################################### # 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_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16742 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_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 '2D 1H-15N HSQC' . . . 16742 1 2 '3D HNCACB' . . . 16742 1 3 '3D CBCA(CO)NH' . . . 16742 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XEASY . . 16742 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 4 4 GLU H H 1 8.174 0.003 . 1 . . . . 4 GLU HN . 16742 1 2 . 1 1 4 4 GLU CA C 13 56.432 0.000 . 1 . . . . 4 GLU CA . 16742 1 3 . 1 1 4 4 GLU CB C 13 30.568 0.000 . 1 . . . . 4 GLU CB . 16742 1 4 . 1 1 4 4 GLU N N 15 121.524 0.009 . 1 . . . . 4 GLU N . 16742 1 5 . 1 1 5 5 THR H H 1 8.298 0.000 . 1 . . . . 5 THR HN . 16742 1 6 . 1 1 5 5 THR CA C 13 61.810 0.000 . 1 . . . . 5 THR CA . 16742 1 7 . 1 1 5 5 THR CB C 13 69.989 0.000 . 1 . . . . 5 THR CB . 16742 1 8 . 1 1 5 5 THR N N 15 116.482 0.014 . 1 . . . . 5 THR N . 16742 1 9 . 1 1 6 6 ALA H H 1 8.341 0.000 . 1 . . . . 6 ALA HN . 16742 1 10 . 1 1 6 6 ALA CA C 13 52.747 0.000 . 1 . . . . 6 ALA CA . 16742 1 11 . 1 1 6 6 ALA CB C 13 19.221 0.000 . 1 . . . . 6 ALA CB . 16742 1 12 . 1 1 6 6 ALA N N 15 126.577 0.005 . 1 . . . . 6 ALA N . 16742 1 13 . 1 1 7 7 ALA H H 1 8.130 0.000 . 1 . . . . 7 ALA HN . 16742 1 14 . 1 1 7 7 ALA CA C 13 52.674 0.000 . 1 . . . . 7 ALA CA . 16742 1 15 . 1 1 7 7 ALA CB C 13 19.221 0.000 . 1 . . . . 7 ALA CB . 16742 1 16 . 1 1 7 7 ALA N N 15 123.049 0.007 . 1 . . . . 7 ALA N . 16742 1 17 . 1 1 8 8 ALA H H 1 8.066 0.001 . 1 . . . . 8 ALA HN . 16742 1 18 . 1 1 8 8 ALA CA C 13 52.747 0.000 . 1 . . . . 8 ALA CA . 16742 1 19 . 1 1 8 8 ALA CB C 13 19.221 0.000 . 1 . . . . 8 ALA CB . 16742 1 20 . 1 1 8 8 ALA N N 15 123.011 0.013 . 1 . . . . 8 ALA N . 16742 1 21 . 1 1 9 9 LYS H H 1 8.017 0.001 . 1 . . . . 9 LYS HN . 16742 1 22 . 1 1 9 9 LYS CA C 13 56.653 0.000 . 1 . . . . 9 LYS CA . 16742 1 23 . 1 1 9 9 LYS CB C 13 33.074 0.000 . 1 . . . . 9 LYS CB . 16742 1 24 . 1 1 9 9 LYS N N 15 119.784 0.007 . 1 . . . . 9 LYS N . 16742 1 25 . 1 1 10 10 PHE H H 1 8.129 0.140 . 1 . . . . 10 PHE HN . 16742 1 26 . 1 1 10 10 PHE CA C 13 57.758 0.000 . 1 . . . . 10 PHE CA . 16742 1 27 . 1 1 10 10 PHE CB C 13 39.263 0.295 . 1 . . . . 10 PHE CB . 16742 1 28 . 1 1 10 10 PHE N N 15 120.032 0.471 . 1 . . . . 10 PHE N . 16742 1 29 . 1 1 15 15 MET H H 1 8.260 0.000 . 1 . . . . 15 MET HN . 16742 1 30 . 