################################### # 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 10207 _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 10207 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10207 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 CA C 13 61.936 0.300 . 1 . . . . 8 THR CA . 10207 1 2 . 1 1 8 8 THR HA H 1 4.334 0.030 . 1 . . . . 8 THR HA . 10207 1 3 . 1 1 8 8 THR CB C 13 69.790 0.300 . 1 . . . . 8 THR CB . 10207 1 4 . 1 1 8 8 THR HB H 1 4.266 0.030 . 1 . . . . 8 THR HB . 10207 1 5 . 1 1 8 8 THR CG2 C 13 21.516 0.300 . 1 . . . . 8 THR CG2 . 10207 1 6 . 1 1 8 8 THR HG21 H 1 1.172 0.030 . 1 . . . . 8 THR HG2 . 10207 1 7 . 1 1 8 8 THR HG22 H 1 1.172 0.030 . 1 . . . . 8 THR HG2 . 10207 1 8 . 1 1 8 8 THR HG23 H 1 1.172 0.030 . 1 . . . . 8 THR HG2 . 10207 1 9 . 1 1 9 9 GLY CA C 13 45.303 0.300 . 1 . . . . 9 GLY CA . 10207 1 10 . 1 1 9 9 GLY HA2 H 1 3.975 0.030 . 1 . . . . 9 GLY HA2 . 10207 1 11 . 1 1 9 9 GLY HA3 H 1 3.975 0.030 . 1 . . . . 9 GLY HA3 . 10207 1 12 . 1 1 9 9 GLY C C 13 174.030 0.300 . 1 . . . . 9 GLY C . 10207 1 13 . 1 1 10 10 GLU N N 15 120.522 0.300 . 1 . . . . 10 GLU N . 10207 1 14 . 1 1 10 10 GLU H H 1 8.138 0.030 . 1 . . . . 10 GLU H . 10207 1 15 . 1 1 10 10 GLU CA C 13 56.348 0.300 . 1 . . . . 10 GLU CA . 10207 1 16 . 1 1 10 10 GLU HA H 1 4.254 0.030 . 1 . . . . 10 GLU HA . 10207 1 17 . 1 1 10 10 GLU CB C 13 30.590 0.300 . 1 . . . . 10 GLU CB . 10207 1 18 . 1 1 10 10 GLU HB2 H 1 1.996 0.030 . 2 . . . . 10 GLU HB2 . 10207 1 19 . 1 1 10 10 GLU HB3 H 1 1.915 0.030 . 2 . . . . 10 GLU HB3 . 10207 1 20 . 1 1 10 10 GLU CG C 13 36.256 0.300 . 1 . . . . 10 GLU CG . 10207 1 21 . 1 1 10 10 GLU HG2 H 1 2.234 0.030 . 2 . . . . 10 GLU HG2 . 10207 1 22 . 1 1 10 10 GLU HG3 H 1 2.193 0.030 . 2 . . . . 10 GLU HG3 . 10207 1 23 . 1 1 10 10 GLU C C 13 176.309 0.300 . 1 . . . . 10 GLU C . 10207 1 24 . 1 1 11 11 LYS N N 15 123.786 0.300 . 1 . . . . 11 LYS N . 10207 1 25 . 1 1 11 11 LYS H H 1 8.422 0.030 . 1 . . . . 11 LYS H . 10207 1 26 . 1 1 11 11 LYS CA C 13 54.092 0.300 . 1 . . . . 11 LYS CA . 10207 1 27 . 1 1 11 11 LYS HA H 1 4.614 0.030 . 1 . . . . 11 LYS HA . 10207 1 28 . 1 1 11 11 LYS CB C 13 32.512 0.300 . 1 . . . . 11 LYS CB . 10207 1 29 . 1 1 11 11 LYS HB2 H 1 1.804 0.030 . 2 . . . . 11 LYS HB2 . 10207 1 30 . 1 1 11 11 LYS HB3 H 1 1.721 0.030 . 2 . . . . 11 LYS HB3 . 10207 1 31 . 1 1 11 11 LYS CG C 13 24.463 0.300 . 1 . . . . 11 LYS CG . 10207 1 32 . 1 1 11 11 LYS HG2 H 1 1.453 0.030 . 1 . . . . 11 LYS HG2 . 10207 1 33 . 1 1 11 11 LYS HG3 H 1 1.453 0.030 . 1 . . . . 11 LYS HG3 . 10207 1 34 . 1 1 11 11 LYS CD C 13 29.203 0.300 . 1 . . . . 11 LYS CD . 10207 1 35 . 1 1 11 11 LYS HD2 H 1 1.671 0.030 . 1 . . . . 11 LYS HD2 . 10207 1 36 . 1 1 11 11 LYS HD3 H 1 1.671 0.030 . 1 . . . . 11 LYS HD3 . 10207 1 37 . 1 1 11 11 LYS CE C 13 42.069 0.300 . 1 . . . . 11 LYS CE . 10207 1 38 . 1 1 11 11 LYS HE2 H 1 2.926 0.030 . 1 . . . . 11 LYS HE2 . 10207 1 39 . 1 1 11 11 LYS HE3 H 1 2.926 0.030 . 1 . . . . 11 LYS HE3 . 10207 1 40 . 1 1 11 11 LYS C C 13 174.485 0.300 . 1 . . . . 11 LYS C . 10207 1 41 . 1 1 12 12 PRO CA C 13 63.537 0.300 . 1 . . . . 12 PRO CA . 10207 1 42 . 1 1 12 12 PRO HA H 1 4.222 0.030 . 1 . . . . 12 PRO HA . 10207 1 43 . 1 1 12 12 PRO CB C 13 32.294 0.300 . 1 . . . . 12 PRO CB . 10207 1 44 . 1 1 12 12 PRO HB2 H 1 1.115 0.030 . 2 . . . . 12 PRO HB2 . 10207 1 45 . 1 1 12 12 PRO HB3 H 1 1.973 0.030 . 2 . . . . 12 PRO HB3 . 10207 1 46 . 1 1 12 12 PRO CG C 13 26.465 0.300 . 1 . . . . 12 PRO CG . 10207 1 47 . 1 1 12 12 PRO HG2 H 1 1.734 0.030 . 2 . . . . 12 PRO HG2 . 10207 1 48 . 1 1 12 12 PRO HG3 H 1 1.442 0.030 . 2 . . . . 12 PRO HG3 . 10207 1 49 . 