################################### # 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 10086 _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 10086 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10086 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 7 7 GLY HA2 H 1 4.002 0.030 . 1 . . . . 7 GLY HA2 . 10086 1 2 . 1 1 7 7 GLY HA3 H 1 4.002 0.030 . 1 . . . . 7 GLY HA3 . 10086 1 3 . 1 1 7 7 GLY C C 13 174.029 0.300 . 1 . . . . 7 GLY C . 10086 1 4 . 1 1 7 7 GLY CA C 13 45.485 0.300 . 1 . . . . 7 GLY CA . 10086 1 5 . 1 1 8 8 GLU H H 1 8.249 0.030 . 1 . . . . 8 GLU H . 10086 1 6 . 1 1 8 8 GLU HA H 1 4.296 0.030 . 1 . . . . 8 GLU HA . 10086 1 7 . 1 1 8 8 GLU HB2 H 1 2.082 0.030 . 2 . . . . 8 GLU HB2 . 10086 1 8 . 1 1 8 8 GLU HB3 H 1 1.949 0.030 . 2 . . . . 8 GLU HB3 . 10086 1 9 . 1 1 8 8 GLU HG2 H 1 2.259 0.030 . 1 . . . . 8 GLU HG2 . 10086 1 10 . 1 1 8 8 GLU HG3 H 1 2.259 0.030 . 1 . . . . 8 GLU HG3 . 10086 1 11 . 1 1 8 8 GLU CA C 13 56.593 0.300 . 1 . . . . 8 GLU CA . 10086 1 12 . 1 1 8 8 GLU CB C 13 30.435 0.300 . 1 . . . . 8 GLU CB . 10086 1 13 . 1 1 8 8 GLU CG C 13 36.333 0.300 . 1 . . . . 8 GLU CG . 10086 1 14 . 1 1 8 8 GLU N N 15 120.092 0.300 . 1 . . . . 8 GLU N . 10086 1 15 . 1 1 9 9 GLU H H 1 8.294 0.030 . 1 . . . . 9 GLU H . 10086 1 16 . 1 1 9 9 GLU HA H 1 4.445 0.030 . 1 . . . . 9 GLU HA . 10086 1 17 . 1 1 9 9 GLU HB2 H 1 1.872 0.030 . 2 . . . . 9 GLU HB2 . 10086 1 18 . 1 1 9 9 GLU HB3 H 1 1.789 0.030 . 2 . . . . 9 GLU HB3 . 10086 1 19 . 1 1 9 9 GLU HG2 H 1 2.187 0.030 . 2 . . . . 9 GLU HG2 . 10086 1 20 . 1 1 9 9 GLU HG3 H 1 2.030 0.030 . 2 . . . . 9 GLU HG3 . 10086 1 21 . 1 1 9 9 GLU CA C 13 56.232 0.300 . 1 . . . . 9 GLU CA . 10086 1 22 . 1 1 9 9 GLU CB C 13 31.240 0.300 . 1 . . . . 9 GLU CB . 10086 1 23 . 1 1 9 9 GLU CG C 13 36.858 0.300 . 1 . . . . 9 GLU CG . 10086 1 24 . 1 1 9 9 GLU N N 15 121.431 0.300 . 1 . . . . 9 GLU N . 10086 1 25 . 1 1 10 10 ILE H H 1 8.326 0.030 . 1 . . . . 10 ILE H . 10086 1 26 . 1 1 10 10 ILE HA H 1 4.314 0.030 . 1 . . . . 10 ILE HA . 10086 1 27 . 1 1 10 10 ILE HB H 1 1.704 0.030 . 1 . . . . 10 ILE HB . 10086 1 28 . 1 1 10 10 ILE HG12 H 1 1.252 0.030 . 2 . . . . 10 ILE HG12 . 10086 1 29 . 1 1 10 10 ILE HG13 H 1 0.920 0.030 . 2 . . . . 10 ILE HG13 . 10086 1 30 . 1 1 10 10 ILE HG21 H 1 0.707 0.030 . 1 . . . . 10 ILE HG2 . 10086 1 31 . 1 1 10 10 ILE HG22 H 1 0.707 0.030 . 1 . . . . 10 ILE HG2 . 10086 1 32 . 1 1 10 10 ILE HG23 H 1 0.707 0.030 . 1 . . . . 10 ILE HG2 . 10086 1 33 . 1 1 10 10 ILE HD11 H 1 0.714 0.030 . 1 . . . . 10 ILE HD1 . 10086 1 34 . 1 1 10 10 ILE HD12 H 1 0.714 0.030 . 1 . . . . 10 ILE HD1 . 10086 1 35 . 1 1 10 10 ILE HD13 H 1 0.714 0.030 . 1 . . . . 10 ILE HD1 . 10086 1 36 . 1 1 10 10 ILE C C 13 173.988 0.300 . 1 . . . . 10 ILE C . 10086 1 37 . 1 1 10 10 ILE CA C 13 59.776 0.300 . 1 . . . . 10 ILE CA . 10086 1 38 . 1 1 10 10 ILE CB C 13 40.850 0.300 . 1 . . . . 10 ILE CB . 10086 1 39 . 1 1 10 10 ILE CG1 C 13 26.798 0.300 . 1 . . . . 10 ILE CG1 . 10086 1 40 . 1 1 10 10 ILE CG2 C 13 17.980 0.300 . 1 . . . . 10 ILE CG2 . 10086 1 41 . 1 1 10 10 ILE CD1 C 13 13.840 0.300 . 1 . . . . 10 ILE CD1 . 10086 1 42 . 1 1 11 11 PHE H H 1 8.345 0.030 . 1 . . . . 11 PHE H . 10086 1 43 . 1 1 11 11 PHE HA H 1 4.959 0.030 . 1 . . . . 11 PHE HA . 10086 1 44 . 1 1 11 11 PHE HB2 H 1 2.684 0.030 . 2 . . . . 11 PHE HB2 . 10086 1 45 . 1 1 11 11 PHE HB3 H 1 2.574 0.030 . 2 . . . . 11 PHE HB3 . 10086 1 46 . 1 1 11 11 PHE HD1 H 1 7.042 0.030 . 1 . . . . 11 PHE HD1 . 10086 1 47 . 1 1 11 11 PHE HD2 H 1 7.042 0.030 . 1 . . . . 11 PHE HD2 . 10086 1 48 . 1 1 11 11 PHE HE1 H 1 7.294 0.030 . 1 . . . . 11 PHE HE1 . 10086 1 49 . 1 1 11 11 PHE HE2 H 1 7.294 0.030 . 1 . . . . 11 PHE HE2 . 10086 1 50 . 1 1 11 11 PHE HZ H 1 7.286 0.030 . 1 . . . . 11 PHE HZ . 10086 1 51 . 1 1 11 11 PHE CA C 13 57.300 0.300 . 1 . . . . 11 PHE CA . 10086 1 52 . 1 1 11 11 PHE CB C 13 41.348 0.300 . 1 . . . . 11 PHE CB . 10086 1 53 . 1 1 11 11 PHE CD1 C 13 131.588 0.300 . 1 . . . . 11 PHE CD1 . 10086 1 54 . 1 1 11 11 PHE CD2 C 13 131.588 0.300 . 1 . . . . 11 PHE CD2 . 10086 1 55 . 1 1 11 11 PHE CE1 C 13 131.386 0.300 . 1 . . . . 11 PHE CE1 . 10086 1 56 . 1 1 11 11 PHE CE2 C 13 131.386 0.300 . 1 . . . . 11 PHE CE2 . 10086 1 57 . 1 1 11 11 PHE CZ C 13 129.652 0.300 . 1 . . . . 11 PHE CZ . 10086 1 58 . 1 1 11 11 PHE N N 15 120.756 0.300 . 1 . . . . 11 PHE N . 10086 1 59 . 1 1 12 12 CYS H H 1 9.254 0.030 . 1 . . . . 12 CYS H . 10086 1 60 . 1 1 12 12 CYS HA H 1 4.499 0.030 . 1 . . . . 12 CYS HA . 10086 1 61 . 1 1 12 12 CYS HB2 H 1 2.614 0.030 . 2 . . . . 12 CYS HB2 . 10086 1 62 . 1 1 12 12 CYS HB3 H 1 2.439 0.030 . 2 . . . . 12 CYS HB3 . 10086 1 63 . 1 1 12 12 CYS CA C 13 57.281 0.300 . 1 . . . . 12 CYS CA . 10086 1 64 . 1 1 12 12 CYS CB C 13 28.910 0.300 . 1 . . . . 12 CYS CB . 10086 1 65 . 1 1 12 12 CYS N N 15 122.032 0.300 . 1 . . . . 12 CYS N . 10086 1 66 . 1 1 13 13 HIS H H 1 8.865 0.030 . 1 . . . . 13 HIS H . 10086 1 67 . 1 1 13 13 HIS HA H 1 5.161 0.030 . 1 . . . . 13 HIS HA . 10086 1 68 . 1 1 13 13 HIS HB2 H 1 2.957 0.030 . 2 . . . . 13 HIS HB2 . 10086 1 69 . 1 1 13 13 HIS HB3 H 1 2.030 0.030 . 2 . . . . 13 HIS HB3 . 10086 1 70 . 1 1 13 13 HIS HD2 H 1 6.679 0.030 . 1 . . . . 13 HIS HD2 . 10086 1 71 . 1 1 13 13 HIS HE1 H 1 7.545 0.030 . 1 . . . . 13 HIS HE1 . 10086 1 72 . 1 1 13 13 HIS C C 13 173.699 0.300 . 1 . . . . 13 HIS C . 10086 1 73 . 1 1 13 13 HIS CA C 13 53.999 0.300 . 1 . . . . 13 HIS CA . 10086 1 74 . 1 1 13 13 HIS CB C 13 30.851 0.300 . 1 . . . . 13 HIS CB . 10086 1 75 . 1 1 13 13 HIS CD2 C 13 118.436 0.300 . 1 . . . . 13 HIS CD2 . 10086 1 76 . 1 1 13 13 HIS CE1 C 13 138.233 0.300 . 1 . . . . 13 HIS CE1 . 10086 1 77 . 1 1 13 13 HIS N N 15 128.705 0.300 . 1 . . . . 13 HIS N . 10086 1 78 . 1 1 14 14 VAL H H 1 8.940 0.030 . 1 . . . . 14 VAL H . 10086 1 79 . 1 1 14 14 VAL HA H 1 4.358 0.030 . 1 . . . . 14 VAL HA . 10086 1 80 . 1 1 14 14 VAL HB H 1 1.857 0.030 . 1 . . . . 14 VAL HB . 10086 1 81 . 1 1 14 14 VAL HG11 H 1 0.726 0.030 . 1 . . . . 14 VAL HG1 . 10086 1 82 . 1 1 14 14 VAL HG12 H 1 0.726 0.030 . 1 . . . . 14 VAL HG1 . 10086 1 83 . 1 1 14 14 VAL HG13 H 1 0.726 0.030 . 1 . . . . 14 VAL HG1 . 10086 1 84 . 1 1 14 14 VAL HG21 H 1 0.705 0.030 . 1 . . . . 14 VAL HG2 . 10086 1 85 . 1 1 14 14 VAL HG22 H 1 0.705 0.030 . 1 . . . . 14 VAL HG2 . 10086 1 86 . 1 1 14 14 VAL HG23 H 1 0.705 0.030 . 1 . . . . 14 VAL HG2 . 10086 1 87 . 1 1 14 14 VAL C C 13 175.262 0.300 . 1 . . . . 14 VAL C . 10086 1 88 . 1 1 14 14 VAL CA C 13 61.408 0.300 . 1 . . . . 14 VAL CA . 10086 1 89 . 1 1 14 14 VAL CB C 13 32.520 0.300 . 1 . . . . 14 VAL CB . 10086 1 90 . 1 1 14 14 VAL CG1 C 13 22.632 0.300 . 2 . . . . 14 VAL CG1 . 10086 1 91 . 1 1 14 14 VAL CG2 C 13 20.717 0.300 . 2 . . . . 14 VAL CG2 . 10086 1 92 . 1 1 14 14 VAL N N 15 124.309 0.300 . 1 . . . . 14 VAL N . 10086 1 93 . 1 1 15 15 TYR H H 1 9.925 0.030 . 1 . . . . 15 TYR H . 10086 1 94 . 1 1 15 15 TYR HA H 1 4.221 0.030 . 1 . . . . 15 TYR HA . 10086 1 95 . 1 1 15 15 TYR HB2 H 1 2.685 0.030 . 2 . . . . 15 TYR HB2 . 10086 1 96 . 1 1 15 15 TYR HB3 H 1 1.789 0.030 . 2 . . . . 15 TYR HB3 . 10086 1 97 . 1 1 15 15 TYR HD1 H 1 7.325 0.030 . 1 . . . . 15 TYR HD1 . 10086 1 98 . 1 1 15 15 TYR HD2 H 1 7.325 0.030 . 1 . . . . 15 TYR HD2 . 10086 1 99 . 1 1 15 15 TYR HE1 H 1 6.543 0.030 . 1 . . . . 15 TYR HE1 . 10086 1 100 . 1 1 15 15 TYR HE2 H 1 6.543 0.030 . 1 . . . . 15 TYR HE2 . 10086 1 101 . 1 1 15 15 TYR C C 13 174.943 0.300 . 1 . . . . 15 TYR C . 10086 1 102 . 1 1 15 15 TYR CA C 13 60.283 0.300 . 1 . . . . 15 TYR CA . 10086 1 103 . 1 1 15 15 TYR CB C 13 37.312 0.300 . 1 . . . . 15 TYR CB . 10086 1 104 . 1 1 15 15 TYR CD1 C 13 133.489 0.300 . 1 . . . . 15 TYR CD1 . 10086 1 105 . 1 1 15 15 TYR CD2 C 13 133.489 0.300 . 1 . . . . 15 TYR CD2 . 10086 1 106 . 1 1 15 15 TYR CE1 C 13 117.176 0.300 . 1 . . . . 15 TYR CE1 . 10086 1 107 . 1 1 15 15 TYR CE2 C 13 117.176 0.300 . 1 . . . . 15 TYR CE2 . 10086 1 108 . 1 1 15 15 TYR N N 15 129.253 0.300 . 1 . . . . 15 TYR N . 10086 1 109 . 1 1 16 16 ILE H H 1 8.912 0.030 . 1 . . . . 16 ILE H . 10086 1 110 . 1 1 16 16 ILE HA H 1 4.335 0.030 . 1 . . . . 16 ILE HA . 10086 1 111 . 1 1 16 16 ILE HB H 1 1.703 0.030 . 1 . . . . 16 ILE HB . 10086 1 112 . 1 1 16 16 ILE HG12 H 1 1.447 0.030 . 2 . . . . 16 ILE HG12 . 10086 1 113 . 1 1 16 16 ILE HG13 H 1 0.816 0.030 . 2 . . . . 16 ILE HG13 . 10086 1 114 . 1 1 16 16 ILE HG21 H 1 0.739 0.030 . 1 . . . . 16 ILE HG2 . 10086 1 115 . 1 1 16 16 ILE HG22 H 1 0.739 0.030 . 1 . . . . 16 ILE HG2 . 10086 1 116 . 1 1 16 16 ILE HG23 H 1 0.739 0.030 . 1 . . . . 16 ILE HG2 . 10086 1 117 . 1 1 16 16 ILE HD11 H 1 0.628 0.030 . 1 . . . . 16 ILE HD1 . 10086 1 118 . 1 1 16 16 ILE HD12 H 1 0.628 0.030 . 1 . . . . 16 ILE HD1 . 10086 1 119 . 1 1 16 16 ILE HD13 H 1 0.628 0.030 . 1 . . . . 16 ILE HD1 . 10086 1 120 . 1 1 16 16 ILE C C 13 177.280 0.300 . 1 . . . . 16 ILE C . 10086 1 121 . 1 1 16 16 ILE CA C 13 62.670 0.300 . 1 . . . . 16 ILE CA . 10086 1 122 . 1 1 16 16 ILE CB C 13 39.683 0.300 . 1 . . . . 16 ILE CB . 10086 1 123 . 1 1 16 16 ILE CG1 C 13 28.145 0.300 . 1 . . . . 16 ILE CG1 . 10086 1 124 . 1 1 16 16 ILE CG2 C 13 18.389 0.300 . 1 . . . . 16 ILE CG2 . 10086 1 125 . 1 1 16 16 ILE CD1 C 13 13.760 0.300 . 1 . . . . 16 ILE CD1 . 10086 1 126 . 1 1 16 16 ILE N N 15 121.861 0.300 . 1 . . . . 16 ILE N . 10086 1 127 . 1 1 17 17 THR H H 1 7.998 0.030 . 1 . . . . 17 THR H . 10086 1 128 . 1 1 17 17 THR HA H 1 4.939 0.030 . 1 . . . . 17 THR HA . 10086 1 129 . 1 1 17 17 THR HB H 1 4.768 0.030 . 1 . . . . 17 THR HB . 10086 1 130 . 1 1 17 17 THR HG21 H 1 1.242 0.030 . 1 . . . . 17 THR HG2 . 10086 1 131 . 1 1 17 17 THR HG22 H 1 1.242 0.030 . 1 . . . . 17 THR HG2 . 10086 1 132 . 1 1 17 17 THR HG23 H 1 1.242 0.030 . 1 . . . . 17 THR HG2 . 10086 1 133 . 1 1 17 17 THR C C 13 174.016 0.300 . 1 . . . . 17 THR C . 10086 1 134 . 1 1 17 17 THR CA C 13 59.478 0.300 . 1 . . . . 17 THR CA . 10086 1 135 . 1 1 17 17 THR CB C 13 71.843 0.300 . 1 . . . . 17 THR CB . 10086 1 136 . 1 1 17 17 THR CG2 C 13 22.046 0.300 . 1 . . . . 17 THR CG2 . 10086 1 137 . 1 1 17 17 THR N N 15 109.659 0.300 . 1 . . . . 17 THR N . 10086 1 138 . 1 1 18 18 GLU H H 1 8.897 0.030 . 1 . . . . 18 GLU H . 10086 1 139 . 1 1 18 18 GLU HA H 1 4.221 0.030 . 1 . . . . 18 GLU HA . 10086 1 140 . 1 1 18 18 GLU HB2 H 1 1.886 0.030 . 2 . . . . 18 GLU HB2 . 10086 1 141 . 1 1 18 18 GLU HB3 H 1 1.737 0.030 . 2 . . . . 18 GLU HB3 . 10086 1 142 . 1 1 18 18 GLU HG2 H 1 2.090 0.030 . 1 . . . . 18 GLU HG2 . 10086 1 143 . 1 1 18 18 GLU HG3 H 1 2.090 0.030 . 1 . . . . 18 GLU HG3 . 10086 1 144 . 1 1 18 18 GLU C C 13 176.744 0.300 . 1 . . . . 18 GLU C . 10086 1 145 . 1 1 18 18 GLU CA C 13 59.313 0.300 . 1 . . . . 18 GLU CA . 10086 1 146 . 1 1 18 18 GLU CB C 13 29.640 0.300 . 1 . . . . 18 GLU CB . 10086 1 147 . 1 1 18 18 GLU CG C 13 35.936 0.300 . 1 . . . . 18 GLU CG . 10086 1 148 . 1 1 18 18 GLU N N 15 115.798 0.300 . 1 . . . . 18 GLU N . 