1 36 36 PHE H H 1 7.760 0.030 . 1 . . . . 36 PHE H . 10190 1 328 . 1 1 36 36 PHE CA C 13 58.890 0.300 . 1 . . . . 36 PHE CA . 10190 1 329 . 1 1 36 36 PHE HA H 1 4.543 0.030 . 1 . . . . 36 PHE HA . 10190 1 330 . 1 1 36 36 PHE CB C 13 39.026 0.300 . 1 . . . . 36 PHE CB . 10190 1 331 . 1 1 36 36 PHE HB3 H 1 3.134 0.030 . 2 . . . . 36 PHE HB3 . 10190 1 332 . 1 1 36 36 PHE CD1 C 13 131.712 0.300 . 1 . . . . 36 PHE CD1 . 10190 1 333 . 1 1 36 36 PHE HD1 H 1 7.278 0.030 . 1 . . . . 36 PHE HD1 . 10190 1 334 . 1 1 36 36 PHE CD2 C 13 131.712 0.300 . 1 . . . . 36 PHE CD2 . 10190 1 335 . 1 1 36 36 PHE HD2 H 1 7.278 0.030 . 1 . . . . 36 PHE HD2 . 10190 1 336 . 1 1 36 36 PHE CE1 C 13 131.712 0.300 . 1 . . . . 36 PHE CE1 . 10190 1 337 . 1 1 36 36 PHE HE1 H 1 7.349 0.030 . 1 . . . . 36 PHE HE1 . 10190 1 338 . 1 1 36 36 PHE CE2 C 13 131.712 0.300 . 1 . . . . 36 PHE CE2 . 10190 1 339 . 1 1 36 36 PHE HE2 H 1 7.349 0.030 . 1 . . . . 36 PHE HE2 . 10190 1 340 . 1 1 36 36 PHE CZ C 13 129.919 0.300 . 1 . . . . 36 PHE CZ . 10190 1 341 . 1 1 36 36 PHE HZ H 1 7.307 0.030 . 1 . . . . 36 PHE HZ . 10190 1 342 . 1 1 36 36 PHE C C 13 176.549 0.300 . 1 . . . . 36 PHE C . 10190 1 343 . 1 1 36 36 PHE HB2 H 1 3.221 0.030 . 2 . . . . 36 PHE HB2 . 10190 1 344 . 1 1 37 37 ARG N N 15 121.608 0.300 . 1 . . . . 37 ARG N . 10190 1 345 . 1 1 37 37 ARG H H 1 8.099 0.030 . 1 . . . . 37 ARG H . 10190 1 346 . 1 1 37 37 ARG CA C 13 56.871 0.300 . 1 . . . . 37 ARG CA . 10190 1 347 . 1 1 37 37 ARG HA H 1 4.231 0.030 . 1 . . . . 37 ARG HA . 10190 1 348 . 1 1 37 37 ARG CB C 13 30.858 0.300 . 1 . . . . 37 ARG CB . 10190 1 349 . 1 1 37 37 ARG HB3 H 1 1.832 0.030 . 2 . . . . 37 ARG HB3 . 10190 1 350 . 1 1 37 37 ARG CG C 13 27.188 0.300 . 1 . . . . 37 ARG CG . 10190 1 351 . 1 1 37 37 ARG HG3 H 1 1.646 0.030 . 2 . . . . 37 ARG HG3 . 10190 1 352 . 1 1 37 37 ARG CD C 13 43.415 0.300 . 1 . . . . 37 ARG CD . 10190 1 353 . 1 1 37 37 ARG HD3 H 1 3.208 0.030 . 1 . . . . 37 ARG HD3 . 10190 1 354 . 1 1 37 37 ARG C C 13 176.808 0.300 . 1 . . . . 37 ARG C . 10190 1 355 . 1 1 37 37 ARG HB2 H 1 1.868 0.030 . 2 . . . . 37 ARG HB2 . 10190 1 356 . 1 1 37 37 ARG HD2 H 1 3.208 0.030 . 1 . . . . 37 ARG HD2 . 10190 1 357 . 1 1 37 37 ARG HG2 H 1 1.698 0.030 . 2 . . . . 37 ARG HG2 . 10190 1 358 . 1 1 38 38 GLU N N 15 120.749 0.300 . 1 . . . . 38 GLU N . 