1 1 12 12 PRO CD C 13 50.288 0.300 . 1 . . . . 12 PRO CD . 10207 1 50 . 1 1 12 12 PRO HD2 H 1 3.604 0.030 . 1 . . . . 12 PRO HD2 . 10207 1 51 . 1 1 12 12 PRO HD3 H 1 3.604 0.030 . 1 . . . . 12 PRO HD3 . 10207 1 52 . 1 1 12 12 PRO C C 13 176.522 0.300 . 1 . . . . 12 PRO C . 10207 1 53 . 1 1 13 13 TYR N N 15 118.425 0.300 . 1 . . . . 13 TYR N . 10207 1 54 . 1 1 13 13 TYR H H 1 7.747 0.030 . 1 . . . . 13 TYR H . 10207 1 55 . 1 1 13 13 TYR CA C 13 57.492 0.300 . 1 . . . . 13 TYR CA . 10207 1 56 . 1 1 13 13 TYR HA H 1 4.643 0.030 . 1 . . . . 13 TYR HA . 10207 1 57 . 1 1 13 13 TYR CB C 13 38.298 0.300 . 1 . . . . 13 TYR CB . 10207 1 58 . 1 1 13 13 TYR HB2 H 1 2.737 0.030 . 2 . . . . 13 TYR HB2 . 10207 1 59 . 1 1 13 13 TYR HB3 H 1 2.955 0.030 . 2 . . . . 13 TYR HB3 . 10207 1 60 . 1 1 13 13 TYR CD1 C 13 132.938 0.300 . 1 . . . . 13 TYR CD1 . 10207 1 61 . 1 1 13 13 TYR HD1 H 1 6.961 0.030 . 1 . . . . 13 TYR HD1 . 10207 1 62 . 1 1 13 13 TYR CD2 C 13 132.938 0.300 . 1 . . . . 13 TYR CD2 . 10207 1 63 . 1 1 13 13 TYR HD2 H 1 6.961 0.030 . 1 . . . . 13 TYR HD2 . 10207 1 64 . 1 1 13 13 TYR CE1 C 13 118.318 0.300 . 1 . . . . 13 TYR CE1 . 10207 1 65 . 1 1 13 13 TYR HE1 H 1 6.872 0.030 . 1 . . . . 13 TYR HE1 . 10207 1 66 . 1 1 13 13 TYR CE2 C 13 118.318 0.300 . 1 . . . . 13 TYR CE2 . 10207 1 67 . 1 1 13 13 TYR HE2 H 1 6.872 0.030 . 1 . . . . 13 TYR HE2 . 10207 1 68 . 1 1 13 13 TYR C C 13 174.436 0.300 . 1 . . . . 13 TYR C . 10207 1 69 . 1 1 14 14 LYS N N 15 125.064 0.300 . 1 . . . . 14 LYS N . 10207 1 70 . 1 1 14 14 LYS H H 1 8.580 0.030 . 1 . . . . 14 LYS H . 10207 1 71 . 1 1 14 14 LYS CA C 13 55.150 0.300 . 1 . . . . 14 LYS CA . 10207 1 72 . 1 1 14 14 LYS HA H 1 4.934 0.030 . 1 . . . . 14 LYS HA . 10207 1 73 . 1 1 14 14 LYS CB C 13 35.364 0.300 . 1 . . . . 14 LYS CB . 10207 1 74 . 1 1 14 14 LYS HB2 H 1 1.644 0.030 . 2 . . . . 14 LYS HB2 . 10207 1 75 . 1 1 14 14 LYS HB3 H 1 1.608 0.030 . 2 . . . . 14 LYS HB3 . 10207 1 76 . 1 1 14 14 LYS CG C 13 24.973 0.300 . 1 . . . . 14 LYS CG . 10207 1 77 . 1 1 14 14 LYS HG2 H 1 1.193 0.030 . 1 . . . . 14 LYS HG2 . 10207 1 78 . 1 1 14 14 LYS HG3 H 1 1.193 0.030 . 1 . . . . 14 LYS HG3 . 10207 1 79 . 1 1 14 14 LYS CD C 13 29.439 0.300 . 1 . . . . 14 LYS CD . 10207 1 80 . 1 1 14 14 LYS HD2 H 1 1.589 0.030 . 1 . . . . 14 LYS HD2 . 10207 1 81 . 1 1 14 14 LYS HD3 H 1 1.589 0.030 . 1 . . . . 14 LYS HD3 . 10207 1 82 . 1 1 14 14 LYS CE C 13 42.078 0.300 . 1 . . . . 14 LYS CE . 10207 1 83 . 1 1 14 14 LYS HE2 H 1 2.926 0.030 . 1 . . . . 14 LYS HE2 . 10207 1 84 . 1 1 14 14 LYS HE3 H 1 2.926 0.030 . 1 . . . . 14 LYS HE3 . 10207 1 85 . 1 1 14 14 LYS C C 13 175.164 0.300 . 1 . . . . 14 LYS C . 10207 1 86 . 1 1 15 15 CYS N N 15 126.356 0.300 . 1 . . . . 15 CYS N . 10207 1 87 . 1 1 15 15 CYS H H 1 9.216 0.030 . 1 . . . . 15 CYS H . 10207 1 88 . 1 1 15 15 CYS CA C 13 59.505 0.300 . 1 . . . . 15 CYS CA . 10207 1 89 . 1 1 15 15 CYS HA H 1 4.499 0.030 . 1 . . . . 15 CYS HA . 10207 1 90 . 1 1 15 15 CYS CB C 13 29.802 0.300 . 1 . . . . 15 CYS CB . 10207 1 91 . 1 1 15 15 CYS HB2 H 1 2.864 0.030 . 2 . . . . 15 CYS HB2 . 10207 1 92 . 1 1 15 15 CYS HB3 H 1 3.430 0.030 . 2 . . . . 15 CYS HB3 . 10207 1 93 . 1 1 15 15 CYS C C 13 177.060 0.300 . 1 . . . . 15 CYS C . 10207 1 94 . 1 1 16 16 ASN N N 15 130.128 0.300 . 1 . . . . 16 ASN N . 10207 1 95 . 1 1 16 16 ASN H H 1 9.375 0.030 . 1 . . . . 16 ASN H . 10207 1 96 . 1 1 16 16 ASN CA C 13 55.567 0.300 . 1 . . . . 16 ASN CA . 10207 1 97 . 1 1 16 16 ASN HA H 1 4.526 0.030 . 1 . . . . 16 ASN HA . 10207 1 98 . 1 1 16 16 ASN CB C 13 38.377 0.300 . 1 . . . . 16 ASN CB . 10207 1 99 . 1 1 16 16 ASN HB2 H 1 2.883 0.030 . 1 . . . . 16 ASN HB2 . 10207 1 100 . 1 1 16 16 ASN HB3 H 1 2.883 0.030 . 