10086 1 149 . 1 1 19 19 HIS H H 1 7.843 0.030 . 1 . . . . 19 HIS H . 10086 1 150 . 1 1 19 19 HIS HA H 1 5.059 0.030 . 1 . . . . 19 HIS HA . 10086 1 151 . 1 1 19 19 HIS HB2 H 1 3.425 0.030 . 2 . . . . 19 HIS HB2 . 10086 1 152 . 1 1 19 19 HIS HB3 H 1 2.897 0.030 . 2 . . . . 19 HIS HB3 . 10086 1 153 . 1 1 19 19 HIS HD2 H 1 7.105 0.030 . 1 . . . . 19 HIS HD2 . 10086 1 154 . 1 1 19 19 HIS HE1 H 1 7.834 0.030 . 1 . . . . 19 HIS HE1 . 10086 1 155 . 1 1 19 19 HIS C C 13 175.220 0.300 . 1 . . . . 19 HIS C . 10086 1 156 . 1 1 19 19 HIS CA C 13 55.562 0.300 . 1 . . . . 19 HIS CA . 10086 1 157 . 1 1 19 19 HIS CB C 13 32.747 0.300 . 1 . . . . 19 HIS CB . 10086 1 158 . 1 1 19 19 HIS CD2 C 13 119.709 0.300 . 1 . . . . 19 HIS CD2 . 10086 1 159 . 1 1 19 19 HIS CE1 C 13 138.651 0.300 . 1 . . . . 19 HIS CE1 . 10086 1 160 . 1 1 19 19 HIS N N 15 111.237 0.300 . 1 . . . . 19 HIS N . 10086 1 161 . 1 1 20 20 SER H H 1 7.716 0.030 . 1 . . . . 20 SER H . 10086 1 162 . 1 1 20 20 SER HA H 1 4.777 0.030 . 1 . . . . 20 SER HA . 10086 1 163 . 1 1 20 20 SER HB2 H 1 3.779 0.030 . 2 . . . . 20 SER HB2 . 10086 1 164 . 1 1 20 20 SER HB3 H 1 3.669 0.030 . 2 . . . . 20 SER HB3 . 10086 1 165 . 1 1 20 20 SER C C 13 171.700 0.300 . 1 . . . . 20 SER C . 10086 1 166 . 1 1 20 20 SER CA C 13 57.312 0.300 . 1 . . . . 20 SER CA . 10086 1 167 . 1 1 20 20 SER CB C 13 65.211 0.300 . 1 . . . . 20 SER CB . 10086 1 168 . 1 1 20 20 SER N N 15 115.699 0.300 . 1 . . . . 20 SER N . 10086 1 169 . 1 1 21 21 TYR H H 1 7.925 0.030 . 1 . . . . 21 TYR H . 10086 1 170 . 1 1 21 21 TYR HA H 1 5.212 0.030 . 1 . . . . 21 TYR HA . 10086 1 171 . 1 1 21 21 TYR HB2 H 1 1.879 0.030 . 2 . . . . 21 TYR HB2 . 10086 1 172 . 1 1 21 21 TYR HB3 H 1 1.231 0.030 . 2 . . . . 21 TYR HB3 . 10086 1 173 . 1 1 21 21 TYR HD1 H 1 6.255 0.030 . 1 . . . . 21 TYR HD1 . 10086 1 174 . 1 1 21 21 TYR HD2 H 1 6.255 0.030 . 1 . . . . 21 TYR HD2 . 10086 1 175 . 1 1 21 21 TYR HE1 H 1 6.291 0.030 . 1 . . . . 21 TYR HE1 . 10086 1 176 . 1 1 21 21 TYR HE2 H 1 6.291 0.030 . 1 . . . . 21 TYR HE2 . 10086 1 177 . 1 1 21 21 TYR C C 13 174.037 0.300 . 1 . . . . 21 TYR C . 10086 1 178 . 1 1 21 21 TYR CA C 13 54.903 0.300 . 1 . . . . 21 TYR CA . 10086 1 179 . 1 1 21 21 TYR CB C 13 40.378 0.300 . 1 . . . . 21 TYR CB . 10086 1 180 . 1 1 21 21 TYR CD1 C 13 133.157 0.300 . 1 . . . . 21 TYR CD1 . 10086 1 181 . 1 1 21 21 TYR CD2 C 13 133.157 0.300 . 1 . . . . 21 TYR CD2 . 10086 1 182 . 1 1 21 21 TYR CE1 C 13 117.416 0.300 . 1 . . . . 21 TYR CE1 . 10086 1 183 . 1 1 21 21 TYR CE2 C 13 117.416 0.300 . 1 . . . . 21 TYR CE2 . 10086 1 184 . 1 1 21 21 TYR N N 15 120.166 0.300 . 1 . . . . 21 TYR N . 10086 1 185 . 1 1 22 22 VAL H H 1 9.097 0.030 . 1 . . . . 22 VAL H . 10086 1 186 . 1 1 22 22 VAL HA H 1 4.357 0.030 . 1 . . . . 22 VAL HA . 10086 1 187 . 1 1 22 22 VAL HB H 1 1.947 0.030 . 1 . . . . 22 VAL HB . 10086 1 188 . 1 1 22 22 VAL HG11 H 1 0.841 0.030 . 1 . . . . 22 VAL HG1 . 10086 1 189 . 1 1 22 22 VAL HG12 H 1 0.841 0.030 . 1 . . . . 22 VAL HG1 . 10086 1 190 . 1 1 22 22 VAL HG13 H 1 0.841 0.030 . 1 . . . . 22 VAL HG1 . 10086 1 191 . 1 1 22 22 VAL HG21 H 1 0.834 0.030 . 1 . . . . 22 VAL HG2 . 10086 1 192 . 1 1 22 22 VAL HG22 H 1 0.834 0.030 . 1 . . . . 22 VAL HG2 . 10086 1 193 . 1 1 22 22 VAL HG23 H 1 0.834 0.030 . 1 . . . . 22 VAL HG2 . 10086 1 194 . 1 1 22 22 VAL C C 13 174.603 0.300 . 1 . . . . 22 VAL C . 10086 1 195 . 1 1 22 22 VAL CA C 13 59.630 0.300 . 1 . . . . 22 VAL CA . 10086 1 196 . 1 1 22 22 VAL CB C 13 34.350 0.300 . 1 . . . . 22 VAL CB . 10086 1 197 . 1 1 22 22 VAL CG1 C 13 21.695 0.300 . 2 . . . . 22 VAL CG1 . 10086 1 198 . 1 1 22 22 VAL CG2 C 13 20.207 0.300 . 2 . . . . 22 VAL CG2 . 10086 1 199 . 1 1 22 22 VAL N N 15 117.389 0.300 . 1 . . . . 22 VAL N . 10086 1 200 . 1 1 23 23 SER H H 1 8.698 0.030 . 1 . . . . 23 SER H . 10086 1 201 . 1 1 23 23 SER HA H 1 5.253 0.030 . 1 . . . . 23 SER HA . 10086 1 202 . 1 1 23 23 SER HB2 H 1 3.723 0.030 . 2 . . . . 23 SER HB2 . 10086 1 203 . 1 1 23 23 SER HB3 H 1 3.571 0.030 . 2 . . . . 23 SER HB3 . 10086 1 204 . 1 1 23 23 SER C C 13 174.160 0.300 . 1 . . . . 23 SER C . 10086 1 205 . 1 1 23 23 SER CA C 13 57.417 0.300 . 1 . . . . 23 SER CA . 10086 1 206 . 1 1 23 23 SER CB C 13 63.457 0.300 . 1 . . . . 23 SER CB . 10086 1 207 . 1 1 23 23 SER N N 15 121.046 0.300 . 1 . . . . 23 SER N . 10086 1 208 . 1 1 24 24 VAL H H 1 9.096 0.030 . 1 . . . . 24 VAL H . 10086 1 209 . 1 1 24 24 VAL HA H 1 4.463 0.030 . 1 . . . . 24 VAL HA . 10086 1 210 . 1 1 24 24 VAL HB H 1 2.076 0.030 . 1 . . . . 24 VAL HB . 10086 1 211 . 1 1 24 24 VAL HG11 H 1 1.022 0.030 . 1 . . . . 24 VAL HG1 . 10086 1 212 . 1 1 24 24 VAL HG12 H 1 1.022 0.030 . 1 . . . . 24 VAL HG1 . 10086 1 213 . 1 1 24 24 VAL HG13 H 1 1.022 0.030 . 1 . . . . 24 VAL HG1 . 10086 1 214 . 1 1 24 24 VAL HG21 H 1 0.875 0.030 . 1 . . . . 24 VAL HG2 . 10086 1 215 . 1 1 24 24 VAL HG22 H 1 0.875 0.030 . 1 . . . . 24 VAL HG2 . 10086 1 216 . 1 1 24 24 VAL HG23 H 1 0.875 0.030 . 1 . . . . 24 VAL HG2 . 10086 1 217 . 1 1 24 24 VAL C C 13 174.778 0.300 . 1 . . . . 24 VAL C . 10086 1 218 . 1 1 24 24 VAL CA C 13 60.648 0.300 . 1 . . . . 24 VAL CA . 10086 1 219 . 1 1 24 24 VAL CB C 13 34.812 0.300 . 1 . . . . 24 VAL CB . 10086 1 220 . 1 1 24 24 VAL CG1 C 13 21.829 0.300 . 2 . . . . 24 VAL CG1 . 10086 1 221 . 1 1 24 24 VAL CG2 C 13 20.704 0.300 . 2 . . . . 24 VAL CG2 . 10086 1 222 . 1 1 24 24 VAL N N 15 125.974 0.300 . 1 . . . . 24 VAL N . 10086 1 223 . 1 1 25 25 LYS H H 1 8.795 0.030 . 1 . . . . 25 LYS H . 10086 1 224 . 1 1 25 25 LYS HA H 1 3.977 0.030 . 1 . . . . 25 LYS HA . 10086 1 225 . 1 1 25 25 LYS HB2 H 1 1.580 0.030 . 1 . . . . 25 LYS HB2 . 10086 1 226 . 1 1 25 25 LYS HB3 H 1 1.580 0.030 . 1 . . . . 25 LYS HB3 . 10086 1 227 . 1 1 25 25 LYS HG2 H 1 1.073 0.030 . 1 . . . . 25 LYS HG2 . 10086 1 228 . 1 1 25 25 LYS HG3 H 1 1.073 0.030 . 1 . . . . 25 LYS HG3 . 10086 1 229 . 1 1 25 25 LYS HD2 H 1 1.523 0.030 . 1 . . . . 25 LYS HD2 . 10086 1 230 . 1 1 25 25 LYS HD3 H 1 1.523 0.030 . 1 . . . . 25 LYS HD3 . 10086 1 231 . 1 1 25 25 LYS HE2 H 1 2.838 0.030 . 1 . . . . 25 LYS HE2 . 10086 1 232 . 1 1 25 25 LYS HE3 H 1 2.838 0.030 . 1 . . . . 25 LYS HE3 . 10086 1 233 . 1 1 25 25 LYS CA C 13 57.418 0.300 . 1 . . . . 25 LYS CA . 10086 1 234 . 1 1 25 25 LYS CB C 13 32.166 0.300 . 1 . . . . 25 LYS CB . 10086 1 235 . 1 1 25 25 LYS CG C 13 24.994 0.300 . 1 . . . . 25 LYS CG . 10086 1 236 . 1 1 25 25 LYS CD C 13 29.188 0.300 . 1 . . . . 25 LYS CD . 10086 1 237 . 1 1 25 25 LYS CE C 13 41.883 0.300 . 1 . . . . 25 LYS CE . 10086 1 238 . 1 1 25 25 LYS N N 15 128.739 0.300 . 1 . . . . 25 LYS N . 10086 1 239 . 1 1 26 26 ALA H H 1 8.570 0.030 . 1 . . . . 26 ALA H . 10086 1 240 . 1 1 26 26 ALA HA H 1 4.610 0.030 . 1 . . . . 26 ALA HA . 10086 1 241 . 1 1 26 26 ALA HB1 H 1 1.177 0.030 . 1 . . . . 26 ALA HB . 10086 1 242 . 1 1 26 26 ALA HB2 H 1 1.177 0.030 . 1 . . . . 26 ALA HB . 10086 1 243 . 1 1 26 26 ALA HB3 H 1 1.177 0.030 . 1 . . . . 26 ALA HB . 10086 1 244 . 1 1 26 26 ALA C C 13 174.668 0.300 . 1 . . . . 26 ALA C . 10086 1 245 . 1 1 26 26 ALA CA C 13 50.630 0.300 . 1 . . . . 26 ALA CA . 10086 1 246 . 1 1 26 26 ALA CB C 13 22.609 0.300 . 1 . . . . 26 ALA CB . 10086 1 247 . 1 1 26 26 ALA N N 15 128.842 0.300 . 1 . . . . 26 ALA N . 10086 1 248 . 1 1 27 27 LYS H H 1 8.678 0.030 . 1 . . . . 27 LYS H . 10086 1 249 . 1 1 27 27 LYS HA H 1 4.819 0.030 . 1 . . . . 27 LYS HA . 10086 1 250 . 1 1 27 27 LYS HB2 H 1 1.964 0.030 . 2 . . . . 27 LYS HB2 . 10086 1 251 . 1 1 27 27 LYS HB3 H 1 1.697 0.030 . 2 . . . . 27 LYS HB3 . 10086 1 252 . 1 1 27 27 LYS HG2 H 1 1.389 0.030 . 1 . . . . 27 LYS HG2 . 10086 1 253 . 1 1 27 27 LYS HG3 H 1 1.389 0.030 . 1 . . . . 27 LYS HG3 . 10086 1 254 . 1 1 27 27 LYS HD2 H 1 1.637 0.030 . 2 . . . . 27 LYS HD2 . 10086 1 255 . 1 1 27 27 LYS HD3 H 1 1.566 0.030 . 2 . . . . 27 LYS HD3 . 10086 1 256 . 1 1 27 27 LYS HE2 H 1 2.911 0.030 . 1 . . . . 27 LYS HE2 . 10086 1 257 . 1 1 27 27 LYS HE3 H 1 2.911 0.030 . 1 . . . . 27 LYS HE3 . 10086 1 258 . 1 1 27 27 LYS C C 13 178.383 0.300 . 1 . . . . 27 LYS C . 10086 1 259 . 1 1 27 27 LYS CA C 13 54.474 0.300 . 1 . . . . 27 LYS CA . 10086 1 260 . 1 1 27 27 LYS CB C 13 36.288 0.300 . 1 . . . . 27 LYS CB . 10086 1 261 . 1 1 27 27 LYS CG C 13 25.138 0.300 . 1 . . . . 27 LYS CG . 10086 1 262 . 1 1 27 27 LYS CD C 13 29.362 0.300 . 1 . . . . 27 LYS CD . 10086 1 263 . 1 1 27 27 LYS CE C 13 42.169 0.300 . 1 . . . . 27 LYS CE . 10086 1 264 . 1 1 27 27 LYS N N 15 117.074 0.300 . 1 . . . . 27 LYS N . 10086 1 265 . 1 1 28 28 VAL H H 1 8.885 0.030 . 1 . . . . 28 VAL H . 10086 1 266 . 1 1 28 28 VAL HA H 1 3.804 0.030 . 1 . . . . 28 VAL HA . 10086 1 267 . 1 1 28 28 VAL HB H 1 2.200 0.030 . 1 . . . . 28 VAL HB . 10086 1 268 . 1 1 28 28 VAL HG11 H 1 1.015 0.030 . 1 . . . . 28 VAL HG1 . 10086 1 269 . 1 1 28 28 VAL HG12 H 1 1.015 0.030 . 1 . . . . 28 VAL HG1 . 10086 1 270 . 1 1 28 28 VAL HG13 H 1 1.015 0.030 . 1 . . . . 28 VAL HG1 . 10086 1 271 . 1 1 28 28 VAL HG21 H 1 1.024 0.030 . 1 . . . . 28 VAL HG2 . 10086 1 272 . 1 1 28 28 VAL HG22 H 1 1.024 0.030 . 1 . . . . 28 VAL HG2 . 10086 1 273 . 1 1 28 28 VAL HG23 H 1 1.024 0.030 . 1 . . . . 28 VAL HG2 . 10086 1 274 . 1 1 28 28 VAL C C 13 176.462 0.300 . 1 . . . . 28 VAL C . 10086 1 275 . 1 1 28 28 VAL CA C 13 65.748 0.300 . 1 . . . . 28 VAL CA . 10086 1 276 . 1 1 28 28 VAL CB C 13 31.375 0.300 . 1 . . . . 28 VAL CB . 10086 1 277 . 1 1 28 28 VAL CG1 C 13 21.388 0.300 . 2 . . . . 28 VAL CG1 . 10086 1 278 . 1 1 28 28 VAL CG2 C 13 20.653 0.300 . 2 . . . . 28 VAL CG2 . 10086 1 279 . 1 1 29 29 SER H H 1 7.235 0.030 . 1 . . . . 29 SER H . 10086 1 280 . 1 1 29 29 SER HA H 1 4.474 0.030 . 1 . . . . 29 SER HA . 10086 1 281 . 1 1 29 29 SER HB2 H 1 4.191 0.030 . 2 . . . . 29 SER HB2 . 10086 1 282 . 1 1 29 29 SER HB3 H 1 3.727 0.030 . 2 . . . . 29 SER HB3 . 10086 1 283 . 1 1 29 29 SER C C 13 175.107 0.300 . 1 . . . . 29 SER C . 10086 1 284 . 1 1 29 29 SER CA C 13 56.985 0.300 . 1 . . . . 29 SER CA . 10086 1 285 . 1 1 29 29 SER CB C 13 63.670 0.300 . 1 . . . . 29 SER CB . 10086 1 286 . 1 1 29 29 SER N N 15 109.525 0.300 . 1 . . . . 29 SER N . 10086 1 287 . 1 1 30 30 SER H H 1 7.922 0.030 . 1 . . . . 30 SER H . 10086 1 288 . 1 1 30 30 SER HA H 1 4.556 0.030 . 1 . . . . 30 SER HA . 10086 1 289 . 1 1 30 30 SER HB2 H 1 3.850 0.030 . 1 . . . . 30 SER HB2 . 10086 1 290 . 1 1 30 30 SER HB3 H 1 3.850 0.030 . 1 . . . . 30 SER HB3 . 10086 1 291 . 1 1 30 30 SER CA C 13 61.755 0.300 . 1 . . . . 30 SER CA . 10086 1 292 . 1 1 30 30 SER CB C 13 63.765 0.300 . 1 . . . . 30 SER CB . 10086 1 293 . 1 1 30 30 SER N N 15 120.399 0.300 . 1 . . . . 30 SER N . 10086 1 294 . 1 1 31 31 ILE H H 1 8.207 0.030 . 1 . . . . 31 ILE H . 10086 1 295 . 1 1 31 31 ILE HA H 1 5.328 0.030 . 1 . . . . 31 ILE HA . 10086 1 296 . 1 1 31 31 ILE HB H 1 2.414 0.030 . 1 . . . . 31 ILE HB . 10086 1 297 . 1 1 31 31 ILE HG12 H 1 1.429 0.030 . 2 . . . . 31 ILE HG12 . 10086 1 298 . 1 1 31 31 ILE HG13 H 1 1.387 0.030 . 