1 1 15 15 MET CA C 13 55.547 0.000 . 1 . . . . 15 MET CA . 16742 1 31 . 1 1 15 15 MET CB C 13 33.221 0.000 . 1 . . . . 15 MET CB . 16742 1 32 . 1 1 15 15 MET N N 15 121.890 0.005 . 1 . . . . 15 MET N . 16742 1 33 . 1 1 16 16 ASP H H 1 8.361 0.001 . 1 . . . . 16 ASP HN . 16742 1 34 . 1 1 16 16 ASP CA C 13 54.295 0.000 . 1 . . . . 16 ASP CA . 16742 1 35 . 1 1 16 16 ASP CB C 13 41.547 0.000 . 1 . . . . 16 ASP CB . 16742 1 36 . 1 1 16 16 ASP N N 15 121.879 0.007 . 1 . . . . 16 ASP N . 16742 1 37 . 1 1 17 17 SER H H 1 8.281 0.000 . 1 . . . . 17 SER HN . 16742 1 38 . 1 1 17 17 SER CA C 13 58.642 0.000 . 1 . . . . 17 SER CA . 16742 1 39 . 1 1 17 17 SER CB C 13 63.726 0.000 . 1 . . . . 17 SER CB . 16742 1 40 . 1 1 17 17 SER N N 15 116.496 0.001 . 1 . . . . 17 SER N . 16742 1 41 . 1 1 18 18 SER H H 1 8.394 0.001 . 1 . . . . 18 SER HN . 16742 1 42 . 1 1 18 18 SER CA C 13 59.010 0.000 . 1 . . . . 18 SER CA . 16742 1 43 . 1 1 18 18 SER CB C 13 63.800 0.000 . 1 . . . . 18 SER CB . 16742 1 44 . 1 1 18 18 SER N N 15 117.833 0.010 . 1 . . . . 18 SER N . 16742 1 45 . 1 1 19 19 THR H H 1 8.042 0.001 . 1 . . . . 19 THR HN . 16742 1 46 . 1 1 19 19 THR CA C 13 62.105 0.000 . 1 . . . . 19 THR CA . 16742 1 47 . 1 1 19 19 THR CB C 13 69.547 0.000 . 1 . . . . 19 THR CB . 16742 1 48 . 1 1 19 19 THR N N 15 114.979 0.007 . 1 . . . . 19 THR N . 16742 1 49 . 1 1 20 20 SER H H 1 8.141 0.000 . 1 . . . . 20 SER HN . 16742 1 50 . 1 1 20 20 SER CA C 13 58.568 0.000 . 1 . . . . 20 SER CA . 16742 1 51 . 1 1 20 20 SER CB C 13 63.874 0.000 . 1 . . . . 20 SER CB . 16742 1 52 . 1 1 20 20 SER N N 15 117.776 0.007 . 1 . . . . 20 SER N . 16742 1 53 . 1 1 21 21 ALA H H 1 8.200 0.000 . 1 . . . . 21 ALA HN . 16742 1 54 . 1 1 21 21 ALA CA C 13 52.747 0.000 . 1 . . . . 21 ALA CA . 16742 1 55 . 1 1 21 21 ALA CB C 13 19.221 0.000 . 1 . . . . 21 ALA CB . 16742 1 56 . 1 1 21 21 ALA N N 15 125.883 0.014 . 1 . . . . 21 ALA N . 16742 1 57 . 1 1 22 22 ALA H H 1 8.098 0.001 . 1 . . . . 22 ALA HN . 16742 1 58 . 1 1 22 22 ALA CA C 13 52.747 0.000 . 1 . . . . 22 ALA CA . 16742 1 59 . 1 1 22 22 ALA CB C 13 19.221 0.000 . 1 . . . . 22 ALA CB . 16742 1 60 . 1 1 22 22 ALA N N 15 122.542 0.013 . 1 . . . . 22 ALA N . 16742 1 61 . 1 1 23 23 SER H H 1 8.080 0.001 . 1 . . . . 23 SER HN . 16742 1 62 . 1 1 23 23 SER CA C 13 58.421 0.000 . 1 . . . . 23 SER CA . 16742 1 63 . 1 1 23 23 SER CB C 13 63.800 0.000 . 1 . . . . 23 SER CB . 16742 1 64 . 1 1 23 23 SER N N 15 114.276 0.007 . 