1 . . . . 16 ASN HB3 . 10207 1 101 . 1 1 16 16 ASN ND2 N 15 113.320 0.300 . 1 . . . . 16 ASN ND2 . 10207 1 102 . 1 1 16 16 ASN HD21 H 1 7.694 0.030 . 2 . . . . 16 ASN HD21 . 10207 1 103 . 1 1 16 16 ASN HD22 H 1 6.976 0.030 . 2 . . . . 16 ASN HD22 . 10207 1 104 . 1 1 16 16 ASN C C 13 175.395 0.300 . 1 . . . . 16 ASN C . 10207 1 105 . 1 1 17 17 GLU N N 15 121.112 0.300 . 1 . . . . 17 GLU N . 10207 1 106 . 1 1 17 17 GLU H H 1 8.801 0.030 . 1 . . . . 17 GLU H . 10207 1 107 . 1 1 17 17 GLU CA C 13 58.384 0.300 . 1 . . . . 17 GLU CA . 10207 1 108 . 1 1 17 17 GLU HA H 1 4.227 0.030 . 1 . . . . 17 GLU HA . 10207 1 109 . 1 1 17 17 GLU CB C 13 29.679 0.300 . 1 . . . . 17 GLU CB . 10207 1 110 . 1 1 17 17 GLU HB2 H 1 1.452 0.030 . 2 . . . . 17 GLU HB2 . 10207 1 111 . 1 1 17 17 GLU HB3 H 1 1.420 0.030 . 2 . . . . 17 GLU HB3 . 10207 1 112 . 1 1 17 17 GLU CG C 13 35.713 0.300 . 1 . . . . 17 GLU CG . 10207 1 113 . 1 1 17 17 GLU HG2 H 1 1.903 0.030 . 2 . . . . 17 GLU HG2 . 10207 1 114 . 1 1 17 17 GLU HG3 H 1 1.766 0.030 . 2 . . . . 17 GLU HG3 . 10207 1 115 . 1 1 17 17 GLU C C 13 177.104 0.300 . 1 . . . . 17 GLU C . 10207 1 116 . 1 1 18 18 CYS N N 15 114.836 0.300 . 1 . . . . 18 CYS N . 10207 1 117 . 1 1 18 18 CYS H H 1 7.953 0.030 . 1 . . . . 18 CYS H . 10207 1 118 . 1 1 18 18 CYS CA C 13 58.341 0.300 . 1 . . . . 18 CYS CA . 10207 1 119 . 1 1 18 18 CYS HA H 1 5.156 0.030 . 1 . . . . 18 CYS HA . 10207 1 120 . 1 1 18 18 CYS CB C 13 32.523 0.300 . 1 . . . . 18 CYS CB . 10207 1 121 . 1 1 18 18 CYS HB2 H 1 2.840 0.030 . 2 . . . . 18 CYS HB2 . 10207 1 122 . 1 1 18 18 CYS HB3 H 1 3.412 0.030 . 2 . . . . 18 CYS HB3 . 10207 1 123 . 1 1 18 18 CYS C C 13 176.223 0.300 . 1 . . . . 18 CYS C . 10207 1 124 . 1 1 19 19 GLY N N 15 113.235 0.300 . 1 . . . . 19 GLY N . 10207 1 125 . 1 1 19 19 GLY H H 1 8.138 0.030 . 1 . . . . 19 GLY H . 10207 1 126 . 1 1 19 19 GLY CA C 13 46.304 0.300 . 1 . . . . 19 GLY CA . 10207 1 127 . 1 1 19 19 GLY HA2 H 1 3.785 0.030 . 2 . . . . 19 GLY HA2 . 10207 1 128 . 1 1 19 19 GLY HA3 H 1 4.241 0.030 . 2 . . . . 19 GLY HA3 . 10207 1 129 . 1 1 19 19 GLY C C 13 173.712 0.300 . 1 . . . . 19 GLY C . 10207 1 130 . 1 1 20 20 LYS N N 15 123.349 0.300 . 1 . . . . 20 LYS N . 10207 1 131 . 1 1 20 20 LYS H H 1 8.040 0.030 . 1 . . . . 20 LYS H . 10207 1 132 . 1 1 20 20 LYS CA C 13 58.424 0.300 . 1 . . . . 20 LYS CA . 10207 1 133 . 1 1 20 20 LYS HA H 1 3.919 0.030 . 1 . . . . 20 LYS HA . 10207 1 134 . 1 1 20 20 LYS CB C 13 33.699 0.300 . 1 . . . . 20 LYS CB . 10207 1 135 . 1 1 20 20 LYS HB2 H 1 1.402 0.030 . 2 . . . . 20 LYS HB2 . 10207 1 136 . 1 1 20 20 LYS HB3 H 1 1.198 0.030 . 2 . . . . 20 LYS HB3 . 10207 1 137 . 1 1 20 20 LYS CG C 13 26.326 0.300 . 1 . . . . 20 LYS CG . 10207 1 138 . 1 1 20 20 LYS HG2 H 1 1.402 0.030 . 2 . . . . 20 LYS HG2 . 10207 1 139 . 1 1 20 20 LYS HG3 H 1 1.054 0.030 . 2 . . . . 20 LYS HG3 . 10207 1 140 . 1 1 20 20 LYS CD C 13 29.476 0.300 . 1 . . . . 20 LYS CD . 10207 1 141 . 1 1 20 20 LYS HD2 H 1 1.401 0.030 . 1 . . . . 20 LYS HD2 . 10207 1 142 . 1 1 20 20 LYS HD3 H 1 1.401 0.030 . 1 . . . . 20 LYS HD3 . 10207 1 143 . 1 1 20 20 LYS CE C 13 42.223 0.300 . 1 . . . . 20 LYS CE . 10207 1 144 . 1 1 20 20 LYS HE2 H 1 2.941 0.030 . 2 . . . . 20 LYS HE2 . 10207 1 145 . 1 1 20 20 LYS HE3 H 1 2.878 0.030 . 2 . . . . 20 LYS HE3 . 10207 1 146 . 1 1 20 20 LYS C C 13 173.678 0.300 . 1 . . . . 20 LYS C . 10207 1 147 . 1 1 21 21 ALA N N 15 124.050 0.300 . 1 . . . . 21 ALA N . 10207 1 148 . 1 1 21 21 ALA H H 1 7.783 0.030 . 1 . . . . 21 ALA H . 10207 1 149 . 1 1 21 21 ALA CA C 13 50.427 0.300 . 1 . . . . 21 ALA CA . 10207 1 150 . 1 1 21 21 ALA HA H 1 5.135 0.030 . 1 . . . . 21 ALA HA . 10207 1 151 . 