10190 1 359 . 1 1 38 38 GLU H H 1 8.205 0.030 . 1 . . . . 38 GLU H . 10190 1 360 . 1 1 38 38 GLU CA C 13 57.166 0.300 . 1 . . . . 38 GLU CA . 10190 1 361 . 1 1 38 38 GLU HA H 1 4.194 0.030 . 1 . . . . 38 GLU HA . 10190 1 362 . 1 1 38 38 GLU CB C 13 30.047 0.300 . 1 . . . . 38 GLU CB . 10190 1 363 . 1 1 38 38 GLU HB3 H 1 2.069 0.030 . 1 . . . . 38 GLU HB3 . 10190 1 364 . 1 1 38 38 GLU CG C 13 36.378 0.300 . 1 . . . . 38 GLU CG . 10190 1 365 . 1 1 38 38 GLU HG3 H 1 2.309 0.030 . 2 . . . . 38 GLU HG3 . 10190 1 366 . 1 1 38 38 GLU C C 13 176.985 0.300 . 1 . . . . 38 GLU C . 10190 1 367 . 1 1 38 38 GLU HB2 H 1 2.069 0.030 . 1 . . . . 38 GLU HB2 . 10190 1 368 . 1 1 38 38 GLU HG2 H 1 2.384 0.030 . 2 . . . . 38 GLU HG2 . 10190 1 369 . 1 1 39 39 LYS N N 15 121.011 0.300 . 1 . . . . 39 LYS N . 10190 1 370 . 1 1 39 39 LYS H H 1 8.130 0.030 . 1 . . . . 39 LYS H . 10190 1 371 . 1 1 39 39 LYS CA C 13 56.734 0.300 . 1 . . . . 39 LYS CA . 10190 1 372 . 1 1 39 39 LYS HA H 1 4.315 0.030 . 1 . . . . 39 LYS HA . 10190 1 373 . 1 1 39 39 LYS CB C 13 32.934 0.300 . 1 . . . . 39 LYS CB . 10190 1 374 . 1 1 39 39 LYS HB3 H 1 1.798 0.030 . 2 . . . . 39 LYS HB3 . 10190 1 375 . 1 1 39 39 LYS CG C 13 24.792 0.300 . 1 . . . . 39 LYS CG . 10190 1 376 . 1 1 39 39 LYS HG3 H 1 1.463 0.030 . 2 . . . . 39 LYS HG3 . 10190 1 377 . 1 1 39 39 LYS CD C 13 29.226 0.300 . 1 . . . . 39 LYS CD . 10190 1 378 . 1 1 39 39 LYS HD3 H 1 1.670 0.030 . 1 . . . . 39 LYS HD3 . 10190 1 379 . 1 1 39 39 LYS CE C 13 42.111 0.300 . 1 . . . . 39 LYS CE . 10190 1 380 . 1 1 39 39 LYS HE3 H 1 2.879 0.030 . 2 . . . . 39 LYS HE3 . 10190 1 381 . 1 1 39 39 LYS C C 13 176.838 0.300 . 1 . . . . 39 LYS C . 10190 1 382 . 1 1 39 39 LYS HB2 H 1 1.881 0.030 . 2 . . . . 39 LYS HB2 . 10190 1 383 . 1 1 39 39 LYS HD2 H 1 1.670 0.030 . 1 . . . . 39 LYS HD2 . 10190 1 384 . 1 1 39 39 LYS HE2 H 1 2.978 0.030 . 2 . . . . 39 LYS HE2 . 10190 1 385 . 1 1 39 39 LYS HG2 H 1 1.508 0.030 . 2 . . . . 39 LYS HG2 . 10190 1 386 . 1 1 40 40 SER N N 15 116.295 0.300 . 1 . . . . 40 SER N . 10190 1 387 . 1 1 40 40 SER H H 1 8.203 0.030 . 1 . . . . 40 SER H . 10190 1 388 . 1 1 40 40 SER CA C 13 58.413 0.300 . 1 . . . . 40 SER CA . 10190 1 389 . 1 1 40 40 SER HA H 1 4.474 0.030 . 1 . . . . 40 SER HA . 10190 1 390 . 1 1 40 40 SER CB C 13 63.797 0.300 . 1 . . . . 40 SER CB . 10190 1 391 . 