1 . . . . 23 SER N . 16742 1 65 . 1 1 24 24 SER H H 1 8.241 0.000 . 1 . . . . 24 SER HN . 16742 1 66 . 1 1 24 24 SER CA C 13 58.568 0.000 . 1 . . . . 24 SER CA . 16742 1 67 . 1 1 24 24 SER CB C 13 63.800 0.000 . 1 . . . . 24 SER CB . 16742 1 68 . 1 1 24 24 SER N N 15 117.494 0.004 . 1 . . . . 24 SER N . 16742 1 69 . 1 1 25 25 SER H H 1 8.212 0.001 . 1 . . . . 25 SER HN . 16742 1 70 . 1 1 25 25 SER CA C 13 58.642 0.000 . 1 . . . . 25 SER CA . 16742 1 71 . 1 1 25 25 SER CB C 13 63.726 0.000 . 1 . . . . 25 SER CB . 16742 1 72 . 1 1 25 25 SER N N 15 117.255 0.002 . 1 . . . . 25 SER N . 16742 1 73 . 1 1 26 26 ASN H H 1 8.223 0.001 . 1 . . . . 26 ASN HN . 16742 1 74 . 1 1 26 26 ASN CA C 13 53.558 0.000 . 1 . . . . 26 ASN CA . 16742 1 75 . 1 1 26 26 ASN CB C 13 38.821 0.000 . 1 . . . . 26 ASN CB . 16742 1 76 . 1 1 26 26 ASN N N 15 120.122 0.005 . 1 . . . . 26 ASN N . 16742 1 77 . 1 1 27 27 TYR H H 1 8.014 0.003 . 1 . . . . 27 TYR HN . 16742 1 78 . 1 1 27 27 TYR CA C 13 58.421 0.000 . 1 . . . . 27 TYR CA . 16742 1 79 . 1 1 27 27 TYR CB C 13 38.747 0.000 . 1 . . . . 27 TYR CB . 16742 1 80 . 1 1 27 27 TYR N N 15 120.374 0.013 . 1 . . . . 27 TYR N . 16742 1 81 . 1 1 28 28 CYS H H 1 8.089 0.000 . 1 . . . . 28 CYS HN . 16742 1 82 . 1 1 28 28 CYS CA C 13 58.937 0.000 . 1 . . . . 28 CYS CA . 16742 1 83 . 1 1 28 28 CYS CB C 13 27.768 0.000 . 1 . . . . 28 CYS CB . 16742 1 84 . 1 1 28 28 CYS N N 15 120.009 0.001 . 1 . . . . 28 CYS N . 16742 1 85 . 1 1 29 29 ASN H H 1 8.250 0.001 . 1 . . . . 29 ASN HN . 16742 1 86 . 1 1 29 29 ASN CA C 13 54.000 0.000 . 1 . . . . 29 ASN CA . 16742 1 87 . 1 1 29 29 ASN CB C 13 38.747 0.000 . 1 . . . . 29 ASN CB . 16742 1 88 . 1 1 29 29 ASN N N 15 120.656 0.001 . 1 . . . . 29 ASN N . 16742 1 89 . 1 1 32 32 MET H H 1 8.077 0.001 . 1 . . . . 32 MET HN . 16742 1 90 . 1 1 32 32 MET CA C 13 55.989 0.000 . 1 . . . . 32 MET CA . 16742 1 91 . 1 1 32 32 MET CB C 13 32.705 0.000 . 1 . . . . 32 MET CB . 16742 1 92 . 1 1 32 32 MET N N 15 120.253 0.008 . 1 . . . . 32 MET N . 16742 1 93 . 1 1 33 33 LYS H H 1 8.086 0.001 . 1 . . . . 33 LYS HN . 16742 1 94 . 1 1 33 33 LYS CA C 13 56.874 0.000 . 1 . . . . 33 LYS CA . 16742 1 95 . 1 1 33 33 LYS CB C 13 33.000 0.000 . 1 . . . . 33 LYS CB . 16742 1 96 . 1 1 33 33 LYS N N 15 121.520 0.013 . 1 . . . . 33 LYS N . 16742 1 97 . 1 1 34 34 SER H H 1 8.088 0.001 . 1 . . . . 34 SER HN . 16742 1 98 . 1 1 34 34 SER CA C 13 58.642 0.000 . 1 . . . . 34 SER CA . 16742 1 99 . 