1 1 21 21 ALA CB C 13 22.453 0.300 . 1 . . . . 21 ALA CB . 10207 1 152 . 1 1 21 21 ALA HB1 H 1 1.186 0.030 . 1 . . . . 21 ALA HB . 10207 1 153 . 1 1 21 21 ALA HB2 H 1 1.186 0.030 . 1 . . . . 21 ALA HB . 10207 1 154 . 1 1 21 21 ALA HB3 H 1 1.186 0.030 . 1 . . . . 21 ALA HB . 10207 1 155 . 1 1 21 21 ALA C C 13 176.113 0.300 . 1 . . . . 21 ALA C . 10207 1 156 . 1 1 22 22 PHE N N 15 116.580 0.300 . 1 . . . . 22 PHE N . 10207 1 157 . 1 1 22 22 PHE H H 1 8.754 0.030 . 1 . . . . 22 PHE H . 10207 1 158 . 1 1 22 22 PHE CA C 13 57.200 0.300 . 1 . . . . 22 PHE CA . 10207 1 159 . 1 1 22 22 PHE HA H 1 4.695 0.030 . 1 . . . . 22 PHE HA . 10207 1 160 . 1 1 22 22 PHE CB C 13 44.007 0.300 . 1 . . . . 22 PHE CB . 10207 1 161 . 1 1 22 22 PHE HB2 H 1 2.680 0.030 . 2 . . . . 22 PHE HB2 . 10207 1 162 . 1 1 22 22 PHE HB3 H 1 3.392 0.030 . 2 . . . . 22 PHE HB3 . 10207 1 163 . 1 1 22 22 PHE CD1 C 13 132.242 0.300 . 1 . . . . 22 PHE CD1 . 10207 1 164 . 1 1 22 22 PHE HD1 H 1 7.248 0.030 . 1 . . . . 22 PHE HD1 . 10207 1 165 . 1 1 22 22 PHE CD2 C 13 132.242 0.300 . 1 . . . . 22 PHE CD2 . 10207 1 166 . 1 1 22 22 PHE HD2 H 1 7.248 0.030 . 1 . . . . 22 PHE HD2 . 10207 1 167 . 1 1 22 22 PHE CE1 C 13 130.575 0.300 . 1 . . . . 22 PHE CE1 . 10207 1 168 . 1 1 22 22 PHE HE1 H 1 6.835 0.030 . 1 . . . . 22 PHE HE1 . 10207 1 169 . 1 1 22 22 PHE CE2 C 13 130.575 0.300 . 1 . . . . 22 PHE CE2 . 10207 1 170 . 1 1 22 22 PHE HE2 H 1 6.835 0.030 . 1 . . . . 22 PHE HE2 . 10207 1 171 . 1 1 22 22 PHE CZ C 13 128.769 0.300 . 1 . . . . 22 PHE CZ . 10207 1 172 . 1 1 22 22 PHE HZ H 1 6.273 0.030 . 1 . . . . 22 PHE HZ . 10207 1 173 . 1 1 22 22 PHE C C 13 175.166 0.300 . 1 . . . . 22 PHE C . 10207 1 174 . 1 1 23 23 ARG N N 15 120.122 0.300 . 1 . . . . 23 ARG N . 10207 1 175 . 1 1 23 23 ARG H H 1 9.062 0.030 . 1 . . . . 23 ARG H . 10207 1 176 . 1 1 23 23 ARG CA C 13 57.935 0.300 . 1 . . . . 23 ARG CA . 10207 1 177 . 1 1 23 23 ARG HA H 1 4.503 0.030 . 1 . . . . 23 ARG HA . 10207 1 178 . 1 1 23 23 ARG CB C 13 31.133 0.300 . 1 . . . . 23 ARG CB . 10207 1 179 . 1 1 23 23 ARG HB2 H 1 2.054 0.030 . 2 . . . . 23 ARG HB2 . 10207 1 180 . 1 1 23 23 ARG HB3 H 1 1.971 0.030 . 2 . . . . 23 ARG HB3 . 10207 1 181 . 1 1 23 23 ARG CG C 13 28.098 0.300 . 1 . . . . 23 ARG CG . 10207 1 182 . 1 1 23 23 ARG HG2 H 1 1.826 0.030 . 1 . . . . 23 ARG HG2 . 10207 1 183 . 1 1 23 23 ARG HG3 H 1 1.826 0.030 . 1 . . . . 23 ARG HG3 . 10207 1 184 . 1 1 23 23 ARG CD C 13 43.443 0.300 . 1 . . . . 23 ARG CD . 10207 1 185 . 1 1 23 23 ARG HD2 H 1 3.288 0.030 . 1 . . . . 23 ARG HD2 . 10207 1 186 . 1 1 23 23 ARG HD3 H 1 3.288 0.030 . 1 . . . . 23 ARG HD3 . 10207 1 187 . 1 1 23 23 ARG C C 13 175.314 0.300 . 1 . . . . 23 ARG C . 10207 1 188 . 1 1 24 24 ALA N N 15 118.433 0.300 . 1 . . . . 24 ALA N . 10207 1 189 . 1 1 24 24 ALA H H 1 7.636 0.030 . 1 . . . . 24 ALA H . 10207 1 190 . 1 1 24 24 ALA CA C 13 50.400 0.300 . 1 . . . . 24 ALA CA . 10207 1 191 . 1 1 24 24 ALA HA H 1 4.860 0.030 . 1 . . . . 24 ALA HA . 10207 1 192 . 1 1 24 24 ALA CB C 13 21.958 0.300 . 1 . . . . 24 ALA CB . 10207 1 193 . 1 1 24 24 ALA HB1 H 1 1.482 0.030 . 1 . . . . 24 ALA HB . 10207 1 194 . 1 1 24 24 ALA HB2 H 1 1.482 0.030 . 1 . . . . 24 ALA HB . 10207 1 195 . 1 1 24 24 ALA HB3 H 1 1.482 0.030 . 1 . . . . 24 ALA HB . 10207 1 196 . 1 1 24 24 ALA C C 13 176.866 0.300 . 1 . . . . 24 ALA C . 10207 1 197 . 1 1 25 25 ARG N N 15 124.787 0.300 . 1 . . . . 25 ARG N . 10207 1 198 . 1 1 25 25 ARG H H 1 8.490 0.030 . 1 . . . . 25 ARG H . 10207 1 199 . 1 1 25 25 ARG CA C 13 59.298 0.300 . 1 . . . . 25 ARG CA . 10207 1 200 . 1 1 25 25 ARG HA H 1 3.125 0.030 . 1 . . . . 25 ARG HA . 10207 1 201 . 1 1 25 25 ARG CB C 13 29.270 0.300 . 1 . . . . 25 ARG CB . 