2 . . . . 31 ILE HG13 . 10086 1 299 . 1 1 31 31 ILE HG21 H 1 0.939 0.030 . 1 . . . . 31 ILE HG2 . 10086 1 300 . 1 1 31 31 ILE HG22 H 1 0.939 0.030 . 1 . . . . 31 ILE HG2 . 10086 1 301 . 1 1 31 31 ILE HG23 H 1 0.939 0.030 . 1 . . . . 31 ILE HG2 . 10086 1 302 . 1 1 31 31 ILE HD11 H 1 1.093 0.030 . 1 . . . . 31 ILE HD1 . 10086 1 303 . 1 1 31 31 ILE HD12 H 1 1.093 0.030 . 1 . . . . 31 ILE HD1 . 10086 1 304 . 1 1 31 31 ILE HD13 H 1 1.093 0.030 . 1 . . . . 31 ILE HD1 . 10086 1 305 . 1 1 31 31 ILE C C 13 178.195 0.300 . 1 . . . . 31 ILE C . 10086 1 306 . 1 1 31 31 ILE CA C 13 59.436 0.300 . 1 . . . . 31 ILE CA . 10086 1 307 . 1 1 31 31 ILE CB C 13 40.079 0.300 . 1 . . . . 31 ILE CB . 10086 1 308 . 1 1 31 31 ILE CG1 C 13 26.381 0.300 . 1 . . . . 31 ILE CG1 . 10086 1 309 . 1 1 31 31 ILE CG2 C 13 17.821 0.300 . 1 . . . . 31 ILE CG2 . 10086 1 310 . 1 1 31 31 ILE CD1 C 13 13.601 0.300 . 1 . . . . 31 ILE CD1 . 10086 1 311 . 1 1 31 31 ILE N N 15 116.909 0.300 . 1 . . . . 31 ILE N . 10086 1 312 . 1 1 32 32 ALA H H 1 8.881 0.030 . 1 . . . . 32 ALA H . 10086 1 313 . 1 1 32 32 ALA HA H 1 3.677 0.030 . 1 . . . . 32 ALA HA . 10086 1 314 . 1 1 32 32 ALA HB1 H 1 1.497 0.030 . 1 . . . . 32 ALA HB . 10086 1 315 . 1 1 32 32 ALA HB2 H 1 1.497 0.030 . 1 . . . . 32 ALA HB . 10086 1 316 . 1 1 32 32 ALA HB3 H 1 1.497 0.030 . 1 . . . . 32 ALA HB . 10086 1 317 . 1 1 32 32 ALA C C 13 179.524 0.300 . 1 . . . . 32 ALA C . 10086 1 318 . 1 1 32 32 ALA CA C 13 56.226 0.300 . 1 . . . . 32 ALA CA . 10086 1 319 . 1 1 32 32 ALA CB C 13 18.483 0.300 . 1 . . . . 32 ALA CB . 10086 1 320 . 1 1 32 32 ALA N N 15 126.158 0.300 . 1 . . . . 32 ALA N . 10086 1 321 . 1 1 33 33 GLN H H 1 9.347 0.030 . 1 . . . . 33 GLN H . 10086 1 322 . 1 1 33 33 GLN HA H 1 3.990 0.030 . 1 . . . . 33 GLN HA . 10086 1 323 . 1 1 33 33 GLN HB2 H 1 2.254 0.030 . 2 . . . . 33 GLN HB2 . 10086 1 324 . 1 1 33 33 GLN HB3 H 1 1.943 0.030 . 2 . . . . 33 GLN HB3 . 10086 1 325 . 1 1 33 33 GLN HG2 H 1 2.475 0.030 . 2 . . . . 33 GLN HG2 . 10086 1 326 . 1 1 33 33 GLN HG3 H 1 2.394 0.030 . 2 . . . . 33 GLN HG3 . 10086 1 327 . 1 1 33 33 GLN HE21 H 1 7.860 0.030 . 2 . . . . 33 GLN HE21 . 10086 1 328 . 1 1 33 33 GLN HE22 H 1 6.917 0.030 . 2 . . . . 33 GLN HE22 . 10086 1 329 . 1 1 33 33 GLN C C 13 178.176 0.300 . 1 . . . . 33 GLN C . 10086 1 330 . 1 1 33 33 GLN CA C 13 59.265 0.300 . 1 . . . . 33 GLN CA . 10086 1 331 . 1 1 33 33 GLN CB C 13 29.053 0.300 . 1 . . . . 33 GLN CB . 10086 1 332 . 1 1 33 33 GLN CG C 13 33.291 0.300 . 1 . . . . 33 GLN CG . 10086 1 333 . 1 1 33 33 GLN N N 15 115.801 0.300 . 1 . . . . 33 GLN N . 10086 1 334 . 1 1 33 33 GLN NE2 N 15 113.108 0.300 . 1 . . . . 33 GLN NE2 . 10086 1 335 . 1 1 34 34 GLU H H 1 7.209 0.030 . 1 . . . . 34 GLU H . 10086 1 336 . 1 1 34 34 GLU HA H 1 4.069 0.030 . 1 . . . . 34 GLU HA . 10086 1 337 . 1 1 34 34 GLU HB2 H 1 2.484 0.030 . 2 . . . . 34 GLU HB2 . 10086 1 338 . 1 1 34 34 GLU HB3 H 1 2.145 0.030 . 2 . . . . 34 GLU HB3 . 10086 1 339 . 1 1 34 34 GLU HG2 H 1 2.383 0.030 . 2 . . . . 34 GLU HG2 . 10086 1 340 . 1 1 34 34 GLU HG3 H 1 2.341 0.030 . 2 . . . . 34 GLU HG3 . 10086 1 341 . 1 1 34 34 GLU C C 13 179.267 0.300 . 1 . . . . 34 GLU C . 10086 1 342 . 1 1 34 34 GLU CA C 13 58.596 0.300 . 1 . . . . 34 GLU CA . 10086 1 343 . 1 1 34 34 GLU CB C 13 30.044 0.300 . 1 . . . . 34 GLU CB . 10086 1 344 . 1 1 34 34 GLU CG C 13 36.912 0.300 . 1 . . . . 34 GLU CG . 10086 1 345 . 1 1 34 34 GLU N N 15 116.139 0.300 . 1 . . . . 34 GLU N . 10086 1 346 . 1 1 35 35 ILE H H 1 7.391 0.030 . 1 . . . . 35 ILE H . 10086 1 347 . 1 1 35 35 ILE HA H 1 3.901 0.030 . 1 . . . . 35 ILE HA . 10086 1 348 . 1 1 35 35 ILE HB H 1 2.112 0.030 . 1 . . . . 35 ILE HB . 10086 1 349 . 1 1 35 35 ILE HG12 H 1 1.643 0.030 . 2 . . . . 35 ILE HG12 . 10086 1 350 . 1 1 35 35 ILE HG13 H 1 1.320 0.030 . 2 . . . . 35 ILE HG13 . 10086 1 351 . 1 1 35 35 ILE HG21 H 1 0.836 0.030 . 1 . . . . 35 ILE HG2 . 10086 1 352 . 1 1 35 35 ILE HG22 H 1 0.836 0.030 . 1 . . . . 35 ILE HG2 . 10086 1 353 . 1 1 35 35 ILE HG23 H 1 0.836 0.030 . 1 . . . . 35 ILE HG2 . 10086 1 354 . 1 1 35 35 ILE HD11 H 1 0.752 0.030 . 1 . . . . 35 ILE HD1 . 10086 1 355 . 1 1 35 35 ILE HD12 H 1 0.752 0.030 . 1 . . . . 35 ILE HD1 . 10086 1 356 . 1 1 35 35 ILE HD13 H 1 0.752 0.030 . 1 . . . . 35 ILE HD1 . 10086 1 357 . 1 1 35 35 ILE C C 13 178.155 0.300 . 1 . . . . 35 ILE C . 10086 1 358 . 1 1 35 35 ILE CA C 13 62.016 0.300 . 1 . . . . 35 ILE CA . 10086 1 359 . 1 1 35 35 ILE CB C 13 36.232 0.300 . 1 . . . . 35 ILE CB . 10086 1 360 . 1 1 35 35 ILE CG1 C 13 28.559 0.300 . 1 . . . . 35 ILE CG1 . 10086 1 361 . 1 1 35 35 ILE CG2 C 13 18.392 0.300 . 1 . . . . 35 ILE CG2 . 10086 1 362 . 1 1 35 35 ILE CD1 C 13 9.925 0.300 . 1 . . . . 35 ILE CD1 . 10086 1 363 . 1 1 35 35 ILE N N 15 119.695 0.300 . 1 . . . . 35 ILE N . 10086 1 364 . 1 1 36 36 LEU H H 1 8.924 0.030 . 1 . . . . 36 LEU H . 10086 1 365 . 1 1 36 36 LEU HA H 1 3.878 0.030 . 1 . . . . 36 LEU HA . 10086 1 366 . 1 1 36 36 LEU HB2 H 1 1.759 0.030 . 2 . . . . 36 LEU HB2 . 10086 1 367 . 1 1 36 36 LEU HB3 H 1 1.656 0.030 . 2 . . . . 36 LEU HB3 . 10086 1 368 . 1 1 36 36 LEU HG H 1 1.583 0.030 . 1 . . . . 36 LEU HG . 10086 1 369 . 1 1 36 36 LEU HD11 H 1 0.915 0.030 . 1 . . . . 36 LEU HD1 . 10086 1 370 . 1 1 36 36 LEU HD12 H 1 0.915 0.030 . 1 . . . . 36 LEU HD1 . 10086 1 371 . 1 1 36 36 LEU HD13 H 1 0.915 0.030 . 1 . . . . 36 LEU HD1 . 10086 1 372 . 1 1 36 36 LEU HD21 H 1 0.899 0.030 . 1 . . . . 36 LEU HD2 . 10086 1 373 . 1 1 36 36 LEU HD22 H 1 0.899 0.030 . 1 . . . . 36 LEU HD2 . 10086 1 374 . 1 1 36 36 LEU HD23 H 1 0.899 0.030 . 1 . . . . 36 LEU HD2 . 10086 1 375 . 1 1 36 36 LEU C C 13 177.619 0.300 . 1 . . . . 36 LEU C . 10086 1 376 . 1 1 36 36 LEU CA C 13 58.065 0.300 . 1 . . . . 36 LEU CA . 10086 1 377 . 1 1 36 36 LEU CB C 13 42.193 0.300 . 1 . . . . 36 LEU CB . 10086 1 378 . 1 1 36 36 LEU CG C 13 27.048 0.300 . 1 . . . . 36 LEU CG . 10086 1 379 . 1 1 36 36 LEU CD1 C 13 25.490 0.300 . 2 . . . . 36 LEU CD1 . 10086 1 380 . 1 1 36 36 LEU CD2 C 13 24.306 0.300 . 2 . . . . 36 LEU CD2 . 10086 1 381 . 1 1 36 36 LEU N N 15 120.699 0.300 . 1 . . . . 36 LEU N . 10086 1 382 . 1 1 37 37 LYS H H 1 7.553 0.030 . 1 . . . . 37 LYS H . 10086 1 383 . 1 1 37 37 LYS HA H 1 3.883 0.030 . 1 . . . . 37 LYS HA . 10086 1 384 . 1 1 37 37 LYS HB2 H 1 2.037 0.030 . 2 . . . . 37 LYS HB2 . 10086 1 385 . 1 1 37 37 LYS HB3 H 1 1.920 0.030 . 2 . . . . 37 LYS HB3 . 10086 1 386 . 1 1 37 37 LYS HG2 H 1 1.648 0.030 . 2 . . . . 37 LYS HG2 . 10086 1 387 . 1 1 37 37 LYS HG3 H 1 1.470 0.030 . 2 . . . . 37 LYS HG3 . 10086 1 388 . 1 1 37 37 LYS HD2 H 1 1.767 0.030 . 1 . . . . 37 LYS HD2 . 10086 1 389 . 1 1 37 37 LYS HD3 H 1 1.767 0.030 . 1 . . . . 37 LYS HD3 . 10086 1 390 . 1 1 37 37 LYS HE2 H 1 3.053 0.030 . 1 . . . . 37 LYS HE2 . 10086 1 391 . 1 1 37 37 LYS HE3 H 1 3.053 0.030 . 1 . . . . 37 LYS HE3 . 10086 1 392 . 1 1 37 37 LYS C C 13 178.876 0.300 . 1 . . . . 37 LYS C . 10086 1 393 . 1 1 37 37 LYS CA C 13 60.375 0.300 . 1 . . . . 37 LYS CA . 10086 1 394 . 1 1 37 37 LYS CB C 13 32.564 0.300 . 1 . . . . 37 LYS CB . 10086 1 395 . 1 1 37 37 LYS CG C 13 24.755 0.300 . 1 . . . . 37 LYS CG . 10086 1 396 . 1 1 37 37 LYS CD C 13 29.361 0.300 . 1 . . . . 37 LYS CD . 10086 1 397 . 1 1 37 37 LYS CE C 13 41.927 0.300 . 1 . . . . 37 LYS CE . 10086 1 398 . 1 1 37 37 LYS N N 15 117.749 0.300 . 1 . . . . 37 LYS N . 10086 1 399 . 1 1 38 38 VAL H H 1 7.050 0.030 . 1 . . . . 38 VAL H . 10086 1 400 . 1 1 38 38 VAL HA H 1 3.912 0.030 . 1 . . . . 38 VAL HA . 10086 1 401 . 1 1 38 38 VAL HB H 1 2.267 0.030 . 1 . . . . 38 VAL HB . 10086 1 402 . 1 1 38 38 VAL HG11 H 1 1.110 0.030 . 1 . . . . 38 VAL HG1 . 10086 1 403 . 1 1 38 38 VAL HG12 H 1 1.110 0.030 . 1 . . . . 38 VAL HG1 . 10086 1 404 . 1 1 38 38 VAL HG13 H 1 1.110 0.030 . 1 . . . . 38 VAL HG1 . 10086 1 405 . 1 1 38 38 VAL HG21 H 1 1.195 0.030 . 1 . . . . 38 VAL HG2 . 10086 1 406 . 1 1 38 38 VAL HG22 H 1 1.195 0.030 . 1 . . . . 38 VAL HG2 . 10086 1 407 . 1 1 38 38 VAL HG23 H 1 1.195 0.030 . 1 . . . . 38 VAL HG2 . 10086 1 408 . 1 1 38 38 VAL C C 13 178.804 0.300 . 1 . . . . 38 VAL C . 10086 1 409 . 1 1 38 38 VAL CA C 13 65.740 0.300 . 1 . . . . 38 VAL CA . 10086 1 410 . 1 1 38 38 VAL CB C 13 31.999 0.300 . 1 . . . . 38 VAL CB . 10086 1 411 . 1 1 38 38 VAL CG1 C 13 22.346 0.300 . 2 . . . . 38 VAL CG1 . 10086 1 412 . 1 1 38 38 VAL CG2 C 13 21.789 0.300 . 2 . . . . 38 VAL CG2 . 10086 1 413 . 1 1 38 38 VAL N N 15 117.773 0.300 . 1 . . . . 38 VAL N . 10086 1 414 . 1 1 39 39 VAL H H 1 8.294 0.030 . 1 . . . . 39 VAL H . 10086 1 415 . 1 1 39 39 VAL HA H 1 3.312 0.030 . 1 . . . . 39 VAL HA . 10086 1 416 . 1 1 39 39 VAL HB H 1 2.172 0.030 . 1 . . . . 39 VAL HB . 10086 1 417 . 1 1 39 39 VAL HG11 H 1 0.970 0.030 . 1 . . . . 39 VAL HG1 . 10086 1 418 . 1 1 39 39 VAL HG12 H 1 0.970 0.030 . 1 . . . . 39 VAL HG1 . 10086 1 419 . 1 1 39 39 VAL HG13 H 1 0.970 0.030 . 1 . . . . 39 VAL HG1 . 10086 1 420 . 1 1 39 39 VAL HG21 H 1 0.809 0.030 . 1 . . . . 39 VAL HG2 . 10086 1 421 . 1 1 39 39 VAL HG22 H 1 0.809 0.030 . 1 . . . . 39 VAL HG2 . 10086 1 422 . 1 1 39 39 VAL HG23 H 1 0.809 0.030 . 1 . . . . 39 VAL HG2 . 10086 1 423 . 1 1 39 39 VAL C C 13 176.868 0.300 . 1 . . . . 39 VAL C . 10086 1 424 . 1 1 39 39 VAL CA C 13 67.367 0.300 . 1 . . . . 39 VAL CA . 10086 1 425 . 1 1 39 39 VAL CB C 13 31.761 0.300 . 1 . . . . 39 VAL CB . 10086 1 426 . 1 1 39 39 VAL CG1 C 13 23.942 0.300 . 2 . . . . 39 VAL CG1 . 10086 1 427 . 1 1 39 39 VAL CG2 C 13 21.451 0.300 . 2 . . . . 39 VAL CG2 . 10086 1 428 . 1 1 39 39 VAL N N 15 120.331 0.300 . 1 . . . . 39 VAL N . 10086 1 429 . 1 1 40 40 ALA H H 1 8.932 0.030 . 1 . . . . 40 ALA H . 10086 1 430 . 1 1 40 40 ALA HA H 1 3.861 0.030 . 1 . . . . 40 ALA HA . 10086 1 431 . 1 1 40 40 ALA HB1 H 1 1.627 0.030 . 1 . . . . 40 ALA HB . 10086 1 432 . 1 1 40 40 ALA HB2 H 1 1.627 0.030 . 1 . . . . 40 ALA HB . 10086 1 433 . 1 1 40 40 ALA HB3 H 1 1.627 0.030 . 1 . . . . 40 ALA HB . 10086 1 434 . 1 1 40 40 ALA C C 13 179.545 0.300 . 1 . . . . 40 ALA C . 10086 1 435 . 1 1 40 40 ALA CA C 13 55.876 0.300 . 1 . . . . 40 ALA CA . 10086 1 436 . 1 1 40 40 ALA CB C 13 18.239 0.300 . 1 . . . . 40 ALA CB . 10086 1 437 . 1 1 40 40 ALA N N 15 120.380 0.300 . 1 . . . . 40 ALA N . 10086 1 438 . 1 1 41 41 GLU H H 1 7.320 0.030 . 1 . . . . 41 GLU H . 10086 1 439 . 1 1 41 41 GLU HA H 1 4.135 0.030 . 1 . . . . 41 GLU HA . 10086 1 440 . 1 1 41 41 GLU HB2 H 1 2.254 0.030 . 1 . . . . 41 GLU HB2 . 10086 1 441 . 1 1 41 41 GLU HB3 H 1 2.254 0.030 . 1 . . . . 41 GLU HB3 . 10086 1 442 . 1 1 41 41 GLU HG2 H 1 2.529 0.030 . 2 . . . . 41 GLU HG2 . 10086 1 443 . 1 1 41 41 GLU HG3 H 1 2.286 0.030 . 2 . . . . 41 GLU HG3 . 10086 1 444 . 1 1 41 41 GLU C C 13 179.515 0.300 . 1 . . . . 41 GLU C . 10086 1 445 . 1 1 41 41 GLU CA C 13 58.976 0.300 . 1 . . . . 41 GLU CA . 10086 1 446 . 1 1 41 41 GLU CB C 13 29.716 0.300 . 1 . . . . 41 GLU CB . 10086 1 447 . 1 1 41 41 GLU CG C 13 36.319 0.300 . 1 . . . . 41 GLU CG . 