1 1 34 34 SER CB C 13 63.726 0.000 . 1 . . . . 34 SER CB . 16742 1 100 . 1 1 34 34 SER N N 15 115.685 0.010 . 1 . . . . 34 SER N . 16742 1 101 . 1 1 35 35 ARG H H 1 8.179 0.000 . 1 . . . . 35 ARG HN . 16742 1 102 . 1 1 35 35 ARG CA C 13 56.358 0.000 . 1 . . . . 35 ARG CA . 16742 1 103 . 1 1 35 35 ARG CB C 13 30.863 0.000 . 1 . . . . 35 ARG CB . 16742 1 104 . 1 1 35 35 ARG N N 15 122.281 0.014 . 1 . . . . 35 ARG N . 16742 1 105 . 1 1 37 37 LEU H H 1 8.153 0.001 . 1 . . . . 37 LEU HN . 16742 1 106 . 1 1 37 37 LEU CA C 13 55.400 0.000 . 1 . . . . 37 LEU CA . 16742 1 107 . 1 1 37 37 LEU CB C 13 42.358 0.000 . 1 . . . . 37 LEU CB . 16742 1 108 . 1 1 37 37 LEU N N 15 122.542 0.013 . 1 . . . . 37 LEU N . 16742 1 109 . 1 1 38 38 THR H H 1 7.977 0.000 . 1 . . . . 38 THR HN . 16742 1 110 . 1 1 38 38 THR CA C 13 62.032 0.000 . 1 . . . . 38 THR CA . 16742 1 111 . 1 1 38 38 THR CB C 13 69.695 0.000 . 1 . . . . 38 THR CB . 16742 1 112 . 1 1 38 38 THR N N 15 114.098 0.004 . 1 . . . . 38 THR N . 16742 1 113 . 1 1 39 39 LYS H H 1 8.165 0.002 . 1 . . . . 39 LYS HN . 16742 1 114 . 1 1 39 39 LYS CA C 13 56.726 0.000 . 1 . . . . 39 LYS CA . 16742 1 115 . 1 1 39 39 LYS CB C 13 33.000 0.000 . 1 . . . . 39 LYS CB . 16742 1 116 . 1 1 39 39 LYS N N 15 122.826 0.005 . 1 . . . . 39 LYS N . 16742 1 117 . 1 1 40 40 ASP H H 1 8.191 0.001 . 1 . . . . 40 ASP HN . 16742 1 118 . 1 1 40 40 ASP CA C 13 54.663 0.000 . 1 . . . . 40 ASP CA . 16742 1 119 . 1 1 40 40 ASP CB C 13 41.326 0.000 . 1 . . . . 40 ASP CB . 16742 1 120 . 1 1 40 40 ASP N N 15 120.596 0.000 . 1 . . . . 40 ASP N . 16742 1 121 . 1 1 41 41 ARG H H 1 8.141 0.002 . 1 . . . . 41 ARG HN . 16742 1 122 . 1 1 41 41 ARG CA C 13 56.284 0.000 . 1 . . . . 41 ARG CA . 16742 1 123 . 1 1 41 41 ARG CB C 13 30.789 0.000 . 1 . . . . 41 ARG CB . 16742 1 124 . 1 1 41 41 ARG N N 15 120.582 0.014 . 1 . . . . 41 ARG N . 16742 1 125 . 1 1 42 42 CYS H H 1 8.206 0.000 . 1 . . . . 42 CYS HN . 16742 1 126 . 1 1 42 42 CYS CA C 13 58.495 0.000 . 1 . . . . 42 CYS CA . 16742 1 127 . 1 1 42 42 CYS CB C 13 28.137 0.000 . 1 . . . . 42 CYS CB . 16742 1 128 . 1 1 42 42 CYS N N 15 119.305 0.001 . 1 . . . . 42 CYS N . 16742 1 129 . 1 1 43 43 LYS H H 1 8.158 0.000 . 1 . . . . 43 LYS HN . 16742 1 130 . 1 1 43 43 LYS CA C 13 54.295 0.000 . 1 . . . . 43 LYS CA . 16742 1 131 . 1 1 43 43 LYS CB C 13 32.705 0.000 . 1 . . . . 43 LYS CB . 16742 1 132 . 1 1 43 43 LYS N N 15 124.279 0.008 . 1 . . . . 43 LYS N . 16742 1 133 . 