10207 1 202 . 1 1 25 25 ARG HB2 H 1 1.479 0.030 . 2 . . . . 25 ARG HB2 . 10207 1 203 . 1 1 25 25 ARG HB3 H 1 1.237 0.030 . 2 . . . . 25 ARG HB3 . 10207 1 204 . 1 1 25 25 ARG CG C 13 27.369 0.300 . 1 . . . . 25 ARG CG . 10207 1 205 . 1 1 25 25 ARG HG2 H 1 1.171 0.030 . 1 . . . . 25 ARG HG2 . 10207 1 206 . 1 1 25 25 ARG HG3 H 1 1.171 0.030 . 1 . . . . 25 ARG HG3 . 10207 1 207 . 1 1 25 25 ARG CD C 13 43.074 0.300 . 1 . . . . 25 ARG CD . 10207 1 208 . 1 1 25 25 ARG HD2 H 1 3.030 0.030 . 1 . . . . 25 ARG HD2 . 10207 1 209 . 1 1 25 25 ARG HD3 H 1 3.030 0.030 . 1 . . . . 25 ARG HD3 . 10207 1 210 . 1 1 25 25 ARG C C 13 178.954 0.300 . 1 . . . . 25 ARG C . 10207 1 211 . 1 1 26 26 SER CA C 13 60.587 0.300 . 1 . . . . 26 SER CA . 10207 1 212 . 1 1 26 26 SER HA H 1 4.057 0.030 . 1 . . . . 26 SER HA . 10207 1 213 . 1 1 26 26 SER CB C 13 61.336 0.300 . 1 . . . . 26 SER CB . 10207 1 214 . 1 1 26 26 SER HB2 H 1 3.846 0.030 . 1 . . . . 26 SER HB2 . 10207 1 215 . 1 1 26 26 SER HB3 H 1 3.846 0.030 . 1 . . . . 26 SER HB3 . 10207 1 216 . 1 1 26 26 SER C C 13 177.007 0.300 . 1 . . . . 26 SER C . 10207 1 217 . 1 1 27 27 SER N N 15 117.278 0.300 . 1 . . . . 27 SER N . 10207 1 218 . 1 1 27 27 SER H H 1 6.825 0.030 . 1 . . . . 27 SER H . 10207 1 219 . 1 1 27 27 SER CA C 13 60.701 0.300 . 1 . . . . 27 SER CA . 10207 1 220 . 1 1 27 27 SER HA H 1 4.167 0.030 . 1 . . . . 27 SER HA . 10207 1 221 . 1 1 27 27 SER CB C 13 62.349 0.300 . 1 . . . . 27 SER CB . 10207 1 222 . 1 1 27 27 SER HB2 H 1 4.009 0.030 . 2 . . . . 27 SER HB2 . 10207 1 223 . 1 1 27 27 SER HB3 H 1 3.966 0.030 . 2 . . . . 27 SER HB3 . 10207 1 224 . 1 1 27 27 SER C C 13 176.462 0.300 . 1 . . . . 27 SER C . 10207 1 225 . 1 1 28 28 LEU N N 15 123.661 0.300 . 1 . . . . 28 LEU N . 10207 1 226 . 1 1 28 28 LEU H H 1 7.171 0.030 . 1 . . . . 28 LEU H . 10207 1 227 . 1 1 28 28 LEU CA C 13 57.758 0.300 . 1 . . . . 28 LEU CA . 10207 1 228 . 1 1 28 28 LEU HA H 1 3.179 0.030 . 1 . . . . 28 LEU HA . 10207 1 229 . 1 1 28 28 LEU CB C 13 40.196 0.300 . 1 . . . . 28 LEU CB . 10207 1 230 . 1 1 28 28 LEU HB2 H 1 1.237 0.030 . 2 . . . . 28 LEU HB2 . 10207 1 231 . 1 1 28 28 LEU HB3 H 1 1.906 0.030 . 2 . . . . 28 LEU HB3 . 10207 1 232 . 1 1 28 28 LEU CG C 13 27.403 0.300 . 1 . . . . 28 LEU CG . 10207 1 233 . 1 1 28 28 LEU HG H 1 1.474 0.030 . 1 . . . . 28 LEU HG . 10207 1 234 . 1 1 28 28 LEU CD1 C 13 22.859 0.300 . 2 . . . . 28 LEU CD1 . 10207 1 235 . 1 1 28 28 LEU HD11 H 1 0.979 0.030 . 1 . . . . 28 LEU HD1 . 10207 1 236 . 1 1 28 28 LEU HD12 H 1 0.979 0.030 . 1 . . . . 28 LEU HD1 . 10207 1 237 . 1 1 28 28 LEU HD13 H 1 0.979 0.030 . 1 . . . . 28 LEU HD1 . 10207 1 238 . 1 1 28 28 LEU CD2 C 13 26.579 0.300 . 2 . . . . 28 LEU CD2 . 10207 1 239 . 1 1 28 28 LEU HD21 H 1 0.950 0.030 . 1 . . . . 28 LEU HD2 . 10207 1 240 . 1 1 28 28 LEU HD22 H 1 0.950 0.030 . 1 . . . . 28 LEU HD2 . 10207 1 241 . 1 1 28 28 LEU HD23 H 1 0.950 0.030 . 1 . . . . 28 LEU HD2 . 10207 1 242 . 1 1 28 28 LEU C C 13 177.102 0.300 . 1 . . . . 28 LEU C . 10207 1 243 . 1 1 29 29 ALA N N 15 121.695 0.300 . 1 . . . . 29 ALA N . 10207 1 244 . 1 1 29 29 ALA H H 1 7.996 0.030 . 1 . . . . 29 ALA H . 10207 1 245 . 1 1 29 29 ALA CA C 13 55.373 0.300 . 1 . . . . 29 ALA CA . 10207 1 246 . 1 1 29 29 ALA HA H 1 4.175 0.030 . 1 . . . . 29 ALA HA . 10207 1 247 . 1 1 29 29 ALA CB C 13 17.751 0.300 . 1 . . . . 29 ALA CB . 10207 1 248 . 1 1 29 29 ALA HB1 H 1 1.410 0.030 . 1 . . . . 29 ALA HB . 10207 1 249 . 1 1 29 29 ALA HB2 H 1 1.410 0.030 . 1 . . . . 29 ALA HB . 10207 1 250 . 1 1 29 29 ALA HB3 H 1 1.410 0.030 . 1 . . . . 29 ALA HB . 10207 1 251 . 1 1 29 29 ALA C C 13 181.065 0.300 . 1 . . . . 29 ALA C . 10207 1 252 . 1 1 30 30 ILE N N 15 118.797 0.300 . 