1 1 40 40 SER HB3 H 1 3.909 0.030 . 1 . . . . 40 SER HB3 . 10190 1 392 . 1 1 40 40 SER C C 13 174.559 0.300 . 1 . . . . 40 SER C . 10190 1 393 . 1 1 40 40 SER HB2 H 1 3.909 0.030 . 1 . . . . 40 SER HB2 . 10190 1 394 . 1 1 41 41 SER N N 15 117.522 0.300 . 1 . . . . 41 SER N . 10190 1 395 . 1 1 41 41 SER H H 1 8.267 0.030 . 1 . . . . 41 SER H . 10190 1 396 . 1 1 41 41 SER CA C 13 58.400 0.300 . 1 . . . . 41 SER CA . 10190 1 397 . 1 1 41 41 SER HA H 1 4.488 0.030 . 1 . . . . 41 SER HA . 10190 1 398 . 1 1 41 41 SER CB C 13 64.016 0.300 . 1 . . . . 41 SER CB . 10190 1 399 . 1 1 41 41 SER HB3 H 1 3.863 0.030 . 2 . . . . 41 SER HB3 . 10190 1 400 . 1 1 41 41 SER C C 13 174.474 0.300 . 1 . . . . 41 SER C . 10190 1 401 . 1 1 41 41 SER HB2 H 1 3.863 0.030 . 2 . . . . 41 SER HB2 . 10190 1 402 . 1 1 42 42 GLY N N 15 110.551 0.300 . 1 . . . . 42 GLY N . 10190 1 403 . 1 1 42 42 GLY H H 1 8.215 0.030 . 1 . . . . 42 GLY H . 10190 1 404 . 1 1 42 42 GLY CA C 13 44.645 0.300 . 1 . . . . 42 GLY CA . 10190 1 405 . 1 1 42 42 GLY HA3 H 1 4.143 0.030 . 1 . . . . 42 GLY HA3 . 10190 1 406 . 1 1 42 42 GLY C C 13 171.741 0.300 . 1 . . . . 42 GLY C . 10190 1 407 . 1 1 42 42 GLY HA2 H 1 4.143 0.030 . 1 . . . . 42 GLY HA2 . 10190 1 408 . 1 1 43 43 PRO CA C 13 63.271 0.300 . 1 . . . . 43 PRO CA . 10190 1 409 . 1 1 43 43 PRO HA H 1 4.488 0.030 . 1 . . . . 43 PRO HA . 10190 1 410 . 1 1 43 43 PRO CB C 13 32.184 0.300 . 1 . . . . 43 PRO CB . 10190 1 411 . 1 1 43 43 PRO HB3 H 1 2.309 0.030 . 2 . . . . 43 PRO HB3 . 10190 1 412 . 1 1 43 43 PRO CG C 13 27.094 0.300 . 1 . . . . 43 PRO CG . 10190 1 413 . 1 1 43 43 PRO HG3 H 1 2.027 0.030 . 1 . . . . 43 PRO HG3 . 10190 1 414 . 1 1 43 43 PRO CD C 13 49.806 0.300 . 1 . . . . 43 PRO CD . 10190 1 415 . 1 1 43 43 PRO HD3 H 1 3.642 0.030 . 1 . . . . 43 PRO HD3 . 10190 1 416 . 1 1 43 43 PRO C C 13 177.380 0.300 . 1 . . . . 43 PRO C . 10190 1 417 . 1 1 43 43 PRO HB2 H 1 1.994 0.030 . 2 . . . . 43 PRO HB2 . 10190 1 418 . 1 1 43 43 PRO HD2 H 1 3.642 0.030 . 1 . . . . 43 PRO HD2 . 10190 1 419 . 1 1 43 43 PRO HG2 H 1 2.027 0.030 . 1 . . . . 43 PRO HG2 . 10190 1 420 . 1 1 44 44 SER N N 15 116.453 0.300 . 1 . . . . 44 SER N . 10190 1 421 . 1 1 44 44 SER H H 1 8.540 0.030 . 1 . . . . 44 SER H . 10190 1 422 . 1 1 44 44 SER C C 13 174.602 0.300 . 1 . . . . 44 SER C . 10190 1 stop_ save_