10086 1 448 . 1 1 41 41 GLU N N 15 115.788 0.300 . 1 . . . . 41 GLU N . 10086 1 449 . 1 1 42 42 LYS H H 1 8.021 0.030 . 1 . . . . 42 LYS H . 10086 1 450 . 1 1 42 42 LYS HA H 1 4.205 0.030 . 1 . . . . 42 LYS HA . 10086 1 451 . 1 1 42 42 LYS HB2 H 1 2.056 0.030 . 2 . . . . 42 LYS HB2 . 10086 1 452 . 1 1 42 42 LYS HB3 H 1 1.937 0.030 . 2 . . . . 42 LYS HB3 . 10086 1 453 . 1 1 42 42 LYS HG2 H 1 1.619 0.030 . 1 . . . . 42 LYS HG2 . 10086 1 454 . 1 1 42 42 LYS HG3 H 1 1.619 0.030 . 1 . . . . 42 LYS HG3 . 10086 1 455 . 1 1 42 42 LYS HD2 H 1 1.675 0.030 . 2 . . . . 42 LYS HD2 . 10086 1 456 . 1 1 42 42 LYS HD3 H 1 1.630 0.030 . 2 . . . . 42 LYS HD3 . 10086 1 457 . 1 1 42 42 LYS HE2 H 1 3.073 0.030 . 2 . . . . 42 LYS HE2 . 10086 1 458 . 1 1 42 42 LYS HE3 H 1 2.972 0.030 . 2 . . . . 42 LYS HE3 . 10086 1 459 . 1 1 42 42 LYS C C 13 179.030 0.300 . 1 . . . . 42 LYS C . 10086 1 460 . 1 1 42 42 LYS CA C 13 58.717 0.300 . 1 . . . . 42 LYS CA . 10086 1 461 . 1 1 42 42 LYS CB C 13 32.574 0.300 . 1 . . . . 42 LYS CB . 10086 1 462 . 1 1 42 42 LYS CG C 13 25.248 0.300 . 1 . . . . 42 LYS CG . 10086 1 463 . 1 1 42 42 LYS CD C 13 28.816 0.300 . 1 . . . . 42 LYS CD . 10086 1 464 . 1 1 42 42 LYS CE C 13 42.163 0.300 . 1 . . . . 42 LYS CE . 10086 1 465 . 1 1 42 42 LYS N N 15 118.788 0.300 . 1 . . . . 42 LYS N . 10086 1 466 . 1 1 43 43 ILE H H 1 8.268 0.030 . 1 . . . . 43 ILE H . 10086 1 467 . 1 1 43 43 ILE HA H 1 4.514 0.030 . 1 . . . . 43 ILE HA . 10086 1 468 . 1 1 43 43 ILE HB H 1 2.111 0.030 . 1 . . . . 43 ILE HB . 10086 1 469 . 1 1 43 43 ILE HG12 H 1 1.556 0.030 . 2 . . . . 43 ILE HG12 . 10086 1 470 . 1 1 43 43 ILE HG13 H 1 1.311 0.030 . 2 . . . . 43 ILE HG13 . 10086 1 471 . 1 1 43 43 ILE HG21 H 1 0.752 0.030 . 1 . . . . 43 ILE HG2 . 10086 1 472 . 1 1 43 43 ILE HG22 H 1 0.752 0.030 . 1 . . . . 43 ILE HG2 . 10086 1 473 . 1 1 43 43 ILE HG23 H 1 0.752 0.030 . 1 . . . . 43 ILE HG2 . 10086 1 474 . 1 1 43 43 ILE HD11 H 1 0.459 0.030 . 1 . . . . 43 ILE HD1 . 10086 1 475 . 1 1 43 43 ILE HD12 H 1 0.459 0.030 . 1 . . . . 43 ILE HD1 . 10086 1 476 . 1 1 43 43 ILE HD13 H 1 0.459 0.030 . 1 . . . . 43 ILE HD1 . 10086 1 477 . 1 1 43 43 ILE C C 13 174.799 0.300 . 1 . . . . 43 ILE C . 10086 1 478 . 1 1 43 43 ILE CA C 13 61.256 0.300 . 1 . . . . 43 ILE CA . 10086 1 479 . 1 1 43 43 ILE CB C 13 38.253 0.300 . 1 . . . . 43 ILE CB . 10086 1 480 . 1 1 43 43 ILE CG1 C 13 25.324 0.300 . 1 . . . . 43 ILE CG1 . 10086 1 481 . 1 1 43 43 ILE CG2 C 13 17.075 0.300 . 1 . . . . 43 ILE CG2 . 10086 1 482 . 1 1 43 43 ILE CD1 C 13 14.158 0.300 . 1 . . . . 43 ILE CD1 . 10086 1 483 . 1 1 43 43 ILE N N 15 110.174 0.300 . 1 . . . . 43 ILE N . 10086 1 484 . 1 1 44 44 GLN H H 1 7.822 0.030 . 1 . . . . 44 GLN H . 10086 1 485 . 1 1 44 44 GLN HA H 1 3.904 0.030 . 1 . . . . 44 GLN HA . 10086 1 486 . 1 1 44 44 GLN HB2 H 1 2.342 0.030 . 2 . . . . 44 GLN HB2 . 10086 1 487 . 1 1 44 44 GLN HB3 H 1 2.131 0.030 . 2 . . . . 44 GLN HB3 . 10086 1 488 . 1 1 44 44 GLN HG2 H 1 2.285 0.030 . 2 . . . . 44 GLN HG2 . 10086 1 489 . 1 1 44 44 GLN HG3 H 1 2.223 0.030 . 2 . . . . 44 GLN HG3 . 10086 1 490 . 1 1 44 44 GLN HE21 H 1 7.705 0.030 . 2 . . . . 44 GLN HE21 . 10086 1 491 . 1 1 44 44 GLN HE22 H 1 6.824 0.030 . 2 . . . . 44 GLN HE22 . 10086 1 492 . 1 1 44 44 GLN C C 13 174.345 0.300 . 1 . . . . 44 GLN C . 10086 1 493 . 1 1 44 44 GLN CA C 13 56.940 0.300 . 1 . . . . 44 GLN CA . 10086 1 494 . 1 1 44 44 GLN CB C 13 25.795 0.300 . 1 . . . . 44 GLN CB . 10086 1 495 . 1 1 44 44 GLN CG C 13 34.421 0.300 . 1 . . . . 44 GLN CG . 10086 1 496 . 1 1 44 44 GLN N N 15 117.622 0.300 . 1 . . . . 44 GLN N . 10086 1 497 . 1 1 44 44 GLN NE2 N 15 113.138 0.300 . 1 . . . . 44 GLN NE2 . 10086 1 498 . 1 1 45 45 TYR H H 1 8.127 0.030 . 1 . . . . 45 TYR H . 10086 1 499 . 1 1 45 45 TYR HA H 1 4.633 0.030 . 1 . . . . 45 TYR HA . 10086 1 500 . 1 1 45 45 TYR HB2 H 1 2.927 0.030 . 2 . . . . 45 TYR HB2 . 10086 1 501 . 1 1 45 45 TYR HB3 H 1 2.676 0.030 . 2 . . . . 45 TYR HB3 . 10086 1 502 . 1 1 45 45 TYR HD1 H 1 7.267 0.030 . 1 . . . . 45 TYR HD1 . 10086 1 503 . 1 1 45 45 TYR HD2 H 1 7.267 0.030 . 1 . . . . 45 TYR HD2 . 10086 1 504 . 1 1 45 45 TYR HE1 H 1 6.912 0.030 . 1 . . . . 45 TYR HE1 . 10086 1 505 . 1 1 45 45 TYR HE2 H 1 6.912 0.030 . 1 . . . . 45 TYR HE2 . 10086 1 506 . 1 1 45 45 TYR C C 13 174.387 0.300 . 1 . . . . 45 TYR C . 10086 1 507 . 1 1 45 45 TYR CA C 13 57.046 0.300 . 1 . . . . 45 TYR CA . 10086 1 508 . 1 1 45 45 TYR CB C 13 43.967 0.300 . 1 . . . . 45 TYR CB . 10086 1 509 . 1 1 45 45 TYR CD1 C 13 133.435 0.300 . 1 . . . . 45 TYR CD1 . 10086 1 510 . 1 1 45 45 TYR CD2 C 13 133.435 0.300 . 1 . . . . 45 TYR CD2 . 10086 1 511 . 1 1 45 45 TYR CE1 C 13 118.175 0.300 . 1 . . . . 45 TYR CE1 . 10086 1 512 . 1 1 45 45 TYR CE2 C 13 118.175 0.300 . 1 . . . . 45 TYR CE2 . 10086 1 513 . 1 1 45 45 TYR N N 15 120.695 0.300 . 1 . . . . 45 TYR N . 10086 1 514 . 1 1 46 46 ALA H H 1 8.369 0.030 . 1 . . . . 46 ALA H . 10086 1 515 . 1 1 46 46 ALA HA H 1 4.253 0.030 . 1 . . . . 46 ALA HA . 10086 1 516 . 1 1 46 46 ALA HB1 H 1 1.404 0.030 . 1 . . . . 46 ALA HB . 10086 1 517 . 1 1 46 46 ALA HB2 H 1 1.404 0.030 . 1 . . . . 46 ALA HB . 10086 1 518 . 1 1 46 46 ALA HB3 H 1 1.404 0.030 . 1 . . . . 46 ALA HB . 10086 1 519 . 1 1 46 46 ALA C C 13 178.856 0.300 . 1 . . . . 46 ALA C . 10086 1 520 . 1 1 46 46 ALA CA C 13 52.508 0.300 . 1 . . . . 46 ALA CA . 10086 1 521 . 1 1 46 46 ALA CB C 13 18.563 0.300 . 1 . . . . 46 ALA CB . 10086 1 522 . 1 1 46 46 ALA N N 15 124.652 0.300 . 1 . . . . 46 ALA N . 10086 1 523 . 1 1 47 47 GLU H H 1 8.809 0.030 . 1 . . . . 47 GLU H . 10086 1 524 . 1 1 47 47 GLU HA H 1 3.704 0.030 . 1 . . . . 47 GLU HA . 10086 1 525 . 1 1 47 47 GLU HB2 H 1 2.024 0.030 . 2 . . . . 47 GLU HB2 . 10086 1 526 . 1 1 47 47 GLU HB3 H 1 1.969 0.030 . 2 . . . . 47 GLU HB3 . 10086 1 527 . 1 1 47 47 GLU HG2 H 1 2.148 0.030 . 1 . . . . 47 GLU HG2 . 10086 1 528 . 1 1 47 47 GLU HG3 H 1 2.148 0.030 . 1 . . . . 47 GLU HG3 . 10086 1 529 . 1 1 47 47 GLU C C 13 178.215 0.300 . 1 . . . . 47 GLU C . 10086 1 530 . 1 1 47 47 GLU CA C 13 59.956 0.300 . 1 . . . . 47 GLU CA . 10086 1 531 . 1 1 47 47 GLU CB C 13 30.174 0.300 . 1 . . . . 47 GLU CB . 10086 1 532 . 1 1 47 47 GLU CG C 13 36.149 0.300 . 1 . . . . 47 GLU CG . 10086 1 533 . 1 1 48 48 GLU H H 1 9.182 0.030 . 1 . . . . 48 GLU H . 10086 1 534 . 1 1 48 48 GLU HA H 1 4.228 0.030 . 1 . . . . 48 GLU HA . 10086 1 535 . 1 1 48 48 GLU HB2 H 1 2.064 0.030 . 1 . . . . 48 GLU HB2 . 10086 1 536 . 1 1 48 48 GLU HB3 H 1 2.064 0.030 . 1 . . . . 48 GLU HB3 . 10086 1 537 . 1 1 48 48 GLU HG2 H 1 2.318 0.030 . 1 . . . . 48 GLU HG2 . 10086 1 538 . 1 1 48 48 GLU HG3 H 1 2.318 0.030 . 1 . . . . 48 GLU HG3 . 10086 1 539 . 1 1 48 48 GLU C C 13 176.498 0.300 . 1 . . . . 48 GLU C . 10086 1 540 . 1 1 48 48 GLU CA C 13 58.414 0.300 . 1 . . . . 48 GLU CA . 10086 1 541 . 1 1 48 48 GLU CB C 13 28.635 0.300 . 1 . . . . 48 GLU CB . 10086 1 542 . 1 1 48 48 GLU CG C 13 36.123 0.300 . 1 . . . . 48 GLU CG . 10086 1 543 . 1 1 48 48 GLU N N 15 115.659 0.300 . 1 . . . . 48 GLU N . 10086 1 544 . 1 1 49 49 ASP H H 1 7.761 0.030 . 1 . . . . 49 ASP H . 10086 1 545 . 1 1 49 49 ASP HA H 1 4.947 0.030 . 1 . . . . 49 ASP HA . 10086 1 546 . 1 1 49 49 ASP HB2 H 1 3.279 0.030 . 2 . . . . 49 ASP HB2 . 10086 1 547 . 1 1 49 49 ASP HB3 H 1 2.914 0.030 . 2 . . . . 49 ASP HB3 . 10086 1 548 . 1 1 49 49 ASP C C 13 174.789 0.300 . 1 . . . . 49 ASP C . 10086 1 549 . 1 1 49 49 ASP CA C 13 54.555 0.300 . 1 . . . . 49 ASP CA . 10086 1 550 . 1 1 49 49 ASP CB C 13 42.054 0.300 . 1 . . . . 49 ASP CB . 10086 1 551 . 1 1 49 49 ASP N N 15 118.882 0.300 . 1 . . . . 49 ASP N . 10086 1 552 . 1 1 50 50 LEU H H 1 7.487 0.030 . 1 . . . . 50 LEU H . 10086 1 553 . 1 1 50 50 LEU HA H 1 5.431 0.030 . 1 . . . . 50 LEU HA . 10086 1 554 . 1 1 50 50 LEU HB2 H 1 1.910 0.030 . 2 . . . . 50 LEU HB2 . 10086 1 555 . 1 1 50 50 LEU HB3 H 1 1.374 0.030 . 2 . . . . 50 LEU HB3 . 10086 1 556 . 1 1 50 50 LEU HG H 1 2.005 0.030 . 1 . . . . 50 LEU HG . 10086 1 557 . 1 1 50 50 LEU HD11 H 1 0.772 0.030 . 1 . . . . 50 LEU HD1 . 10086 1 558 . 1 1 50 50 LEU HD12 H 1 0.772 0.030 . 1 . . . . 50 LEU HD1 . 10086 1 559 . 1 1 50 50 LEU HD13 H 1 0.772 0.030 . 1 . . . . 50 LEU HD1 . 10086 1 560 . 1 1 50 50 LEU HD21 H 1 0.731 0.030 . 1 . . . . 50 LEU HD2 . 10086 1 561 . 1 1 50 50 LEU HD22 H 1 0.731 0.030 . 1 . . . . 50 LEU HD2 . 10086 1 562 . 1 1 50 50 LEU HD23 H 1 0.731 0.030 . 1 . . . . 50 LEU HD2 . 10086 1 563 . 1 1 50 50 LEU C C 13 175.324 0.300 . 1 . . . . 50 LEU C . 10086 1 564 . 1 1 50 50 LEU CA C 13 53.337 0.300 . 1 . . . . 50 LEU CA . 10086 1 565 . 1 1 50 50 LEU CB C 13 47.695 0.300 . 1 . . . . 50 LEU CB . 10086 1 566 . 1 1 50 50 LEU CG C 13 25.680 0.300 . 1 . . . . 50 LEU CG . 10086 1 567 . 1 1 50 50 LEU CD1 C 13 25.985 0.300 . 2 . . . . 50 LEU CD1 . 10086 1 568 . 1 1 50 50 LEU CD2 C 13 22.842 0.300 . 2 . . . . 50 LEU CD2 . 10086 1 569 . 1 1 50 50 LEU N N 15 119.249 0.300 . 1 . . . . 50 LEU N . 10086 1 570 . 1 1 51 51 ALA H H 1 8.551 0.030 . 1 . . . . 51 ALA H . 10086 1 571 . 1 1 51 51 ALA HA H 1 4.493 0.030 . 1 . . . . 51 ALA HA . 10086 1 572 . 1 1 51 51 ALA HB1 H 1 1.232 0.030 . 1 . . . . 51 ALA HB . 10086 1 573 . 1 1 51 51 ALA HB2 H 1 1.232 0.030 . 1 . . . . 51 ALA HB . 10086 1 574 . 1 1 51 51 ALA HB3 H 1 1.232 0.030 . 1 . . . . 51 ALA HB . 10086 1 575 . 1 1 51 51 ALA C C 13 175.509 0.300 . 1 . . . . 51 ALA C . 10086 1 576 . 1 1 51 51 ALA CA C 13 51.726 0.300 . 1 . . . . 51 ALA CA . 10086 1 577 . 1 1 51 51 ALA CB C 13 23.656 0.300 . 1 . . . . 51 ALA CB . 10086 1 578 . 1 1 51 51 ALA N N 15 119.472 0.300 . 1 . . . . 51 ALA N . 10086 1 579 . 1 1 52 52 LEU H H 1 9.303 0.030 . 1 . . . . 52 LEU H . 10086 1 580 . 1 1 52 52 LEU HA H 1 5.400 0.030 . 1 . . . . 52 LEU HA . 10086 1 581 . 1 1 52 52 LEU HB2 H 1 1.861 0.030 . 2 . . . . 52 LEU HB2 . 10086 1 582 . 1 1 52 52 LEU HB3 H 1 1.267 0.030 . 2 . . . . 52 LEU HB3 . 10086 1 583 . 1 1 52 52 LEU HG H 1 1.747 0.030 . 1 . . . . 52 LEU HG . 10086 1 584 . 1 1 52 52 LEU HD11 H 1 0.859 0.030 . 1 . . . . 52 LEU HD1 . 10086 1 585 . 1 1 52 52 LEU HD12 H 1 0.859 0.030 . 1 . . . . 52 LEU HD1 . 10086 1 586 . 1 1 52 52 LEU HD13 H 1 0.859 0.030 . 1 . . . . 52 LEU HD1 . 10086 1 587 . 1 1 52 52 LEU HD21 H 1 0.770 0.030 . 1 . . . . 52 LEU HD2 . 10086 1 588 . 1 1 52 52 LEU HD22 H 1 0.770 0.030 . 1 . . . . 52 LEU HD2 . 10086 1 589 . 1 1 52 52 LEU HD23 H 1 0.770 0.030 . 1 . . . . 52 LEU HD2 . 10086 1 590 . 1 1 52 52 LEU C C 13 175.839 0.300 . 1 . . . . 52 LEU C . 10086 1 591 . 1 1 52 52 LEU CA C 13 53.368 0.300 . 1 . . . . 52 LEU CA . 10086 1 592 . 1 1 52 52 LEU CB C 13 43.631 0.300 . 1 . . . . 52 LEU CB . 10086 1 593 . 1 1 52 52 LEU CG C 13 26.653 0.300 . 1 . . . . 52 LEU CG . 10086 1 594 . 1 1 52 52 LEU CD1 C 13 26.373 0.300 . 2 . . . . 52 LEU CD1 . 10086 1 595 . 1 1 52 52 LEU CD2 C 13 23.875 0.300 . 2 . . . . 52 LEU CD2 . 10086 1 596 . 1 1 52 52 LEU N N 15 120.064 0.300 . 1 . . . . 52 LEU N . 10086 1 597 . 1 1 53 53 VAL H H 1 9.199 0.030 . 