1 . . . . 30 ILE N . 10207 1 253 . 1 1 30 30 ILE H H 1 7.480 0.030 . 1 . . . . 30 ILE H . 10207 1 254 . 1 1 30 30 ILE CA C 13 64.334 0.300 . 1 . . . . 30 ILE CA . 10207 1 255 . 1 1 30 30 ILE HA H 1 3.698 0.030 . 1 . . . . 30 ILE HA . 10207 1 256 . 1 1 30 30 ILE CB C 13 38.471 0.300 . 1 . . . . 30 ILE CB . 10207 1 257 . 1 1 30 30 ILE HB H 1 1.710 0.030 . 1 . . . . 30 ILE HB . 10207 1 258 . 1 1 30 30 ILE CG1 C 13 29.005 0.300 . 1 . . . . 30 ILE CG1 . 10207 1 259 . 1 1 30 30 ILE HG12 H 1 1.152 0.030 . 2 . . . . 30 ILE HG12 . 10207 1 260 . 1 1 30 30 ILE HG13 H 1 1.650 0.030 . 2 . . . . 30 ILE HG13 . 10207 1 261 . 1 1 30 30 ILE CG2 C 13 17.180 0.300 . 1 . . . . 30 ILE CG2 . 10207 1 262 . 1 1 30 30 ILE HG21 H 1 0.882 0.030 . 1 . . . . 30 ILE HG2 . 10207 1 263 . 1 1 30 30 ILE HG22 H 1 0.882 0.030 . 1 . . . . 30 ILE HG2 . 10207 1 264 . 1 1 30 30 ILE HG23 H 1 0.882 0.030 . 1 . . . . 30 ILE HG2 . 10207 1 265 . 1 1 30 30 ILE CD1 C 13 12.850 0.300 . 1 . . . . 30 ILE CD1 . 10207 1 266 . 1 1 30 30 ILE HD11 H 1 0.796 0.030 . 1 . . . . 30 ILE HD1 . 10207 1 267 . 1 1 30 30 ILE HD12 H 1 0.796 0.030 . 1 . . . . 30 ILE HD1 . 10207 1 268 . 1 1 30 30 ILE HD13 H 1 0.796 0.030 . 1 . . . . 30 ILE HD1 . 10207 1 269 . 1 1 30 30 ILE C C 13 178.562 0.300 . 1 . . . . 30 ILE C . 10207 1 270 . 1 1 31 31 HIS N N 15 118.999 0.300 . 1 . . . . 31 HIS N . 10207 1 271 . 1 1 31 31 HIS H H 1 7.443 0.030 . 1 . . . . 31 HIS H . 10207 1 272 . 1 1 31 31 HIS CA C 13 59.207 0.300 . 1 . . . . 31 HIS CA . 10207 1 273 . 1 1 31 31 HIS HA H 1 4.235 0.030 . 1 . . . . 31 HIS HA . 10207 1 274 . 1 1 31 31 HIS CB C 13 28.607 0.300 . 1 . . . . 31 HIS CB . 10207 1 275 . 1 1 31 31 HIS HB2 H 1 3.014 0.030 . 2 . . . . 31 HIS HB2 . 10207 1 276 . 1 1 31 31 HIS HB3 H 1 2.872 0.030 . 2 . . . . 31 HIS HB3 . 10207 1 277 . 1 1 31 31 HIS CD2 C 13 127.174 0.300 . 1 . . . . 31 HIS CD2 . 10207 1 278 . 1 1 31 31 HIS HD2 H 1 6.884 0.030 . 1 . . . . 31 HIS HD2 . 10207 1 279 . 1 1 31 31 HIS CE1 C 13 139.611 0.300 . 1 . . . . 31 HIS CE1 . 10207 1 280 . 1 1 31 31 HIS HE1 H 1 7.978 0.030 . 1 . . . . 31 HIS HE1 . 10207 1 281 . 1 1 31 31 HIS C C 13 178.221 0.300 . 1 . . . . 31 HIS C . 10207 1 282 . 1 1 32 32 GLN N N 15 120.561 0.300 . 1 . . . . 32 GLN N . 10207 1 283 . 1 1 32 32 GLN H H 1 9.107 0.030 . 1 . . . . 32 GLN H . 10207 1 284 . 1 1 32 32 GLN CA C 13 59.849 0.300 . 1 . . . . 32 GLN CA . 10207 1 285 . 1 1 32 32 GLN HA H 1 3.717 0.030 . 1 . . . . 32 GLN HA . 10207 1 286 . 1 1 32 32 GLN CB C 13 28.269 0.300 . 1 . . . . 32 GLN CB . 10207 1 287 . 1 1 32 32 GLN HB2 H 1 2.299 0.030 . 2 . . . . 32 GLN HB2 . 10207 1 288 . 1 1 32 32 GLN HB3 H 1 2.152 0.030 . 2 . . . . 32 GLN HB3 . 10207 1 289 . 1 1 32 32 GLN CG C 13 35.495 0.300 . 1 . . . . 32 GLN CG . 10207 1 290 . 1 1 32 32 GLN HG2 H 1 2.755 0.030 . 1 . . . . 32 GLN HG2 . 10207 1 291 . 1 1 32 32 GLN HG3 H 1 2.755 0.030 . 1 . . . . 32 GLN HG3 . 10207 1 292 . 1 1 32 32 GLN NE2 N 15 112.756 0.300 . 1 . . . . 32 GLN NE2 . 10207 1 293 . 1 1 32 32 GLN HE21 H 1 7.661 0.030 . 2 . . . . 32 GLN HE21 . 10207 1 294 . 1 1 32 32 GLN HE22 H 1 7.009 0.030 . 2 . . . . 32 GLN HE22 . 10207 1 295 . 1 1 32 32 GLN C C 13 177.933 0.300 . 1 . . . . 32 GLN C . 10207 1 296 . 1 1 33 33 ALA N N 15 120.580 0.300 . 1 . . . . 33 ALA N . 10207 1 297 . 1 1 33 33 ALA H H 1 7.225 0.030 . 1 . . . . 33 ALA H . 10207 1 298 . 1 1 33 33 ALA CA C 13 54.275 0.300 . 1 . . . . 33 ALA CA . 10207 1 299 . 1 1 33 33 ALA HA H 1 4.223 0.030 . 1 . . . . 33 ALA HA . 10207 1 300 . 1 1 33 33 ALA CB C 13 18.072 0.300 . 1 . . . . 33 ALA CB . 10207 1 301 . 1 1 33 33 ALA HB1 H 1 1.469 0.030 . 1 . . . . 33 ALA HB . 10207 1 302 . 1 1 33 33 ALA HB2 H 1 1.469 0.030 . 1 . . . . 33 ALA HB . 