1 1 45 45 VAL H H 1 7.900 0.000 . 1 . . . . 45 VAL HN . 16742 1 134 . 1 1 45 45 VAL CA C 13 62.179 0.000 . 1 . . . . 45 VAL CA . 16742 1 135 . 1 1 45 45 VAL CB C 13 32.926 0.000 . 1 . . . . 45 VAL CB . 16742 1 136 . 1 1 45 45 VAL N N 15 119.540 0.001 . 1 . . . . 45 VAL N . 16742 1 137 . 1 1 46 46 ASN H H 1 8.355 0.001 . 1 . . . . 46 ASN HN . 16742 1 138 . 1 1 46 46 ASN CA C 13 53.116 0.000 . 1 . . . . 46 ASN CA . 16742 1 139 . 1 1 46 46 ASN CB C 13 39.116 0.000 . 1 . . . . 46 ASN CB . 16742 1 140 . 1 1 46 46 ASN N N 15 121.652 0.000 . 1 . . . . 46 ASN N . 16742 1 141 . 1 1 47 47 THR H H 1 7.924 0.002 . 1 . . . . 47 THR HN . 16742 1 142 . 1 1 47 47 THR CA C 13 61.884 0.000 . 1 . . . . 47 THR CA . 16742 1 143 . 1 1 47 47 THR CB C 13 69.621 0.000 . 1 . . . . 47 THR CB . 16742 1 144 . 1 1 47 47 THR N N 15 114.089 0.005 . 1 . . . . 47 THR N . 16742 1 145 . 1 1 48 48 PHE H H 1 8.106 0.001 . 1 . . . . 48 PHE HN . 16742 1 146 . 1 1 48 48 PHE CA C 13 57.610 0.000 . 1 . . . . 48 PHE CA . 16742 1 147 . 1 1 48 48 PHE CB C 13 39.484 0.000 . 1 . . . . 48 PHE CB . 16742 1 148 . 1 1 48 48 PHE N N 15 121.933 0.010 . 1 . . . . 48 PHE N . 16742 1 149 . 1 1 49 49 VAL H H 1 7.875 0.000 . 1 . . . . 49 VAL HN . 16742 1 150 . 1 1 49 49 VAL CA C 13 62.218 0.000 . 1 . . . . 49 VAL CA . 16742 1 151 . 1 1 49 49 VAL CB C 13 32.926 0.000 . 1 . . . . 49 VAL CB . 16742 1 152 . 1 1 49 49 VAL N N 15 121.311 0.012 . 1 . . . . 49 VAL N . 16742 1 153 . 1 1 50 50 HIS H H 1 8.382 0.001 . 1 . . . . 50 HIS HN . 16742 1 154 . 1 1 50 50 HIS CA C 13 55.469 0.000 . 1 . . . . 50 HIS CA . 16742 1 155 . 1 1 50 50 HIS CB C 13 29.537 0.000 . 1 . . . . 50 HIS CB . 16742 1 156 . 1 1 50 50 HIS N N 15 122.297 0.002 . 1 . . . . 50 HIS N . 16742 1 157 . 1 1 51 51 GLU H H 1 8.436 0.002 . 1 . . . . 51 GLU HN . 16742 1 158 . 1 1 51 51 GLU CA C 13 56.680 0.000 . 1 . . . . 51 GLU CA . 16742 1 159 . 1 1 51 51 GLU CB C 13 30.495 0.000 . 1 . . . . 51 GLU CB . 16742 1 160 . 1 1 51 51 GLU N N 15 122.749 0.014 . 1 . . . . 51 GLU N . 16742 1 161 . 1 1 52 52 SER H H 1 8.399 0.001 . 1 . . . . 52 SER HN . 16742 1 162 . 1 1 52 52 SER CA C 13 58.238 0.000 . 1 . . . . 52 SER CA . 16742 1 163 . 1 1 52 52 SER CB C 13 63.874 0.000 . 1 . . . . 52 SER CB . 16742 1 164 . 1 1 52 52 SER N N 15 117.128 0.011 . 1 . . . . 52 SER N . 16742 1 165 . 1 1 53 53 LEU H H 1 8.236 0.001 . 1 . . . . 53 LEU HN . 16742 1 166 . 1 1 53 53 LEU CA C 13 55.469 0.000 . 1 . . . . 53 LEU CA . 16742 1 167 . 