1 . . . . 53 VAL H . 10086 1 598 . 1 1 53 53 VAL HA H 1 4.513 0.030 . 1 . . . . 53 VAL HA . 10086 1 599 . 1 1 53 53 VAL HB H 1 1.347 0.030 . 1 . . . . 53 VAL HB . 10086 1 600 . 1 1 53 53 VAL HG11 H 1 0.384 0.030 . 1 . . . . 53 VAL HG1 . 10086 1 601 . 1 1 53 53 VAL HG12 H 1 0.384 0.030 . 1 . . . . 53 VAL HG1 . 10086 1 602 . 1 1 53 53 VAL HG13 H 1 0.384 0.030 . 1 . . . . 53 VAL HG1 . 10086 1 603 . 1 1 53 53 VAL HG21 H 1 0.338 0.030 . 1 . . . . 53 VAL HG2 . 10086 1 604 . 1 1 53 53 VAL HG22 H 1 0.338 0.030 . 1 . . . . 53 VAL HG2 . 10086 1 605 . 1 1 53 53 VAL HG23 H 1 0.338 0.030 . 1 . . . . 53 VAL HG2 . 10086 1 606 . 1 1 53 53 VAL C C 13 173.861 0.300 . 1 . . . . 53 VAL C . 10086 1 607 . 1 1 53 53 VAL CA C 13 60.223 0.300 . 1 . . . . 53 VAL CA . 10086 1 608 . 1 1 53 53 VAL CB C 13 35.898 0.300 . 1 . . . . 53 VAL CB . 10086 1 609 . 1 1 53 53 VAL CG1 C 13 20.925 0.300 . 2 . . . . 53 VAL CG1 . 10086 1 610 . 1 1 53 53 VAL CG2 C 13 21.319 0.300 . 2 . . . . 53 VAL CG2 . 10086 1 611 . 1 1 53 53 VAL N N 15 121.724 0.300 . 1 . . . . 53 VAL N . 10086 1 612 . 1 1 54 54 ALA H H 1 8.910 0.030 . 1 . . . . 54 ALA H . 10086 1 613 . 1 1 54 54 ALA HA H 1 5.212 0.030 . 1 . . . . 54 ALA HA . 10086 1 614 . 1 1 54 54 ALA HB1 H 1 1.263 0.030 . 1 . . . . 54 ALA HB . 10086 1 615 . 1 1 54 54 ALA HB2 H 1 1.263 0.030 . 1 . . . . 54 ALA HB . 10086 1 616 . 1 1 54 54 ALA HB3 H 1 1.263 0.030 . 1 . . . . 54 ALA HB . 10086 1 617 . 1 1 54 54 ALA C C 13 176.446 0.300 . 1 . . . . 54 ALA C . 10086 1 618 . 1 1 54 54 ALA CA C 13 50.389 0.300 . 1 . . . . 54 ALA CA . 10086 1 619 . 1 1 54 54 ALA CB C 13 20.233 0.300 . 1 . . . . 54 ALA CB . 10086 1 620 . 1 1 54 54 ALA N N 15 129.379 0.300 . 1 . . . . 54 ALA N . 10086 1 621 . 1 1 55 55 ILE H H 1 9.011 0.030 . 1 . . . . 55 ILE H . 10086 1 622 . 1 1 55 55 ILE HA H 1 5.155 0.030 . 1 . . . . 55 ILE HA . 10086 1 623 . 1 1 55 55 ILE HB H 1 1.810 0.030 . 1 . . . . 55 ILE HB . 10086 1 624 . 1 1 55 55 ILE HG12 H 1 1.447 0.030 . 2 . . . . 55 ILE HG12 . 10086 1 625 . 1 1 55 55 ILE HG13 H 1 0.881 0.030 . 2 . . . . 55 ILE HG13 . 10086 1 626 . 1 1 55 55 ILE HG21 H 1 0.834 0.030 . 1 . . . . 55 ILE HG2 . 10086 1 627 . 1 1 55 55 ILE HG22 H 1 0.834 0.030 . 1 . . . . 55 ILE HG2 . 10086 1 628 . 1 1 55 55 ILE HG23 H 1 0.834 0.030 . 1 . . . . 55 ILE HG2 . 10086 1 629 . 1 1 55 55 ILE HD11 H 1 0.412 0.030 . 1 . . . . 55 ILE HD1 . 10086 1 630 . 1 1 55 55 ILE HD12 H 1 0.412 0.030 . 1 . . . . 55 ILE HD1 . 10086 1 631 . 1 1 55 55 ILE HD13 H 1 0.412 0.030 . 1 . . . . 55 ILE HD1 . 10086 1 632 . 1 1 55 55 ILE C C 13 177.663 0.300 . 1 . . . . 55 ILE C . 10086 1 633 . 1 1 55 55 ILE CA C 13 59.704 0.300 . 1 . . . . 55 ILE CA . 10086 1 634 . 1 1 55 55 ILE CB C 13 38.740 0.300 . 1 . . . . 55 ILE CB . 10086 1 635 . 1 1 55 55 ILE CG1 C 13 27.684 0.300 . 1 . . . . 55 ILE CG1 . 10086 1 636 . 1 1 55 55 ILE CG2 C 13 16.442 0.300 . 1 . . . . 55 ILE CG2 . 10086 1 637 . 1 1 55 55 ILE CD1 C 13 12.124 0.300 . 1 . . . . 55 ILE CD1 . 10086 1 638 . 1 1 55 55 ILE N N 15 123.092 0.300 . 1 . . . . 55 ILE N . 10086 1 639 . 1 1 56 56 THR H H 1 8.918 0.030 . 1 . . . . 56 THR H . 10086 1 640 . 1 1 56 56 THR HA H 1 4.687 0.030 . 1 . . . . 56 THR HA . 10086 1 641 . 1 1 56 56 THR HB H 1 4.687 0.030 . 1 . . . . 56 THR HB . 10086 1 642 . 1 1 56 56 THR HG21 H 1 1.300 0.030 . 1 . . . . 56 THR HG2 . 10086 1 643 . 1 1 56 56 THR HG22 H 1 1.300 0.030 . 1 . . . . 56 THR HG2 . 10086 1 644 . 1 1 56 56 THR HG23 H 1 1.300 0.030 . 1 . . . . 56 THR HG2 . 10086 1 645 . 1 1 56 56 THR C C 13 177.390 0.300 . 1 . . . . 56 THR C . 10086 1 646 . 1 1 56 56 THR CA C 13 61.053 0.300 . 1 . . . . 56 THR CA . 10086 1 647 . 1 1 56 56 THR CB C 13 71.764 0.300 . 1 . . . . 56 THR CB . 10086 1 648 . 1 1 56 56 THR CG2 C 13 21.982 0.300 . 1 . . . . 56 THR CG2 . 10086 1 649 . 1 1 56 56 THR N N 15 118.729 0.300 . 1 . . . . 56 THR N . 10086 1 650 . 1 1 57 57 PHE H H 1 8.768 0.030 . 1 . . . . 57 PHE H . 10086 1 651 . 1 1 57 57 PHE HA H 1 4.498 0.030 . 1 . . . . 57 PHE HA . 10086 1 652 . 1 1 57 57 PHE HB2 H 1 3.270 0.030 . 2 . . . . 57 PHE HB2 . 10086 1 653 . 1 1 57 57 PHE HB3 H 1 3.186 0.030 . 2 . . . . 57 PHE HB3 . 10086 1 654 . 1 1 57 57 PHE HD1 H 1 7.337 0.030 . 1 . . . . 57 PHE HD1 . 10086 1 655 . 1 1 57 57 PHE HD2 H 1 7.337 0.030 . 1 . . . . 57 PHE HD2 . 10086 1 656 . 1 1 57 57 PHE HE1 H 1 7.332 0.030 . 1 . . . . 57 PHE HE1 . 10086 1 657 . 1 1 57 57 PHE HE2 H 1 7.332 0.030 . 1 . . . . 57 PHE HE2 . 10086 1 658 . 1 1 57 57 PHE HZ H 1 7.294 0.030 . 1 . . . . 57 PHE HZ . 10086 1 659 . 1 1 57 57 PHE C C 13 179.082 0.300 . 1 . . . . 57 PHE C . 10086 1 660 . 1 1 57 57 PHE CA C 13 60.288 0.300 . 1 . . . . 57 PHE CA . 10086 1 661 . 1 1 57 57 PHE CB C 13 38.100 0.300 . 1 . . . . 57 PHE CB . 10086 1 662 . 1 1 57 57 PHE CD1 C 13 131.468 0.300 . 1 . . . . 57 PHE CD1 . 10086 1 663 . 1 1 57 57 PHE CD2 C 13 131.468 0.300 . 1 . . . . 57 PHE CD2 . 10086 1 664 . 1 1 57 57 PHE CE1 C 13 131.547 0.300 . 1 . . . . 57 PHE CE1 . 10086 1 665 . 1 1 57 57 PHE CE2 C 13 131.547 0.300 . 1 . . . . 57 PHE CE2 . 10086 1 666 . 1 1 57 57 PHE CZ C 13 130.010 0.300 . 1 . . . . 57 PHE CZ . 10086 1 667 . 1 1 57 57 PHE N N 15 121.213 0.300 . 1 . . . . 57 PHE N . 10086 1 668 . 1 1 58 58 SER HA H 1 4.419 0.030 . 1 . . . . 58 SER HA . 10086 1 669 . 1 1 58 58 SER HB2 H 1 4.095 0.030 . 2 . . . . 58 SER HB2 . 10086 1 670 . 1 1 58 58 SER HB3 H 1 3.761 0.030 . 2 . . . . 58 SER HB3 . 10086 1 671 . 1 1 58 58 SER C C 13 174.998 0.300 . 1 . . . . 58 SER C . 10086 1 672 . 1 1 58 58 SER CA C 13 58.151 0.300 . 1 . . . . 58 SER CA . 10086 1 673 . 1 1 58 58 SER CB C 13 63.332 0.300 . 1 . . . . 58 SER CB . 10086 1 674 . 1 1 59 59 GLY H H 1 8.073 0.030 . 1 . . . . 59 GLY H . 10086 1 675 . 1 1 59 59 GLY HA2 H 1 4.235 0.030 . 2 . . . . 59 GLY HA2 . 10086 1 676 . 1 1 59 59 GLY HA3 H 1 3.489 0.030 . 2 . . . . 59 GLY HA3 . 10086 1 677 . 1 1 59 59 GLY C C 13 174.418 0.300 . 1 . . . . 59 GLY C . 10086 1 678 . 1 1 59 59 GLY CA C 13 45.327 0.300 . 1 . . . . 59 GLY CA . 10086 1 679 . 1 1 59 59 GLY N N 15 110.696 0.300 . 1 . . . . 59 GLY N . 10086 1 680 . 1 1 60 60 GLU H H 1 7.624 0.030 . 1 . . . . 60 GLU H . 10086 1 681 . 1 1 60 60 GLU HA H 1 4.221 0.030 . 1 . . . . 60 GLU HA . 10086 1 682 . 1 1 60 60 GLU HB2 H 1 1.944 0.030 . 1 . . . . 60 GLU HB2 . 10086 1 683 . 1 1 60 60 GLU HB3 H 1 1.944 0.030 . 1 . . . . 60 GLU HB3 . 10086 1 684 . 1 1 60 60 GLU HG2 H 1 2.137 0.030 . 1 . . . . 60 GLU HG2 . 10086 1 685 . 1 1 60 60 GLU HG3 H 1 2.137 0.030 . 1 . . . . 60 GLU HG3 . 10086 1 686 . 1 1 60 60 GLU C C 13 175.189 0.300 . 1 . . . . 60 GLU C . 10086 1 687 . 1 1 60 60 GLU CA C 13 56.667 0.300 . 1 . . . . 60 GLU CA . 10086 1 688 . 1 1 60 60 GLU CB C 13 30.139 0.300 . 1 . . . . 60 GLU CB . 10086 1 689 . 1 1 60 60 GLU CG C 13 36.363 0.300 . 1 . . . . 60 GLU CG . 10086 1 690 . 1 1 60 60 GLU N N 15 121.134 0.300 . 1 . . . . 60 GLU N . 10086 1 691 . 1 1 61 61 LYS H H 1 8.411 0.030 . 1 . . . . 61 LYS H . 10086 1 692 . 1 1 61 61 LYS HA H 1 5.028 0.030 . 1 . . . . 61 LYS HA . 10086 1 693 . 1 1 61 61 LYS HB2 H 1 1.600 0.030 . 2 . . . . 61 LYS HB2 . 10086 1 694 . 1 1 61 61 LYS HB3 H 1 1.405 0.030 . 2 . . . . 61 LYS HB3 . 10086 1 695 . 1 1 61 61 LYS HG2 H 1 1.328 0.030 . 2 . . . . 61 LYS HG2 . 10086 1 696 . 1 1 61 61 LYS HG3 H 1 1.076 0.030 . 2 . . . . 61 LYS HG3 . 10086 1 697 . 1 1 61 61 LYS HD2 H 1 1.532 0.030 . 1 . . . . 61 LYS HD2 . 10086 1 698 . 1 1 61 61 LYS HD3 H 1 1.532 0.030 . 1 . . . . 61 LYS HD3 . 10086 1 699 . 1 1 61 61 LYS HE2 H 1 2.887 0.030 . 1 . . . . 61 LYS HE2 . 10086 1 700 . 1 1 61 61 LYS HE3 H 1 2.887 0.030 . 1 . . . . 61 LYS HE3 . 10086 1 701 . 1 1 61 61 LYS C C 13 175.982 0.300 . 1 . . . . 61 LYS C . 10086 1 702 . 1 1 61 61 LYS CA C 13 55.389 0.300 . 1 . . . . 61 LYS CA . 10086 1 703 . 1 1 61 61 LYS CB C 13 34.660 0.300 . 1 . . . . 61 LYS CB . 10086 1 704 . 1 1 61 61 LYS CG C 13 24.911 0.300 . 1 . . . . 61 LYS CG . 10086 1 705 . 1 1 61 61 LYS CD C 13 29.444 0.300 . 1 . . . . 61 LYS CD . 10086 1 706 . 1 1 61 61 LYS CE C 13 41.880 0.300 . 1 . . . . 61 LYS CE . 10086 1 707 . 1 1 61 61 LYS N N 15 122.591 0.300 . 1 . . . . 61 LYS N . 10086 1 708 . 1 1 62 62 HIS H H 1 9.127 0.030 . 1 . . . . 62 HIS H . 10086 1 709 . 1 1 62 62 HIS HA H 1 4.797 0.030 . 1 . . . . 62 HIS HA . 10086 1 710 . 1 1 62 62 HIS HB2 H 1 3.054 0.030 . 2 . . . . 62 HIS HB2 . 10086 1 711 . 1 1 62 62 HIS HB3 H 1 2.965 0.030 . 2 . . . . 62 HIS HB3 . 10086 1 712 . 1 1 62 62 HIS HD2 H 1 6.738 0.030 . 1 . . . . 62 HIS HD2 . 10086 1 713 . 1 1 62 62 HIS HE1 H 1 7.864 0.030 . 1 . . . . 62 HIS HE1 . 10086 1 714 . 1 1 62 62 HIS C C 13 173.718 0.300 . 1 . . . . 62 HIS C . 10086 1 715 . 1 1 62 62 HIS CA C 13 54.797 0.300 . 1 . . . . 62 HIS CA . 10086 1 716 . 1 1 62 62 HIS CB C 13 32.399 0.300 . 1 . . . . 62 HIS CB . 10086 1 717 . 1 1 62 62 HIS CD2 C 13 119.255 0.300 . 1 . . . . 62 HIS CD2 . 10086 1 718 . 1 1 62 62 HIS CE1 C 13 138.233 0.300 . 1 . . . . 62 HIS CE1 . 10086 1 719 . 1 1 62 62 HIS N N 15 123.332 0.300 . 1 . . . . 62 HIS N . 10086 1 720 . 1 1 63 63 GLU H H 1 8.880 0.030 . 1 . . . . 63 GLU H . 10086 1 721 . 1 1 63 63 GLU HA H 1 4.255 0.030 . 1 . . . . 63 GLU HA . 10086 1 722 . 1 1 63 63 GLU HB2 H 1 1.881 0.030 . 2 . . . . 63 GLU HB2 . 10086 1 723 . 1 1 63 63 GLU HB3 H 1 1.820 0.030 . 2 . . . . 63 GLU HB3 . 10086 1 724 . 1 1 63 63 GLU HG2 H 1 2.063 0.030 . 1 . . . . 63 GLU HG2 . 10086 1 725 . 1 1 63 63 GLU HG3 H 1 2.063 0.030 . 1 . . . . 63 GLU HG3 . 10086 1 726 . 1 1 63 63 GLU C C 13 176.003 0.300 . 1 . . . . 63 GLU C . 10086 1 727 . 1 1 63 63 GLU CA C 13 56.803 0.300 . 1 . . . . 63 GLU CA . 10086 1 728 . 1 1 63 63 GLU CB C 13 29.820 0.300 . 1 . . . . 63 GLU CB . 10086 1 729 . 1 1 63 63 GLU CG C 13 35.893 0.300 . 1 . . . . 63 GLU CG . 10086 1 730 . 1 1 63 63 GLU N N 15 127.134 0.300 . 1 . . . . 63 GLU N . 10086 1 731 . 1 1 64 64 LEU H H 1 8.721 0.030 . 1 . . . . 64 LEU H . 10086 1 732 . 1 1 64 64 LEU HA H 1 4.521 0.030 . 1 . . . . 64 LEU HA . 10086 1 733 . 1 1 64 64 LEU HB2 H 1 1.691 0.030 . 2 . . . . 64 LEU HB2 . 10086 1 734 . 1 1 64 64 LEU HB3 H 1 1.460 0.030 . 2 . . . . 64 LEU HB3 . 10086 1 735 . 1 1 64 64 LEU HG H 1 1.729 0.030 . 1 . . . . 64 LEU HG . 10086 1 736 . 1 1 64 64 LEU HD11 H 1 0.866 0.030 . 1 . . . . 64 LEU HD1 . 10086 1 737 . 1 1 64 64 LEU HD12 H 1 0.866 0.030 . 1 . . . . 64 LEU HD1 . 10086 1 738 . 1 1 64 64 LEU HD13 H 1 0.866 0.030 . 1 . . . . 64 LEU HD1 . 10086 1 739 . 1 1 64 64 LEU HD21 H 1 0.856 0.030 . 1 . . . . 64 LEU HD2 . 10086 1 740 . 1 1 64 64 LEU HD22 H 1 0.856 0.030 . 1 . . . . 64 LEU HD2 . 10086 1 741 . 1 1 64 64 LEU HD23 H 1 0.856 0.030 . 1 . . . . 64 LEU HD2 . 10086 1 742 . 1 1 64 64 LEU C C 13 177.496 0.300 . 1 . . . . 64 LEU C . 10086 1 743 . 1 1 64 64 LEU CA C 13 55.679 0.300 . 1 . . . . 64 LEU CA . 10086 1 744 . 1 1 64 64 LEU CB C 13 40.994 0.300 . 1 . . . . 64 LEU CB . 10086 1 745 . 1 1 64 64 LEU CG C 13 28.945 0.300 . 1 . . . . 64 LEU CG . 10086 1 746 . 1 1 64 64 LEU CD1 C 13 25.873 0.300 . 2 . . . . 64 LEU CD1 . 