10207 1 303 . 1 1 33 33 ALA HB3 H 1 1.469 0.030 . 1 . . . . 33 ALA HB . 10207 1 304 . 1 1 33 33 ALA C C 13 179.277 0.300 . 1 . . . . 33 ALA C . 10207 1 305 . 1 1 34 34 THR N N 15 108.871 0.300 . 1 . . . . 34 THR N . 10207 1 306 . 1 1 34 34 THR H H 1 7.690 0.030 . 1 . . . . 34 THR H . 10207 1 307 . 1 1 34 34 THR CA C 13 63.808 0.300 . 1 . . . . 34 THR CA . 10207 1 308 . 1 1 34 34 THR HA H 1 4.152 0.030 . 1 . . . . 34 THR HA . 10207 1 309 . 1 1 34 34 THR CB C 13 69.413 0.300 . 1 . . . . 34 THR CB . 10207 1 310 . 1 1 34 34 THR HB H 1 4.052 0.030 . 1 . . . . 34 THR HB . 10207 1 311 . 1 1 34 34 THR CG2 C 13 20.973 0.300 . 1 . . . . 34 THR CG2 . 10207 1 312 . 1 1 34 34 THR HG21 H 1 1.182 0.030 . 1 . . . . 34 THR HG2 . 10207 1 313 . 1 1 34 34 THR HG22 H 1 1.182 0.030 . 1 . . . . 34 THR HG2 . 10207 1 314 . 1 1 34 34 THR HG23 H 1 1.182 0.030 . 1 . . . . 34 THR HG2 . 10207 1 315 . 1 1 34 34 THR C C 13 175.831 0.300 . 1 . . . . 34 THR C . 10207 1 316 . 1 1 35 35 HIS N N 15 118.845 0.300 . 1 . . . . 35 HIS N . 10207 1 317 . 1 1 35 35 HIS H H 1 7.183 0.030 . 1 . . . . 35 HIS H . 10207 1 318 . 1 1 35 35 HIS CA C 13 55.596 0.300 . 1 . . . . 35 HIS CA . 10207 1 319 . 1 1 35 35 HIS HA H 1 4.800 0.030 . 1 . . . . 35 HIS HA . 10207 1 320 . 1 1 35 35 HIS CB C 13 28.675 0.300 . 1 . . . . 35 HIS CB . 10207 1 321 . 1 1 35 35 HIS HB2 H 1 3.301 0.030 . 2 . . . . 35 HIS HB2 . 10207 1 322 . 1 1 35 35 HIS HB3 H 1 3.159 0.030 . 2 . . . . 35 HIS HB3 . 10207 1 323 . 1 1 35 35 HIS CD2 C 13 127.098 0.300 . 1 . . . . 35 HIS CD2 . 10207 1 324 . 1 1 35 35 HIS HD2 H 1 6.673 0.030 . 1 . . . . 35 HIS HD2 . 10207 1 325 . 1 1 35 35 HIS CE1 C 13 139.713 0.300 . 1 . . . . 35 HIS CE1 . 10207 1 326 . 1 1 35 35 HIS HE1 H 1 7.996 0.030 . 1 . . . . 35 HIS HE1 . 10207 1 327 . 1 1 35 35 HIS C C 13 175.495 0.300 . 1 . . . . 35 HIS C . 10207 1 328 . 1 1 36 36 SER N N 15 115.119 0.300 . 1 . . . . 36 SER N . 10207 1 329 . 1 1 36 36 SER H H 1 7.871 0.030 . 1 . . . . 36 SER H . 10207 1 330 . 1 1 36 36 SER CA C 13 58.965 0.300 . 1 . . . . 36 SER CA . 10207 1 331 . 1 1 36 36 SER HA H 1 4.444 0.030 . 1 . . . . 36 SER HA . 10207 1 332 . 1 1 36 36 SER CB C 13 63.882 0.300 . 1 . . . . 36 SER CB . 10207 1 333 . 1 1 36 36 SER HB2 H 1 3.894 0.030 . 1 . . . . 36 SER HB2 . 10207 1 334 . 1 1 36 36 SER HB3 H 1 3.894 0.030 . 1 . . . . 36 SER HB3 . 10207 1 335 . 1 1 36 36 SER C C 13 175.070 0.300 . 1 . . . . 36 SER C . 10207 1 336 . 1 1 37 37 GLY N N 15 110.906 0.300 . 1 . . . . 37 GLY N . 10207 1 337 . 1 1 37 37 GLY H H 1 8.364 0.030 . 1 . . . . 37 GLY H . 10207 1 338 . 1 1 37 37 GLY CA C 13 45.222 0.300 . 1 . . . . 37 GLY CA . 10207 1 339 . 1 1 37 37 GLY HA2 H 1 3.977 0.030 . 2 . . . . 37 GLY HA2 . 10207 1 340 . 1 1 37 37 GLY HA3 H 1 3.901 0.030 . 2 . . . . 37 GLY HA3 . 10207 1 341 . 1 1 37 37 GLY C C 13 174.068 0.300 . 1 . . . . 37 GLY C . 10207 1 342 . 1 1 38 38 GLU N N 15 120.200 0.300 . 1 . . . . 38 GLU N . 10207 1 343 . 1 1 38 38 GLU H H 1 8.198 0.030 . 1 . . . . 38 GLU H . 10207 1 344 . 1 1 38 38 GLU CA C 13 56.989 0.300 . 1 . . . . 38 GLU CA . 10207 1 345 . 1 1 38 38 GLU HA H 1 4.140 0.030 . 1 . . . . 38 GLU HA . 10207 1 346 . 1 1 38 38 GLU CB C 13 30.446 0.300 . 1 . . . . 38 GLU CB . 10207 1 347 . 1 1 38 38 GLU HB2 H 1 1.960 0.030 . 2 . . . . 38 GLU HB2 . 10207 1 348 . 1 1 38 38 GLU HB3 H 1 1.896 0.030 . 2 . . . . 38 GLU HB3 . 10207 1 349 . 1 1 38 38 GLU CG C 13 36.275 0.300 . 1 . . . . 38 GLU CG . 10207 1 350 . 1 1 38 38 GLU HG2 H 1 2.233 0.030 . 2 . . . . 38 GLU HG2 . 10207 1 351 . 1 1 38 38 GLU HG3 H 1 2.190 0.030 . 2 . . . . 38 GLU HG3 . 10207 1 352 . 1 1 38 38 GLU C C 13 176.270 0.300 . 1 . . . . 38 GLU C . 10207 1 353 . 1 1 39 39 LYS N N 15 120.907 0.300 . 