1 1 53 53 LEU CB C 13 42.284 0.000 . 1 . . . . 53 LEU CB . 16742 1 168 . 1 1 53 53 LEU N N 15 124.279 0.008 . 1 . . . . 53 LEU N . 16742 1 169 . 1 1 54 54 ALA H H 1 8.080 0.000 . 1 . . . . 54 ALA HN . 16742 1 170 . 1 1 54 54 ALA CA C 13 52.959 0.000 . 1 . . . . 54 ALA CA . 16742 1 171 . 1 1 54 54 ALA CB C 13 19.295 0.000 . 1 . . . . 54 ALA CB . 16742 1 172 . 1 1 54 54 ALA N N 15 123.471 0.004 . 1 . . . . 54 ALA N . 16742 1 173 . 1 1 55 55 ASP H H 1 8.073 0.000 . 1 . . . . 55 ASP HN . 16742 1 174 . 1 1 55 55 ASP CA C 13 54.517 0.000 . 1 . . . . 55 ASP CA . 16742 1 175 . 1 1 55 55 ASP CB C 13 41.105 0.000 . 1 . . . . 55 ASP CB . 16742 1 176 . 1 1 55 55 ASP N N 15 118.967 0.011 . 1 . . . . 55 ASP N . 16742 1 177 . 1 1 56 56 VAL H H 1 7.864 0.002 . 1 . . . . 56 VAL HN . 16742 1 178 . 1 1 56 56 VAL CA C 13 62.823 0.000 . 1 . . . . 56 VAL CA . 16742 1 179 . 1 1 56 56 VAL CB C 13 32.558 0.000 . 1 . . . . 56 VAL CB . 16742 1 180 . 1 1 56 56 VAL N N 15 119.549 0.008 . 1 . . . . 56 VAL N . 16742 1 181 . 1 1 57 57 GLN H H 1 8.250 0.000 . 1 . . . . 57 GLN HN . 16742 1 182 . 1 1 57 57 GLN CA C 13 56.074 0.000 . 1 . . . . 57 GLN CA . 16742 1 183 . 1 1 57 57 GLN CB C 13 29.316 0.000 . 1 . . . . 57 GLN CB . 16742 1 184 . 1 1 57 57 GLN N N 15 122.289 0.006 . 1 . . . . 57 GLN N . 16742 1 185 . 1 1 58 58 ALA H H 1 8.069 0.000 . 1 . . . . 58 ALA HN . 16742 1 186 . 1 1 58 58 ALA CA C 13 52.747 0.000 . 1 . . . . 58 ALA CA . 16742 1 187 . 1 1 58 58 ALA CB C 13 19.295 0.000 . 1 . . . . 58 ALA CB . 16742 1 188 . 1 1 58 58 ALA N N 15 124.466 0.003 . 1 . . . . 58 ALA N . 16742 1 189 . 1 1 59 59 VAL H H 1 7.937 0.000 . 1 . . . . 59 VAL HN . 16742 1 190 . 1 1 59 59 VAL CA C 13 62.695 0.000 . 1 . . . . 59 VAL CA . 16742 1 191 . 1 1 59 59 VAL CB C 13 32.632 0.000 . 1 . . . . 59 VAL CB . 16742 1 192 . 1 1 59 59 VAL N N 15 118.377 0.007 . 1 . . . . 59 VAL N . 16742 1 193 . 1 1 60 60 CYS H H 1 8.277 0.001 . 1 . . . . 60 CYS HN . 16742 1 194 . 1 1 60 60 CYS CA C 13 58.789 0.000 . 1 . . . . 60 CYS CA . 16742 1 195 . 1 1 60 60 CYS CB C 13 27.916 0.000 . 1 . . . . 60 CYS CB . 16742 1 196 . 1 1 60 60 CYS N N 15 121.895 0.010 . 1 . . . . 60 CYS N . 16742 1 197 . 1 1 61 61 SER H H 1 8.262 0.000 . 1 . . . . 61 SER HN . 16742 1 198 . 1 1 61 61 SER CA C 13 58.789 0.000 . 1 . . . . 61 SER CA . 16742 1 199 . 1 1 61 61 SER CB C 13 63.726 0.000 . 1 . . . . 61 SER CB . 16742 1 200 . 1 1 61 61 SER N N 15 118.029 0.011 . 1 . . . . 61 SER N . 16742 1 201 . 