10086 1 747 . 1 1 64 64 LEU CD2 C 13 24.772 0.300 . 2 . . . . 64 LEU CD2 . 10086 1 748 . 1 1 64 64 LEU N N 15 128.158 0.300 . 1 . . . . 64 LEU N . 10086 1 749 . 1 1 65 65 GLN H H 1 9.246 0.030 . 1 . . . . 65 GLN H . 10086 1 750 . 1 1 65 65 GLN HA H 1 4.468 0.030 . 1 . . . . 65 GLN HA . 10086 1 751 . 1 1 65 65 GLN HB2 H 1 2.389 0.030 . 2 . . . . 65 GLN HB2 . 10086 1 752 . 1 1 65 65 GLN HB3 H 1 1.784 0.030 . 2 . . . . 65 GLN HB3 . 10086 1 753 . 1 1 65 65 GLN HG2 H 1 2.554 0.030 . 2 . . . . 65 GLN HG2 . 10086 1 754 . 1 1 65 65 GLN HG3 H 1 2.479 0.030 . 2 . . . . 65 GLN HG3 . 10086 1 755 . 1 1 65 65 GLN HE21 H 1 7.528 0.030 . 2 . . . . 65 GLN HE21 . 10086 1 756 . 1 1 65 65 GLN HE22 H 1 6.940 0.030 . 2 . . . . 65 GLN HE22 . 10086 1 757 . 1 1 65 65 GLN C C 13 175.175 0.300 . 1 . . . . 65 GLN C . 10086 1 758 . 1 1 65 65 GLN CA C 13 53.491 0.300 . 1 . . . . 65 GLN CA . 10086 1 759 . 1 1 65 65 GLN CB C 13 27.353 0.300 . 1 . . . . 65 GLN CB . 10086 1 760 . 1 1 65 65 GLN CG C 13 34.103 0.300 . 1 . . . . 65 GLN CG . 10086 1 761 . 1 1 65 65 GLN N N 15 124.736 0.300 . 1 . . . . 65 GLN N . 10086 1 762 . 1 1 65 65 GLN NE2 N 15 114.078 0.300 . 1 . . . . 65 GLN NE2 . 10086 1 763 . 1 1 66 66 PRO HA H 1 4.231 0.030 . 1 . . . . 66 PRO HA . 10086 1 764 . 1 1 66 66 PRO HB2 H 1 2.495 0.030 . 2 . . . . 66 PRO HB2 . 10086 1 765 . 1 1 66 66 PRO HB3 H 1 1.910 0.030 . 2 . . . . 66 PRO HB3 . 10086 1 766 . 1 1 66 66 PRO HG2 H 1 2.160 0.030 . 2 . . . . 66 PRO HG2 . 10086 1 767 . 1 1 66 66 PRO HG3 H 1 2.118 0.030 . 2 . . . . 66 PRO HG3 . 10086 1 768 . 1 1 66 66 PRO HD2 H 1 3.806 0.030 . 1 . . . . 66 PRO HD2 . 10086 1 769 . 1 1 66 66 PRO HD3 H 1 3.806 0.030 . 1 . . . . 66 PRO HD3 . 10086 1 770 . 1 1 66 66 PRO C C 13 176.421 0.300 . 1 . . . . 66 PRO C . 10086 1 771 . 1 1 66 66 PRO CA C 13 66.093 0.300 . 1 . . . . 66 PRO CA . 10086 1 772 . 1 1 66 66 PRO CB C 13 32.589 0.300 . 1 . . . . 66 PRO CB . 10086 1 773 . 1 1 66 66 PRO CG C 13 27.754 0.300 . 1 . . . . 66 PRO CG . 10086 1 774 . 1 1 66 66 PRO CD C 13 49.867 0.300 . 1 . . . . 66 PRO CD . 10086 1 775 . 1 1 67 67 ASN H H 1 7.881 0.030 . 1 . . . . 67 ASN H . 10086 1 776 . 1 1 67 67 ASN HA H 1 4.960 0.030 . 1 . . . . 67 ASN HA . 10086 1 777 . 1 1 67 67 ASN HB2 H 1 2.941 0.030 . 2 . . . . 67 ASN HB2 . 10086 1 778 . 1 1 67 67 ASN HB3 H 1 2.853 0.030 . 2 . . . . 67 ASN HB3 . 10086 1 779 . 1 1 67 67 ASN HD21 H 1 7.557 0.030 . 2 . . . . 67 ASN HD21 . 10086 1 780 . 1 1 67 67 ASN HD22 H 1 6.887 0.030 . 2 . . . . 67 ASN HD22 . 10086 1 781 . 1 1 67 67 ASN C C 13 175.046 0.300 . 1 . . . . 67 ASN C . 10086 1 782 . 1 1 67 67 ASN CA C 13 52.775 0.300 . 1 . . . . 67 ASN CA . 10086 1 783 . 1 1 67 67 ASN CB C 13 38.237 0.300 . 1 . . . . 67 ASN CB . 10086 1 784 . 1 1 67 67 ASN N N 15 108.106 0.300 . 1 . . . . 67 ASN N . 10086 1 785 . 1 1 67 67 ASN ND2 N 15 112.977 0.300 . 1 . . . . 67 ASN ND2 . 10086 1 786 . 1 1 68 68 ASP H H 1 8.032 0.030 . 1 . . . . 68 ASP H . 10086 1 787 . 1 1 68 68 ASP HA H 1 4.599 0.030 . 1 . . . . 68 ASP HA . 10086 1 788 . 1 1 68 68 ASP HB2 H 1 2.939 0.030 . 2 . . . . 68 ASP HB2 . 10086 1 789 . 1 1 68 68 ASP HB3 H 1 2.480 0.030 . 2 . . . . 68 ASP HB3 . 10086 1 790 . 1 1 68 68 ASP C C 13 176.518 0.300 . 1 . . . . 68 ASP C . 10086 1 791 . 1 1 68 68 ASP CA C 13 55.131 0.300 . 1 . . . . 68 ASP CA . 10086 1 792 . 1 1 68 68 ASP CB C 13 41.615 0.300 . 1 . . . . 68 ASP CB . 10086 1 793 . 1 1 68 68 ASP N N 15 121.146 0.300 . 1 . . . . 68 ASP N . 10086 1 794 . 1 1 69 69 LEU H H 1 8.422 0.030 . 1 . . . . 69 LEU H . 10086 1 795 . 1 1 69 69 LEU HA H 1 4.573 0.030 . 1 . . . . 69 LEU HA . 10086 1 796 . 1 1 69 69 LEU HB2 H 1 1.757 0.030 . 2 . . . . 69 LEU HB2 . 10086 1 797 . 1 1 69 69 LEU HB3 H 1 1.700 0.030 . 2 . . . . 69 LEU HB3 . 10086 1 798 . 1 1 69 69 LEU HG H 1 1.791 0.030 . 1 . . . . 69 LEU HG . 10086 1 799 . 1 1 69 69 LEU HD11 H 1 1.004 0.030 . 1 . . . . 69 LEU HD1 . 10086 1 800 . 1 1 69 69 LEU HD12 H 1 1.004 0.030 . 1 . . . . 69 LEU HD1 . 10086 1 801 . 1 1 69 69 LEU HD13 H 1 1.004 0.030 . 1 . . . . 69 LEU HD1 . 10086 1 802 . 1 1 69 69 LEU HD21 H 1 0.873 0.030 . 1 . . . . 69 LEU HD2 . 10086 1 803 . 1 1 69 69 LEU HD22 H 1 0.873 0.030 . 1 . . . . 69 LEU HD2 . 10086 1 804 . 1 1 69 69 LEU HD23 H 1 0.873 0.030 . 1 . . . . 69 LEU HD2 . 10086 1 805 . 1 1 69 69 LEU CA C 13 54.996 0.300 . 1 . . . . 69 LEU CA . 10086 1 806 . 1 1 69 69 LEU CB C 13 41.544 0.300 . 1 . . . . 69 LEU CB . 10086 1 807 . 1 1 69 69 LEU CG C 13 27.325 0.300 . 1 . . . . 69 LEU CG . 10086 1 808 . 1 1 69 69 LEU CD1 C 13 25.678 0.300 . 2 . . . . 69 LEU CD1 . 10086 1 809 . 1 1 69 69 LEU CD2 C 13 23.590 0.300 . 2 . . . . 69 LEU CD2 . 10086 1 810 . 1 1 69 69 LEU N N 15 121.345 0.300 . 1 . . . . 69 LEU N . 10086 1 811 . 1 1 70 70 VAL H H 1 7.265 0.030 . 1 . . . . 70 VAL H . 10086 1 812 . 1 1 70 70 VAL HB H 1 1.830 0.030 . 1 . . . . 70 VAL HB . 10086 1 813 . 1 1 70 70 VAL HG11 H 1 0.778 0.030 . 1 . . . . 70 VAL HG1 . 10086 1 814 . 1 1 70 70 VAL HG12 H 1 0.778 0.030 . 1 . . . . 70 VAL HG1 . 10086 1 815 . 1 1 70 70 VAL HG13 H 1 0.778 0.030 . 1 . . . . 70 VAL HG1 . 10086 1 816 . 1 1 70 70 VAL HG21 H 1 0.775 0.030 . 1 . . . . 70 VAL HG2 . 10086 1 817 . 1 1 70 70 VAL HG22 H 1 0.775 0.030 . 1 . . . . 70 VAL HG2 . 10086 1 818 . 1 1 70 70 VAL HG23 H 1 0.775 0.030 . 1 . . . . 70 VAL HG2 . 10086 1 819 . 1 1 70 70 VAL CA C 13 64.378 0.300 . 1 . . . . 70 VAL CA . 10086 1 820 . 1 1 70 70 VAL CB C 13 32.397 0.300 . 1 . . . . 70 VAL CB . 10086 1 821 . 1 1 70 70 VAL CG1 C 13 21.438 0.300 . 2 . . . . 70 VAL CG1 . 10086 1 822 . 1 1 70 70 VAL CG2 C 13 20.797 0.300 . 2 . . . . 70 VAL CG2 . 10086 1 823 . 1 1 70 70 VAL N N 15 118.316 0.300 . 1 . . . . 70 VAL N . 10086 1 824 . 1 1 71 71 ILE H H 1 9.025 0.030 . 1 . . . . 71 ILE H . 10086 1 825 . 1 1 71 71 ILE HA H 1 4.084 0.030 . 1 . . . . 71 ILE HA . 10086 1 826 . 1 1 71 71 ILE HB H 1 2.113 0.030 . 1 . . . . 71 ILE HB . 10086 1 827 . 1 1 71 71 ILE HG12 H 1 1.337 0.030 . 1 . . . . 71 ILE HG12 . 10086 1 828 . 1 1 71 71 ILE HG13 H 1 1.337 0.030 . 1 . . . . 71 ILE HG13 . 10086 1 829 . 1 1 71 71 ILE HG21 H 1 0.866 0.030 . 1 . . . . 71 ILE HG2 . 10086 1 830 . 1 1 71 71 ILE HG22 H 1 0.866 0.030 . 1 . . . . 71 ILE HG2 . 10086 1 831 . 1 1 71 71 ILE HG23 H 1 0.866 0.030 . 1 . . . . 71 ILE HG2 . 10086 1 832 . 1 1 71 71 ILE HD11 H 1 0.636 0.030 . 1 . . . . 71 ILE HD1 . 10086 1 833 . 1 1 71 71 ILE HD12 H 1 0.636 0.030 . 1 . . . . 71 ILE HD1 . 10086 1 834 . 1 1 71 71 ILE HD13 H 1 0.636 0.030 . 1 . . . . 71 ILE HD1 . 10086 1 835 . 1 1 71 71 ILE CA C 13 61.032 0.300 . 1 . . . . 71 ILE CA . 10086 1 836 . 1 1 71 71 ILE CB C 13 36.071 0.300 . 1 . . . . 71 ILE CB . 10086 1 837 . 1 1 71 71 ILE CG1 C 13 27.623 0.300 . 1 . . . . 71 ILE CG1 . 10086 1 838 . 1 1 71 71 ILE CG2 C 13 17.614 0.300 . 1 . . . . 71 ILE CG2 . 10086 1 839 . 1 1 71 71 ILE CD1 C 13 11.339 0.300 . 1 . . . . 71 ILE CD1 . 10086 1 840 . 1 1 72 72 SER H H 1 7.798 0.030 . 1 . . . . 72 SER H . 10086 1 841 . 1 1 72 72 SER HB2 H 1 3.960 0.030 . 2 . . . . 72 SER HB2 . 10086 1 842 . 1 1 72 72 SER HB3 H 1 3.843 0.030 . 2 . . . . 72 SER HB3 . 10086 1 843 . 1 1 72 72 SER CB C 13 63.767 0.300 . 1 . . . . 72 SER CB . 10086 1 844 . 1 1 72 72 SER N N 15 117.699 0.300 . 1 . . . . 72 SER N . 10086 1 845 . 1 1 73 73 LYS HA H 1 4.227 0.030 . 1 . . . . 73 LYS HA . 10086 1 846 . 1 1 73 73 LYS HB2 H 1 1.848 0.030 . 1 . . . . 73 LYS HB2 . 10086 1 847 . 1 1 73 73 LYS HB3 H 1 1.848 0.030 . 1 . . . . 73 LYS HB3 . 10086 1 848 . 1 1 73 73 LYS HG2 H 1 1.495 0.030 . 2 . . . . 73 LYS HG2 . 10086 1 849 . 1 1 73 73 LYS HG3 H 1 1.429 0.030 . 2 . . . . 73 LYS HG3 . 10086 1 850 . 1 1 73 73 LYS HD2 H 1 1.657 0.030 . 2 . . . . 73 LYS HD2 . 10086 1 851 . 1 1 73 73 LYS HD3 H 1 1.622 0.030 . 2 . . . . 73 LYS HD3 . 10086 1 852 . 1 1 73 73 LYS HE2 H 1 2.896 0.030 . 1 . . . . 73 LYS HE2 . 10086 1 853 . 1 1 73 73 LYS HE3 H 1 2.896 0.030 . 1 . . . . 73 LYS HE3 . 10086 1 854 . 1 1 73 73 LYS CA C 13 57.469 0.300 . 1 . . . . 73 LYS CA . 10086 1 855 . 1 1 73 73 LYS CB C 13 31.933 0.300 . 1 . . . . 73 LYS CB . 10086 1 856 . 1 1 73 73 LYS CG C 13 24.723 0.300 . 1 . . . . 73 LYS CG . 10086 1 857 . 1 1 73 73 LYS CD C 13 28.343 0.300 . 1 . . . . 73 LYS CD . 10086 1 858 . 1 1 73 73 LYS CE C 13 41.897 0.300 . 1 . . . . 73 LYS CE . 10086 1 859 . 1 1 74 74 SER HA H 1 4.287 0.030 . 1 . . . . 74 SER HA . 10086 1 860 . 1 1 74 74 SER HB2 H 1 3.944 0.030 . 2 . . . . 74 SER HB2 . 10086 1 861 . 1 1 74 74 SER HB3 H 1 3.884 0.030 . 2 . . . . 74 SER HB3 . 10086 1 862 . 1 1 74 74 SER CB C 13 63.269 0.300 . 1 . . . . 74 SER CB . 10086 1 863 . 1 1 75 75 LEU H H 1 8.100 0.030 . 1 . . . . 75 LEU H . 10086 1 864 . 1 1 75 75 LEU HA H 1 4.220 0.030 . 1 . . . . 75 LEU HA . 10086 1 865 . 1 1 75 75 LEU HB2 H 1 1.759 0.030 . 2 . . . . 75 LEU HB2 . 10086 1 866 . 1 1 75 75 LEU HB3 H 1 1.630 0.030 . 2 . . . . 75 LEU HB3 . 10086 1 867 . 1 1 75 75 LEU HG H 1 1.689 0.030 . 1 . . . . 75 LEU HG . 10086 1 868 . 1 1 75 75 LEU HD11 H 1 0.864 0.030 . 1 . . . . 75 LEU HD1 . 10086 1 869 . 1 1 75 75 LEU HD12 H 1 0.864 0.030 . 1 . . . . 75 LEU HD1 . 10086 1 870 . 1 1 75 75 LEU HD13 H 1 0.864 0.030 . 1 . . . . 75 LEU HD1 . 10086 1 871 . 1 1 75 75 LEU HD21 H 1 0.841 0.030 . 1 . . . . 75 LEU HD2 . 10086 1 872 . 1 1 75 75 LEU HD22 H 1 0.841 0.030 . 1 . . . . 75 LEU HD2 . 10086 1 873 . 1 1 75 75 LEU HD23 H 1 0.841 0.030 . 1 . . . . 75 LEU HD2 . 10086 1 874 . 1 1 75 75 LEU CA C 13 56.527 0.300 . 1 . . . . 75 LEU CA . 10086 1 875 . 1 1 75 75 LEU CB C 13 41.875 0.300 . 1 . . . . 75 LEU CB . 10086 1 876 . 1 1 75 75 LEU CG C 13 27.057 0.300 . 1 . . . . 75 LEU CG . 10086 1 877 . 1 1 75 75 LEU CD1 C 13 25.161 0.300 . 2 . . . . 75 LEU CD1 . 10086 1 878 . 1 1 75 75 LEU CD2 C 13 23.262 0.300 . 2 . . . . 75 LEU CD2 . 10086 1 879 . 1 1 75 75 LEU N N 15 119.512 0.300 . 1 . . . . 75 LEU N . 10086 1 880 . 1 1 76 76 GLU HA H 1 4.217 0.030 . 1 . . . . 76 GLU HA . 10086 1 881 . 1 1 76 76 GLU HB2 H 1 2.080 0.030 . 1 . . . . 76 GLU HB2 . 10086 1 882 . 1 1 76 76 GLU HB3 H 1 2.080 0.030 . 1 . . . . 76 GLU HB3 . 10086 1 883 . 1 1 76 76 GLU HG2 H 1 2.371 0.030 . 1 . . . . 76 GLU HG2 . 10086 1 884 . 1 1 76 76 GLU HG3 H 1 2.371 0.030 . 1 . . . . 76 GLU HG3 . 10086 1 885 . 1 1 76 76 GLU CA C 13 58.108 0.300 . 1 . . . . 76 GLU CA . 10086 1 886 . 1 1 76 76 GLU CB C 13 29.988 0.300 . 1 . . . . 76 GLU CB . 10086 1 887 . 1 1 76 76 GLU CG C 13 36.464 0.300 . 1 . . . . 76 GLU CG . 10086 1 888 . 1 1 77 77 ALA H H 1 8.006 0.030 . 1 . . . . 77 ALA H . 10086 1 889 . 1 1 77 77 ALA HA H 1 4.382 0.030 . 1 . . . . 77 ALA HA . 10086 1 890 . 1 1 77 77 ALA HB1 H 1 1.418 0.030 . 1 . . . . 77 ALA HB . 10086 1 891 . 1 1 77 77 ALA HB2 H 1 1.418 0.030 . 1 . . . . 77 ALA HB . 10086 1 892 . 1 1 77 77 ALA HB3 H 1 1.418 0.030 . 1 . . . . 77 ALA HB . 10086 1 893 . 1 1 77 77 ALA C C 13 177.720 0.300 . 1 . . . . 77 ALA C . 10086 1 894 . 1 1 77 77 ALA CA C 13 52.896 0.300 . 1 . . . . 77 ALA CA . 10086 1 895 . 1 1 77 77 ALA CB C 13 18.956 0.300 . 1 . . . . 77 ALA CB . 10086 1 896 . 