1 . . . . 39 LYS N . 10207 1 354 . 1 1 39 39 LYS H H 1 8.233 0.030 . 1 . . . . 39 LYS H . 10207 1 355 . 1 1 39 39 LYS CA C 13 53.740 0.300 . 1 . . . . 39 LYS CA . 10207 1 356 . 1 1 39 39 LYS HA H 1 4.464 0.030 . 1 . . . . 39 LYS HA . 10207 1 357 . 1 1 39 39 LYS CB C 13 33.224 0.300 . 1 . . . . 39 LYS CB . 10207 1 358 . 1 1 39 39 LYS HB2 H 1 1.537 0.030 . 2 . . . . 39 LYS HB2 . 10207 1 359 . 1 1 39 39 LYS HB3 H 1 1.312 0.030 . 2 . . . . 39 LYS HB3 . 10207 1 360 . 1 1 39 39 LYS CG C 13 25.140 0.300 . 1 . . . . 39 LYS CG . 10207 1 361 . 1 1 39 39 LYS HG2 H 1 1.297 0.030 . 2 . . . . 39 LYS HG2 . 10207 1 362 . 1 1 39 39 LYS HG3 H 1 1.053 0.030 . 2 . . . . 39 LYS HG3 . 10207 1 363 . 1 1 39 39 LYS CD C 13 29.541 0.300 . 1 . . . . 39 LYS CD . 10207 1 364 . 1 1 39 39 LYS HD2 H 1 1.465 0.030 . 1 . . . . 39 LYS HD2 . 10207 1 365 . 1 1 39 39 LYS HD3 H 1 1.465 0.030 . 1 . . . . 39 LYS HD3 . 10207 1 366 . 1 1 39 39 LYS CE C 13 42.185 0.300 . 1 . . . . 39 LYS CE . 10207 1 367 . 1 1 39 39 LYS HE2 H 1 2.876 0.030 . 1 . . . . 39 LYS HE2 . 10207 1 368 . 1 1 39 39 LYS HE3 H 1 2.876 0.030 . 1 . . . . 39 LYS HE3 . 10207 1 369 . 1 1 39 39 LYS C C 13 173.830 0.300 . 1 . . . . 39 LYS C . 10207 1 370 . 1 1 40 40 PRO CA C 13 63.189 0.300 . 1 . . . . 40 PRO CA . 10207 1 371 . 1 1 40 40 PRO HA H 1 4.462 0.030 . 1 . . . . 40 PRO HA . 10207 1 372 . 1 1 40 40 PRO CB C 13 32.177 0.300 . 1 . . . . 40 PRO CB . 10207 1 373 . 1 1 40 40 PRO HB2 H 1 1.921 0.030 . 2 . . . . 40 PRO HB2 . 10207 1 374 . 1 1 40 40 PRO HB3 H 1 2.300 0.030 . 2 . . . . 40 PRO HB3 . 10207 1 375 . 1 1 40 40 PRO CG C 13 27.286 0.300 . 1 . . . . 40 PRO CG . 10207 1 376 . 1 1 40 40 PRO HG2 H 1 1.996 0.030 . 1 . . . . 40 PRO HG2 . 10207 1 377 . 1 1 40 40 PRO HG3 H 1 1.996 0.030 . 1 . . . . 40 PRO HG3 . 10207 1 378 . 1 1 40 40 PRO CD C 13 49.826 0.300 . 1 . . . . 40 PRO CD . 10207 1 379 . 1 1 40 40 PRO HD2 H 1 3.608 0.030 . 1 . . . . 40 PRO HD2 . 10207 1 380 . 1 1 40 40 PRO HD3 H 1 3.608 0.030 . 1 . . . . 40 PRO HD3 . 10207 1 381 . 1 1 41 41 SER N N 15 116.632 0.300 . 1 . . . . 41 SER N . 10207 1 382 . 1 1 41 41 SER H H 1 8.507 0.030 . 1 . . . . 41 SER H . 10207 1 383 . 1 1 41 41 SER CA C 13 58.580 0.300 . 1 . . . . 41 SER CA . 10207 1 384 . 1 1 41 41 SER HA H 1 4.502 0.030 . 1 . . . . 41 SER HA . 10207 1 385 . 1 1 41 41 SER CB C 13 63.908 0.300 . 1 . . . . 41 SER CB . 10207 1 386 . 1 1 41 41 SER HB2 H 1 3.894 0.030 . 1 . . . . 41 SER HB2 . 10207 1 387 . 1 1 41 41 SER HB3 H 1 3.894 0.030 . 1 . . . . 41 SER HB3 . 10207 1 388 . 1 1 42 42 GLY N N 15 110.670 0.300 . 1 . . . . 42 GLY N . 10207 1 389 . 1 1 42 42 GLY H H 1 8.222 0.030 . 1 . . . . 42 GLY H . 10207 1 390 . 1 1 42 42 GLY CA C 13 44.675 0.300 . 1 . . . . 42 GLY CA . 10207 1 391 . 1 1 42 42 GLY HA2 H 1 4.151 0.030 . 2 . . . . 42 GLY HA2 . 10207 1 392 . 1 1 42 42 GLY HA3 H 1 4.079 0.030 . 2 . . . . 42 GLY HA3 . 10207 1 393 . 1 1 43 43 PRO CA C 13 63.074 0.300 . 1 . . . . 43 PRO CA . 10207 1 394 . 1 1 43 43 PRO HA H 1 4.462 0.030 . 1 . . . . 43 PRO HA . 10207 1 395 . 1 1 43 43 PRO CB C 13 32.165 0.300 . 1 . . . . 43 PRO CB . 10207 1 396 . 1 1 43 43 PRO HB2 H 1 2.300 0.030 . 2 . . . . 43 PRO HB2 . 10207 1 397 . 1 1 43 43 PRO HB3 H 1 1.921 0.030 . 2 . . . . 43 PRO HB3 . 10207 1 398 . 1 1 43 43 PRO CG C 13 27.441 0.300 . 1 . . . . 43 PRO CG . 10207 1 399 . 1 1 43 43 PRO HG2 H 1 2.008 0.030 . 1 . . . . 43 PRO HG2 . 10207 1 400 . 1 1 43 43 PRO HG3 H 1 2.008 0.030 . 1 . . . . 43 PRO HG3 . 10207 1 401 . 1 1 43 43 PRO CD C 13 50.685 0.300 . 1 . . . . 43 PRO CD . 10207 1 402 . 1 1 43 43 PRO HD2 H 1 3.629 0.030 . 2 . . . . 43 PRO HD2 . 10207 1 403 . 1 1 43 43 PRO HD3 H 1 3.819 0.030 . 2 . . . . 43 PRO HD3 . 10207 1 stop_ save_