1 1 78 78 SER H H 1 8.034 0.030 . 1 . . . . 78 SER H . 10086 1 897 . 1 1 78 78 SER HA H 1 4.506 0.030 . 1 . . . . 78 SER HA . 10086 1 898 . 1 1 78 78 SER HB2 H 1 3.934 0.030 . 1 . . . . 78 SER HB2 . 10086 1 899 . 1 1 78 78 SER HB3 H 1 3.934 0.030 . 1 . . . . 78 SER HB3 . 10086 1 900 . 1 1 78 78 SER C C 13 174.188 0.300 . 1 . . . . 78 SER C . 10086 1 901 . 1 1 78 78 SER CA C 13 58.621 0.300 . 1 . . . . 78 SER CA . 10086 1 902 . 1 1 78 78 SER CB C 13 63.800 0.300 . 1 . . . . 78 SER CB . 10086 1 903 . 1 1 78 78 SER N N 15 112.438 0.300 . 1 . . . . 78 SER N . 10086 1 904 . 1 1 79 79 GLY HA2 H 1 4.007 0.030 . 2 . . . . 79 GLY HA2 . 10086 1 905 . 1 1 79 79 GLY HA3 H 1 3.539 0.030 . 2 . . . . 79 GLY HA3 . 10086 1 906 . 1 1 79 79 GLY C C 13 172.111 0.300 . 1 . . . . 79 GLY C . 10086 1 907 . 1 1 79 79 GLY CA C 13 45.416 0.300 . 1 . . . . 79 GLY CA . 10086 1 908 . 1 1 80 80 ARG H H 1 8.144 0.030 . 1 . . . . 80 ARG H . 10086 1 909 . 1 1 80 80 ARG HA H 1 4.596 0.030 . 1 . . . . 80 ARG HA . 10086 1 910 . 1 1 80 80 ARG HB2 H 1 1.511 0.030 . 2 . . . . 80 ARG HB2 . 10086 1 911 . 1 1 80 80 ARG HB3 H 1 1.414 0.030 . 2 . . . . 80 ARG HB3 . 10086 1 912 . 1 1 80 80 ARG HG2 H 1 1.434 0.030 . 2 . . . . 80 ARG HG2 . 10086 1 913 . 1 1 80 80 ARG HG3 H 1 1.266 0.030 . 2 . . . . 80 ARG HG3 . 10086 1 914 . 1 1 80 80 ARG HD2 H 1 2.709 0.030 . 2 . . . . 80 ARG HD2 . 10086 1 915 . 1 1 80 80 ARG HD3 H 1 2.596 0.030 . 2 . . . . 80 ARG HD3 . 10086 1 916 . 1 1 80 80 ARG C C 13 174.582 0.300 . 1 . . . . 80 ARG C . 10086 1 917 . 1 1 80 80 ARG CA C 13 55.055 0.300 . 1 . . . . 80 ARG CA . 10086 1 918 . 1 1 80 80 ARG CB C 13 35.561 0.300 . 1 . . . . 80 ARG CB . 10086 1 919 . 1 1 80 80 ARG CG C 13 27.327 0.300 . 1 . . . . 80 ARG CG . 10086 1 920 . 1 1 80 80 ARG CD C 13 43.340 0.300 . 1 . . . . 80 ARG CD . 10086 1 921 . 1 1 80 80 ARG N N 15 119.894 0.300 . 1 . . . . 80 ARG N . 10086 1 922 . 1 1 81 81 ILE H H 1 8.999 0.030 . 1 . . . . 81 ILE H . 10086 1 923 . 1 1 81 81 ILE HA H 1 4.783 0.030 . 1 . . . . 81 ILE HA . 10086 1 924 . 1 1 81 81 ILE HB H 1 2.029 0.030 . 1 . . . . 81 ILE HB . 10086 1 925 . 1 1 81 81 ILE HG12 H 1 1.545 0.030 . 2 . . . . 81 ILE HG12 . 10086 1 926 . 1 1 81 81 ILE HG13 H 1 1.144 0.030 . 2 . . . . 81 ILE HG13 . 10086 1 927 . 1 1 81 81 ILE HG21 H 1 0.873 0.030 . 1 . . . . 81 ILE HG2 . 10086 1 928 . 1 1 81 81 ILE HG22 H 1 0.873 0.030 . 1 . . . . 81 ILE HG2 . 10086 1 929 . 1 1 81 81 ILE HG23 H 1 0.873 0.030 . 1 . . . . 81 ILE HG2 . 10086 1 930 . 1 1 81 81 ILE HD11 H 1 0.767 0.030 . 1 . . . . 81 ILE HD1 . 10086 1 931 . 1 1 81 81 ILE HD12 H 1 0.767 0.030 . 1 . . . . 81 ILE HD1 . 10086 1 932 . 1 1 81 81 ILE HD13 H 1 0.767 0.030 . 1 . . . . 81 ILE HD1 . 10086 1 933 . 1 1 81 81 ILE C C 13 174.592 0.300 . 1 . . . . 81 ILE C . 10086 1 934 . 1 1 81 81 ILE CA C 13 59.964 0.300 . 1 . . . . 81 ILE CA . 10086 1 935 . 1 1 81 81 ILE CB C 13 38.183 0.300 . 1 . . . . 81 ILE CB . 10086 1 936 . 1 1 81 81 ILE CG1 C 13 27.543 0.300 . 1 . . . . 81 ILE CG1 . 10086 1 937 . 1 1 81 81 ILE CG2 C 13 19.572 0.300 . 1 . . . . 81 ILE CG2 . 10086 1 938 . 1 1 81 81 ILE CD1 C 13 12.273 0.300 . 1 . . . . 81 ILE CD1 . 10086 1 939 . 1 1 81 81 ILE N N 15 122.573 0.300 . 1 . . . . 81 ILE N . 10086 1 940 . 1 1 82 82 TYR H H 1 9.529 0.030 . 1 . . . . 82 TYR H . 10086 1 941 . 1 1 82 82 TYR HA H 1 5.703 0.030 . 1 . . . . 82 TYR HA . 10086 1 942 . 1 1 82 82 TYR HB2 H 1 2.958 0.030 . 2 . . . . 82 TYR HB2 . 10086 1 943 . 1 1 82 82 TYR HB3 H 1 2.781 0.030 . 2 . . . . 82 TYR HB3 . 10086 1 944 . 1 1 82 82 TYR HD1 H 1 7.042 0.030 . 1 . . . . 82 TYR HD1 . 10086 1 945 . 1 1 82 82 TYR HD2 H 1 7.042 0.030 . 1 . . . . 82 TYR HD2 . 10086 1 946 . 1 1 82 82 TYR HE1 H 1 6.458 0.030 . 1 . . . . 82 TYR HE1 . 10086 1 947 . 1 1 82 82 TYR HE2 H 1 6.458 0.030 . 1 . . . . 82 TYR HE2 . 10086 1 948 . 1 1 82 82 TYR C C 13 175.725 0.300 . 1 . . . . 82 TYR C . 10086 1 949 . 1 1 82 82 TYR CA C 13 56.301 0.300 . 1 . . . . 82 TYR CA . 10086 1 950 . 1 1 82 82 TYR CB C 13 43.479 0.300 . 1 . . . . 82 TYR CB . 10086 1 951 . 1 1 82 82 TYR CD1 C 13 133.812 0.300 . 1 . . . . 82 TYR CD1 . 10086 1 952 . 1 1 82 82 TYR CD2 C 13 133.812 0.300 . 1 . . . . 82 TYR CD2 . 10086 1 953 . 1 1 82 82 TYR CE1 C 13 118.653 0.300 . 1 . . . . 82 TYR CE1 . 10086 1 954 . 1 1 82 82 TYR CE2 C 13 118.653 0.300 . 1 . . . . 82 TYR CE2 . 10086 1 955 . 1 1 82 82 TYR N N 15 125.631 0.300 . 1 . . . . 82 TYR N . 10086 1 956 . 1 1 83 83 VAL H H 1 8.563 0.030 . 1 . . . . 83 VAL H . 10086 1 957 . 1 1 83 83 VAL HA H 1 5.327 0.030 . 1 . . . . 83 VAL HA . 10086 1 958 . 1 1 83 83 VAL HB H 1 1.730 0.030 . 1 . . . . 83 VAL HB . 10086 1 959 . 1 1 83 83 VAL HG11 H 1 1.011 0.030 . 1 . . . . 83 VAL HG1 . 10086 1 960 . 1 1 83 83 VAL HG12 H 1 1.011 0.030 . 1 . . . . 83 VAL HG1 . 10086 1 961 . 1 1 83 83 VAL HG13 H 1 1.011 0.030 . 1 . . . . 83 VAL HG1 . 10086 1 962 . 1 1 83 83 VAL HG21 H 1 0.939 0.030 . 1 . . . . 83 VAL HG2 . 10086 1 963 . 1 1 83 83 VAL HG22 H 1 0.939 0.030 . 1 . . . . 83 VAL HG2 . 10086 1 964 . 1 1 83 83 VAL HG23 H 1 0.939 0.030 . 1 . . . . 83 VAL HG2 . 10086 1 965 . 1 1 83 83 VAL C C 13 172.791 0.300 . 1 . . . . 83 VAL C . 10086 1 966 . 1 1 83 83 VAL CA C 13 58.756 0.300 . 1 . . . . 83 VAL CA . 10086 1 967 . 1 1 83 83 VAL CB C 13 34.021 0.300 . 1 . . . . 83 VAL CB . 10086 1 968 . 1 1 83 83 VAL CG1 C 13 23.892 0.300 . 2 . . . . 83 VAL CG1 . 10086 1 969 . 1 1 83 83 VAL CG2 C 13 19.962 0.300 . 2 . . . . 83 VAL CG2 . 10086 1 970 . 1 1 83 83 VAL N N 15 117.030 0.300 . 1 . . . . 83 VAL N . 10086 1 971 . 1 1 84 84 TYR H H 1 9.366 0.030 . 1 . . . . 84 TYR H . 10086 1 972 . 1 1 84 84 TYR HA H 1 4.967 0.030 . 1 . . . . 84 TYR HA . 10086 1 973 . 1 1 84 84 TYR HB2 H 1 2.837 0.030 . 2 . . . . 84 TYR HB2 . 10086 1 974 . 1 1 84 84 TYR HB3 H 1 2.778 0.030 . 2 . . . . 84 TYR HB3 . 10086 1 975 . 1 1 84 84 TYR HD1 H 1 6.829 0.030 . 1 . . . . 84 TYR HD1 . 10086 1 976 . 1 1 84 84 TYR HD2 H 1 6.829 0.030 . 1 . . . . 84 TYR HD2 . 10086 1 977 . 1 1 84 84 TYR HE1 H 1 6.467 0.030 . 1 . . . . 84 TYR HE1 . 10086 1 978 . 1 1 84 84 TYR HE2 H 1 6.467 0.030 . 1 . . . . 84 TYR HE2 . 10086 1 979 . 1 1 84 84 TYR C C 13 174.297 0.300 . 1 . . . . 84 TYR C . 10086 1 980 . 1 1 84 84 TYR CA C 13 54.842 0.300 . 1 . . . . 84 TYR CA . 10086 1 981 . 1 1 84 84 TYR CB C 13 42.015 0.300 . 1 . . . . 84 TYR CB . 10086 1 982 . 1 1 84 84 TYR CD1 C 13 131.419 0.300 . 1 . . . . 84 TYR CD1 . 10086 1 983 . 1 1 84 84 TYR CD2 C 13 131.419 0.300 . 1 . . . . 84 TYR CD2 . 10086 1 984 . 1 1 84 84 TYR CE1 C 13 117.476 0.300 . 1 . . . . 84 TYR CE1 . 10086 1 985 . 1 1 84 84 TYR CE2 C 13 117.476 0.300 . 1 . . . . 84 TYR CE2 . 10086 1 986 . 1 1 84 84 TYR N N 15 129.088 0.300 . 1 . . . . 84 TYR N . 10086 1 987 . 1 1 85 85 ARG H H 1 8.687 0.030 . 1 . . . . 85 ARG H . 10086 1 988 . 1 1 85 85 ARG HA H 1 4.938 0.030 . 1 . . . . 85 ARG HA . 10086 1 989 . 1 1 85 85 ARG HB2 H 1 1.579 0.030 . 2 . . . . 85 ARG HB2 . 10086 1 990 . 1 1 85 85 ARG HB3 H 1 1.446 0.030 . 2 . . . . 85 ARG HB3 . 10086 1 991 . 1 1 85 85 ARG HG2 H 1 1.174 0.030 . 2 . . . . 85 ARG HG2 . 10086 1 992 . 1 1 85 85 ARG HG3 H 1 1.103 0.030 . 2 . . . . 85 ARG HG3 . 10086 1 993 . 1 1 85 85 ARG HD2 H 1 2.713 0.030 . 2 . . . . 85 ARG HD2 . 10086 1 994 . 1 1 85 85 ARG HD3 H 1 2.609 0.030 . 2 . . . . 85 ARG HD3 . 10086 1 995 . 1 1 85 85 ARG C C 13 176.580 0.300 . 1 . . . . 85 ARG C . 10086 1 996 . 1 1 85 85 ARG CA C 13 54.691 0.300 . 1 . . . . 85 ARG CA . 10086 1 997 . 1 1 85 85 ARG CB C 13 32.173 0.300 . 1 . . . . 85 ARG CB . 10086 1 998 . 1 1 85 85 ARG CG C 13 26.784 0.300 . 1 . . . . 85 ARG CG . 10086 1 999 . 1 1 85 85 ARG CD C 13 43.341 0.300 . 1 . . . . 85 ARG CD . 10086 1 1000 . 1 1 85 85 ARG N N 15 117.260 0.300 . 1 . . . . 85 ARG N . 10086 1 1001 . 1 1 86 86 LYS H H 1 8.635 0.030 . 1 . . . . 86 LYS H . 10086 1 1002 . 1 1 86 86 LYS HA H 1 4.496 0.030 . 1 . . . . 86 LYS HA . 10086 1 1003 . 1 1 86 86 LYS HB2 H 1 1.792 0.030 . 2 . . . . 86 LYS HB2 . 10086 1 1004 . 1 1 86 86 LYS HB3 H 1 1.514 0.030 . 2 . . . . 86 LYS HB3 . 10086 1 1005 . 1 1 86 86 LYS HG2 H 1 1.324 0.030 . 2 . . . . 86 LYS HG2 . 10086 1 1006 . 1 1 86 86 LYS HG3 H 1 1.191 0.030 . 2 . . . . 86 LYS HG3 . 10086 1 1007 . 1 1 86 86 LYS HD2 H 1 1.673 0.030 . 1 . . . . 86 LYS HD2 . 10086 1 1008 . 1 1 86 86 LYS HD3 H 1 1.673 0.030 . 1 . . . . 86 LYS HD3 . 10086 1 1009 . 1 1 86 86 LYS HE2 H 1 2.941 0.030 . 1 . . . . 86 LYS HE2 . 10086 1 1010 . 1 1 86 86 LYS HE3 H 1 2.941 0.030 . 1 . . . . 86 LYS HE3 . 10086 1 1011 . 1 1 86 86 LYS CB C 13 33.773 0.300 . 1 . . . . 86 LYS CB . 10086 1 1012 . 1 1 86 86 LYS CG C 13 25.326 0.300 . 1 . . . . 86 LYS CG . 10086 1 1013 . 1 1 86 86 LYS CD C 13 29.487 0.300 . 1 . . . . 86 LYS CD . 10086 1 1014 . 1 1 86 86 LYS CE C 13 41.945 0.300 . 1 . . . . 86 LYS CE . 10086 1 1015 . 1 1 86 86 LYS N N 15 124.726 0.300 . 1 . . . . 86 LYS N . 10086 1 1016 . 1 1 87 87 ASP H H 1 8.589 0.030 . 1 . . . . 87 ASP H . 10086 1 1017 . 1 1 87 87 ASP HA H 1 4.679 0.030 . 1 . . . . 87 ASP HA . 10086 1 1018 . 1 1 87 87 ASP HB2 H 1 2.884 0.030 . 2 . . . . 87 ASP HB2 . 10086 1 1019 . 1 1 87 87 ASP HB3 H 1 2.688 0.030 . 2 . . . . 87 ASP HB3 . 10086 1 1020 . 1 1 87 87 ASP C C 13 176.730 0.300 . 1 . . . . 87 ASP C . 10086 1 1021 . 1 1 87 87 ASP CA C 13 53.368 0.300 . 1 . . . . 87 ASP CA . 10086 1 1022 . 1 1 87 87 ASP CB C 13 41.594 0.300 . 1 . . . . 87 ASP CB . 10086 1 1023 . 1 1 87 87 ASP N N 15 122.565 0.300 . 1 . . . . 87 ASP N . 10086 1 1024 . 1 1 88 88 LEU H H 1 8.045 0.030 . 1 . . . . 88 LEU H . 10086 1 1025 . 1 1 88 88 LEU HA H 1 4.282 0.030 . 1 . . . . 88 LEU HA . 10086 1 1026 . 1 1 88 88 LEU HB2 H 1 1.702 0.030 . 2 . . . . 88 LEU HB2 . 10086 1 1027 . 1 1 88 88 LEU HB3 H 1 1.599 0.030 . 2 . . . . 88 LEU HB3 . 10086 1 1028 . 1 1 88 88 LEU HG H 1 1.658 0.030 . 1 . . . . 88 LEU HG . 10086 1 1029 . 1 1 88 88 LEU HD11 H 1 0.908 0.030 . 1 . . . . 88 LEU HD1 . 10086 1 1030 . 1 1 88 88 LEU HD12 H 1 0.908 0.030 . 1 . . . . 88 LEU HD1 . 10086 1 1031 . 1 1 88 88 LEU HD13 H 1 0.908 0.030 . 1 . . . . 88 LEU HD1 . 10086 1 1032 . 1 1 88 88 LEU HD21 H 1 0.883 0.030 . 1 . . . . 88 LEU HD2 . 10086 1 1033 . 1 1 88 88 LEU HD22 H 1 0.883 0.030 . 1 . . . . 88 LEU HD2 . 10086 1 1034 . 1 1 88 88 LEU HD23 H 1 0.883 0.030 . 1 . . . . 88 LEU HD2 . 10086 1 1035 . 1 1 88 88 LEU C C 13 177.239 0.300 . 1 . . . . 88 LEU C . 10086 1 1036 . 1 1 88 88 LEU CA C 13 55.860 0.300 . 1 . . . . 88 LEU CA . 10086 1 1037 . 1 1 88 88 LEU CB C 13 42.012 0.300 . 1 . . . . 88 LEU CB . 10086 1 1038 . 1 1 88 88 LEU CG C 13 26.994 0.300 . 1 . . . . 88 LEU CG . 10086 1 1039 . 1 1 88 88 LEU CD1 C 13 25.144 0.300 . 2 . . . . 88 LEU CD1 . 10086 1 1040 . 1 1 88 88 LEU CD2 C 13 23.340 0.300 . 2 . . . . 88 LEU CD2 . 10086 1 1041 . 1 1 88 88 LEU N N 15 119.201 0.300 . 1 . . . . 88 LEU N . 10086 1 1042 . 1 1 89 89 ALA H H 1 8.250 0.030 . 1 . . . . 89 ALA H . 10086 1 1043 . 1 1 89 89 ALA HA H 1 4.276 0.030 . 1 . . . . 89 ALA HA . 10086 1 1044 . 1 1 89 89 ALA HB1 H 1 1.400 0.030 . 1 . . . . 89 ALA HB . 10086 1 1045 . 1 1 89 89 ALA HB2 H 1 1.400 0.030 . 1 . . . . 89 ALA HB . 10086 1 1046 . 1 1 89 89 ALA HB3 H 1 1.400 0.030 . 1 . . . . 89 ALA HB . 10086 1 1047 . 1 1 89 89 ALA C C 13 176.888 0.300 . 1 . . . . 89 ALA C . 10086 1 1048 . 1 1 89 89 ALA CA C 13 52.502 0.300 . 1 . . . . 89 ALA CA . 10086 1 1049 . 1 1 89 89 ALA CB C 13 18.601 0.300 . 1 . . . . 89 ALA CB . 10086 1 1050 . 1 1 89 89 ALA N N 15 122.962 0.300 . 1 . . . . 89 ALA N . 10086 1 1051 . 1 1 90 90 ASP H H 1 8.306 0.030 . 1 . . . . 90 ASP H . 10086 1 1052 . 1 1 90 90 ASP HA H 1 4.412 0.030 . 1 . . . . 90 ASP HA . 10086 1 1053 . 1 1 90 90 ASP HB2 H 1 2.867 0.030 . 2 . . . . 90 ASP HB2 . 10086 1 1054 . 1 1 90 90 ASP HB3 H 1 2.741 0.030 . 2 . . . . 90 ASP HB3 . 10086 1 1055 . 1 1 90 90 ASP C C 13 175.582 0.300 . 1 . . . . 90 ASP C . 10086 1 1056 . 1 1 90 90 ASP CA C 13 55.219 0.300 . 1 . . . . 90 ASP CA . 10086 1 1057 . 1 1 90 90 ASP CB C 13 40.139 0.300 . 1 . . . . 90 ASP CB . 10086 1 1058 . 1 1 90 90 ASP N N 15 116.137 0.300 . 1 . . . . 90 ASP N . 10086 1 1059 . 1 1 91 91 THR H H 1 7.883 0.030 . 1 . . . . 91 THR H . 10086 1 1060 . 1 1 91 91 THR HA H 1 4.348 0.030 . 1 . . . . 91 THR HA . 10086 1 1061 . 1 1 91 91 THR HB H 1 4.177 0.030 . 1 . . . . 91 THR HB . 10086 1 1062 . 1 1 91 91 THR HG21 H 1 1.152 0.030 . 1 . . . . 91 THR HG2 . 10086 1 1063 . 1 1 91 91 THR HG22 H 1 1.152 0.030 . 1 . . . . 91 THR HG2 . 10086 1 1064 . 1 1 91 91 THR HG23 H 1 1.152 0.030 . 1 . . . . 91 THR HG2 . 10086 1 1065 . 1 1 91 91 THR C C 13 173.748 0.300 . 1 . . . . 91 THR C . 10086 1 1066 . 1 1 91 91 THR CA C 13 61.728 0.300 . 1 . . . . 91 THR CA . 10086 1 1067 . 1 1 91 91 THR CB C 13 70.255 0.300 . 1 . . . . 91 THR CB . 10086 1 1068 . 1 1 91 91 THR CG2 C 13 21.745 0.300 . 1 . . . . 91 THR CG2 . 10086 1 1069 . 1 1 91 91 THR N N 15 113.142 0.300 . 1 . . . . 91 THR N . 10086 1 1070 . 1 1 92 92 LEU H H 1 8.371 0.030 . 1 . . . . 92 LEU H . 10086 1 1071 . 1 1 92 92 LEU HA H 1 4.686 0.030 . 1 . . . . 92 LEU HA . 10086 1 1072 . 1 1 92 92 LEU HB2 H 1 1.684 0.030 . 2 . . . . 92 LEU HB2 . 10086 1 1073 . 1 1 92 92 LEU HB3 H 1 1.369 0.030 . 2 . . . . 92 LEU HB3 . 10086 1 1074 . 1 1 92 92 LEU HG H 1 1.568 0.030 . 1 . . . . 92 LEU HG . 10086 1 1075 . 1 1 92 92 LEU HD11 H 1 0.690 0.030 . 1 . . . . 92 LEU HD1 . 10086 1 1076 . 1 1 92 92 LEU HD12 H 1 0.690 0.030 . 1 . . . . 92 LEU HD1 . 10086 1 1077 . 1 1 92 92 LEU HD13 H 1 0.690 0.030 . 1 . . . . 92 LEU HD1 . 10086 1 1078 . 1 1 92 92 LEU HD21 H 1 0.644 0.030 . 1 . . . . 92 LEU HD2 . 10086 1 1079 . 1 1 92 92 LEU HD22 H 1 0.644 0.030 . 1 . . . . 92 LEU HD2 . 10086 1 1080 . 1 1 92 92 LEU HD23 H 1 0.644 0.030 . 1 . . . . 92 LEU HD2 . 10086 1 1081 . 1 1 92 92 LEU C C 13 176.409 0.300 . 1 . . . . 92 LEU C . 10086 1 1082 . 1 1 92 92 LEU CA C 13 54.432 0.300 . 1 . . . . 92 LEU CA . 10086 1 1083 . 1 1 92 92 LEU CB C 13 43.348 0.300 . 1 . . . . 92 LEU CB . 10086 1 1084 . 1 1 92 92 LEU CG C 13 27.007 0.300 . 1 . . . . 92 LEU CG . 10086 1 1085 . 1 1 92 92 LEU CD1 C 13 25.186 0.300 . 2 . . . . 92 LEU CD1 . 10086 1 1086 . 1 1 92 92 LEU CD2 C 13 23.989 0.300 . 2 . . . . 92 LEU CD2 . 10086 1 1087 . 1 1 92 92 LEU N N 15 123.738 0.300 . 1 . . . . 92 LEU N . 10086 1 1088 . 1 1 93 93 ASN HA H 1 5.044 0.030 . 1 . . . . 93 ASN HA . 10086 1 1089 . 1 1 93 93 ASN HB2 H 1 2.567 0.030 . 2 . . . . 93 ASN HB2 . 10086 1 1090 . 1 1 93 93 ASN HB3 H 1 2.419 0.030 . 2 . . . . 93 ASN HB3 . 10086 1 1091 . 1 1 93 93 ASN HD21 H 1 7.497 0.030 . 2 . . . . 93 ASN HD21 . 10086 1 1092 . 1 1 93 93 ASN HD22 H 1 6.813 0.030 . 2 . . . . 93 ASN HD22 . 10086 1 1093 . 1 1 93 93 ASN CA C 13 50.836 0.300 . 1 . . . . 93 ASN CA . 10086 1 1094 . 1 1 93 93 ASN CB C 13 41.395 0.300 . 1 . . . . 93 ASN CB . 10086 1 1095 . 1 1 93 93 ASN ND2 N 15 114.253 0.300 . 1 . . . . 93 ASN ND2 . 10086 1 1096 . 1 1 94 94 PRO HA H 1 3.808 0.030 . 1 . . . . 94 PRO HA . 10086 1 1097 . 1 1 94 94 PRO HB2 H 1 1.662 0.030 . 2 . . . . 94 PRO HB2 . 10086 1 1098 . 1 1 94 94 PRO HB3 H 1 1.875 0.030 . 2 . . . . 94 PRO HB3 . 10086 1 1099 . 1 1 94 94 PRO HG2 H 1 1.684 0.030 . 1 . . . . 94 PRO HG2 . 10086 1 1100 . 1 1 94 94 PRO HG3 H 1 1.684 0.030 . 1 . . . . 94 PRO HG3 . 10086 1 1101 . 1 1 94 94 PRO HD2 H 1 3.521 0.030 . 2 . . . . 94 PRO HD2 . 10086 1 1102 . 1 1 94 94 PRO HD3 H 1 3.390 0.030 . 2 . . . . 94 PRO HD3 . 10086 1 1103 . 1 1 94 94 PRO CA C 13 62.200 0.300 . 1 . . . . 94 PRO CA . 10086 1 1104 . 1 1 94 94 PRO CB C 13 31.986 0.300 . 1 . . . . 94 PRO CB . 10086 1 1105 . 1 1 94 94 PRO CG C 13 26.541 0.300 . 1 . . . . 94 PRO CG . 10086 1 1106 . 1 1 94 94 PRO CD C 13 50.154 0.300 . 1 . . . . 94 PRO CD . 10086 1 1107 . 1 1 95 95 PHE HA H 1 4.206 0.030 . 1 . . . . 95 PHE HA . 10086 1 1108 . 1 1 95 95 PHE HB2 H 1 3.091 0.030 . 2 . . . . 95 PHE HB2 . 10086 1 1109 . 1 1 95 95 PHE HB3 H 1 3.011 0.030 . 2 . . . . 95 PHE HB3 . 10086 1 1110 . 1 1 95 95 PHE HD1 H 1 7.311 0.030 . 1 . . . . 95 PHE HD1 . 10086 1 1111 . 1 1 95 95 PHE HD2 H 1 7.311 0.030 . 1 . . . . 95 PHE HD2 . 10086 1 1112 . 1 1 95 95 PHE HE1 H 1 6.906 0.030 . 1 . . . . 95 PHE HE1 . 10086 1 1113 . 1 1 95 95 PHE HE2 H 1 6.906 0.030 . 1 . . . . 95 PHE HE2 . 10086 1 1114 . 1 1 95 95 PHE HZ H 1 6.509 0.030 . 1 . . . . 95 PHE HZ . 10086 1 1115 . 1 1 95 95 PHE C C 13 175.596 0.300 . 1 . . . . 95 PHE C . 10086 1 1116 . 1 1 95 95 PHE CA C 13 59.505 0.300 . 1 . . . . 95 PHE CA . 10086 1 1117 . 1 1 95 95 PHE CB C 13 39.210 0.300 . 1 . . . . 95 PHE CB . 10086 1 1118 . 1 1 95 95 PHE CD1 C 13 131.757 0.300 . 1 . . . . 95 PHE CD1 . 10086 1 1119 . 1 1 95 95 PHE CD2 C 13 131.757 0.300 . 1 . . . . 95 PHE CD2 . 10086 1 1120 . 1 1 95 95 PHE CE1 C 13 130.946 0.300 . 1 . . . . 95 PHE CE1 . 10086 1 1121 . 1 1 95 95 PHE CE2 C 13 130.946 0.300 . 1 . . . . 95 PHE CE2 . 10086 1 1122 . 1 1 95 95 PHE CZ C 13 129.316 0.300 . 1 . . . . 95 PHE CZ . 10086 1 1123 . 1 1 96 96 ALA H H 1 8.140 0.030 . 1 . . . . 96 ALA H . 10086 1 1124 . 1 1 96 96 ALA HA H 1 4.357 0.030 . 1 . . . . 96 ALA HA . 10086 1 1125 . 1 1 96 96 ALA HB1 H 1 1.392 0.030 . 1 . . . . 96 ALA HB . 10086 1 1126 . 1 1 96 96 ALA HB2 H 1 1.392 0.030 . 1 . . . . 96 ALA HB . 10086 1 1127 . 1 1 96 96 ALA HB3 H 1 1.392 0.030 . 1 . . . . 96 ALA HB . 10086 1 1128 . 1 1 96 96 ALA C C 13 177.425 0.300 . 1 . . . . 96 ALA C . 10086 1 1129 . 1 1 96 96 ALA CA C 13 51.877 0.300 . 1 . . . . 96 ALA CA . 10086 1 1130 . 1 1 96 96 ALA CB C 13 20.116 0.300 . 1 . . . . 96 ALA CB . 10086 1 1131 . 1 1 96 96 ALA N N 15 123.012 0.300 . 1 . . . . 96 ALA N . 10086 1 1132 . 1 1 97 97 GLU H H 1 8.479 0.030 . 1 . . . . 97 GLU H . 10086 1 1133 . 1 1 97 97 GLU HA H 1 4.232 0.030 . 1 . . . . 97 GLU HA . 10086 1 1134 . 1 1 97 97 GLU HB2 H 1 2.086 0.030 . 2 . . . . 97 GLU HB2 . 10086 1 1135 . 1 1 97 97 GLU HB3 H 1 1.972 0.030 . 2 . . . . 97 GLU HB3 . 10086 1 1136 . 1 1 97 97 GLU HG2 H 1 2.317 0.030 . 1 . . . . 97 GLU HG2 . 10086 1 1137 . 1 1 97 97 GLU HG3 H 1 2.317 0.030 . 1 . . . . 97 GLU HG3 . 10086 1 1138 . 1 1 97 97 GLU C C 13 176.333 0.300 . 1 . . . . 97 GLU C . 10086 1 1139 . 1 1 97 97 GLU CA C 13 56.863 0.300 . 1 . . . . 97 GLU CA . 10086 1 1140 . 1 1 97 97 GLU CB C 13 30.482 0.300 . 1 . . . . 97 GLU CB . 10086 1 1141 . 1 1 97 97 GLU CG C 13 36.320 0.300 . 1 . . . . 97 GLU CG . 10086 1 1142 . 1 1 97 97 GLU N N 15 119.915 0.300 . 1 . . . . 97 GLU N . 10086 1 1143 . 1 1 98 98 ASN H H 1 8.593 0.030 . 1 . . . . 98 ASN H . 10086 1 1144 . 1 1 98 98 ASN HA H 1 4.773 0.030 . 1 . . . . 98 ASN HA . 10086 1 1145 . 1 1 98 98 ASN HB2 H 1 2.883 0.030 . 2 . . . . 98 ASN HB2 . 10086 1 1146 . 1 1 98 98 ASN HB3 H 1 2.824 0.030 . 2 . . . . 98 ASN HB3 . 10086 1 1147 . 1 1 98 98 ASN HD21 H 1 7.628 0.030 . 2 . . . . 98 ASN HD21 . 10086 1 1148 . 1 1 98 98 ASN HD22 H 1 6.908 0.030 . 2 . . . . 98 ASN HD22 . 10086 1 1149 . 1 1 98 98 ASN C C 13 175.149 0.300 . 1 . . . . 98 ASN C . 10086 1 1150 . 1 1 98 98 ASN CA C 13 53.368 0.300 . 1 . . . . 98 ASN CA . 10086 1 1151 . 1 1 98 98 ASN CB C 13 38.864 0.300 . 1 . . . . 98 ASN CB . 10086 1 1152 . 1 1 98 98 ASN N N 15 119.226 0.300 . 1 . . . . 98 ASN N . 10086 1 1153 . 1 1 98 98 ASN ND2 N 15 112.980 0.300 . 1 . . . . 98 ASN ND2 . 10086 1 1154 . 1 1 99 99 SER H H 1 8.305 0.030 . 1 . . . . 99 SER H . 10086 1 1155 . 1 1 99 99 SER HA H 1 4.505 0.030 . 1 . . . . 99 SER HA . 10086 1 1156 . 1 1 99 99 SER HB2 H 1 3.878 0.030 . 1 . . . . 99 SER HB2 . 10086 1 1157 . 1 1 99 99 SER HB3 H 1 3.878 0.030 . 1 . . . . 99 SER HB3 . 10086 1 1158 . 1 1 99 99 SER C C 13 174.524 0.300 . 1 . . . . 99 SER C . 10086 1 1159 . 1 1 99 99 SER CA C 13 58.414 0.300 . 1 . . . . 99 SER CA . 10086 1 1160 . 1 1 99 99 SER CB C 13 63.967 0.300 . 1 . . . . 99 SER CB . 10086 1 1161 . 1 1 99 99 SER N N 15 116.196 0.300 . 1 . . . . 99 SER N . 10086 1 1162 . 1 1 100 100 GLY H H 1 8.320 0.030 . 1 . . . . 100 GLY H . 10086 1 1163 . 1 1 100 100 GLY HA2 H 1 4.138 0.030 . 2 . . . . 100 GLY HA2 . 10086 1 1164 . 1 1 100 100 GLY HA3 H 1 4.081 0.030 . 2 . . . . 100 GLY HA3 . 10086 1 1165 . 1 1 100 100 GLY C C 13 171.803 0.300 . 1 . . . . 100 GLY C . 10086 1 1166 . 1 1 100 100 GLY CA C 13 44.704 0.300 . 1 . . . . 100 GLY CA . 10086 1 1167 . 1 1 100 100 GLY N N 15 110.632 0.300 . 1 . . . . 100 GLY N . 10086 1 1168 . 1 1 101 101 PRO HA H 1 4.483 0.030 . 1 . . . . 101 PRO HA . 10086 1 1169 . 1 1 101 101 PRO HB2 H 1 2.276 0.030 . 2 . . . . 101 PRO HB2 . 10086 1 1170 . 1 1 101 101 PRO HB3 H 1 1.963 0.030 . 2 . . . . 101 PRO HB3 . 10086 1 1171 . 1 1 101 101 PRO HG2 H 1 1.964 0.030 . 1 . . . . 101 PRO HG2 . 10086 1 1172 . 1 1 101 101 PRO HG3 H 1 1.964 0.030 . 1 . . . . 101 PRO HG3 . 10086 1 1173 . 1 1 101 101 PRO HD2 H 1 3.581 0.030 . 1 . . . . 101 PRO HD2 . 10086 1 1174 . 1 1 101 101 PRO HD3 H 1 3.581 0.030 . 1 . . . . 101 PRO HD3 . 10086 1 1175 . 1 1 101 101 PRO CA C 13 63.242 0.300 . 1 . . . . 101 PRO CA . 10086 1 1176 . 1 1 101 101 PRO CB C 13 32.167 0.300 . 1 . . . . 101 PRO CB . 10086 1 1177 . 1 1 101 101 PRO CG C 13 27.176 0.300 . 1 . . . . 101 PRO CG . 10086 1 1178 . 1 1 101 101 PRO CD C 13 49.759 0.300 . 1 . . . . 101 PRO CD . 10086 1 1179 . 1 1 103 103 SER HA H 1 4.478 0.030 . 1 . . . . 103 SER HA . 10086 1 1180 . 1 1 103 103 SER HB2 H 1 3.869 0.030 . 1 . . . . 103 SER HB2 . 10086 1 1181 . 1 1 103 103 SER HB3 H 1 3.869 0.030 . 1 . . . . 103 SER HB3 . 10086 1 1182 . 1 1 103 103 SER C C 13 173.967 0.300 . 1 . . . . 103 SER C . 10086 1 1183 . 1 1 103 103 SER CA C 13 58.332 0.300 . 1 . . . . 103 SER CA . 10086 1 1184 . 1 1 103 103 SER CB C 13 63.926 0.300 . 1 . . . . 103 SER CB . 10086 1 1185 . 1 1 104 104 GLY H H 1 8.061 0.030 . 1 . . . . 104 GLY H . 10086 1 1186 . 1 1 104 104 GLY HA2 H 1 3.777 0.030 . 1 . . . . 104 GLY HA2 . 10086 1 1187 . 1 1 104 104 GLY HA3 H 1 3.777 0.030 . 1 . . . . 104 GLY HA3 . 10086 1 1188 . 1 1 104 104 GLY C C 13 179.021 0.300 . 1 . . . . 104 GLY C . 10086 1 1189 . 1 1 104 104 GLY CA C 13 46.240 0.300 . 1 . . . . 104 GLY CA . 10086 1 1190 . 1 1 104 104 GLY N N 15 116.873 0.300 . 1 . . . . 104 GLY N . 10086 1 stop_ save_