1 1 62 62 GLN H H 1 8.228 0.000 . 1 . . . . 62 GLN HN . 16742 1 202 . 1 1 62 62 GLN CA C 13 56.137 0.000 . 1 . . . . 62 GLN CA . 16742 1 203 . 1 1 62 62 GLN CB C 13 29.463 0.000 . 1 . . . . 62 GLN CB . 16742 1 204 . 1 1 62 62 GLN N N 15 121.885 0.000 . 1 . . . . 62 GLN N . 16742 1 205 . 1 1 64 64 ASN H H 1 8.311 0.000 . 1 . . . . 64 ASN HN . 16742 1 206 . 1 1 64 64 ASN CA C 13 53.337 0.000 . 1 . . . . 64 ASN CA . 16742 1 207 . 1 1 64 64 ASN CB C 13 38.895 0.000 . 1 . . . . 64 ASN CB . 16742 1 208 . 1 1 64 64 ASN N N 15 119.136 0.005 . 1 . . . . 64 ASN N . 16742 1 209 . 1 1 65 65 VAL H H 1 7.925 0.000 . 1 . . . . 65 VAL HN . 16742 1 210 . 1 1 65 65 VAL CA C 13 62.218 0.000 . 1 . . . . 65 VAL CA . 16742 1 211 . 1 1 65 65 VAL CB C 13 32.853 0.000 . 1 . . . . 65 VAL CB . 16742 1 212 . 1 1 65 65 VAL N N 15 119.775 0.001 . 1 . . . . 65 VAL N . 16742 1 213 . 1 1 66 66 ALA H H 1 8.232 0.001 . 1 . . . . 66 ALA HN . 16742 1 214 . 1 1 66 66 ALA CA C 13 52.527 0.000 . 1 . . . . 66 ALA CA . 16742 1 215 . 1 1 66 66 ALA CB C 13 19.295 0.000 . 1 . . . . 66 ALA CB . 16742 1 216 . 1 1 66 66 ALA N N 15 126.738 0.011 . 1 . . . . 66 ALA N . 16742 1 217 . 1 1 67 67 CYS H H 1 8.133 0.000 . 1 . . . . 67 CYS HN . 16742 1 218 . 1 1 67 67 CYS CA C 13 58.411 0.000 . 1 . . . . 67 CYS CA . 16742 1 219 . 1 1 67 67 CYS CB C 13 28.137 0.000 . 1 . . . . 67 CYS CB . 16742 1 220 . 1 1 67 67 CYS N N 15 118.264 0.011 . 1 . . . . 67 CYS N . 16742 1 221 . 1 1 68 68 LYS H H 1 8.326 0.000 . 1 . . . . 68 LYS HN . 16742 1 222 . 1 1 68 68 LYS CA C 13 56.594 0.000 . 1 . . . . 68 LYS CA . 16742 1 223 . 1 1 68 68 LYS CB C 13 32.926 0.000 . 1 . . . . 68 LYS CB . 16742 1 224 . 1 1 68 68 LYS N N 15 123.715 0.014 . 1 . . . . 68 LYS N . 16742 1 225 . 1 1 69 69 ASN H H 1 8.298 0.001 . 1 . . . . 69 ASN HN . 16742 1 226 . 1 1 69 69 ASN CA C 13 53.306 0.000 . 1 . . . . 69 ASN CA . 16742 1 227 . 1 1 69 69 ASN CB C 13 38.968 0.000 . 1 . . . . 69 ASN CB . 16742 1 228 . 1 1 69 69 ASN N N 15 119.314 0.007 . 1 . . . . 69 ASN N . 16742 1 229 . 1 1 70 70 GLY H H 1 8.295 0.000 . 1 . . . . 70 GLY HN . 16742 1 230 . 1 1 70 70 GLY CA C 13 45.605 0.000 . 1 . . . . 70 GLY CA . 16742 1 231 . 1 1 70 70 GLY N N 15 109.910 0.000 . 1 . . . . 70 GLY N . 16742 1 232 . 1 1 71 71 GLN H H 1 8.123 0.000 . 1 . . . . 71 GLN HN . 16742 1 233 . 1 1 71 71 GLN CA C 13 55.901 0.000 . 1 . . . . 71 GLN CA . 16742 1 234 . 1 1 71 71 GLN CB C 13 29.610 0.000 . 1 . . . . 71 GLN CB . 16742 1 235 . 1 1 71 71 GLN N N 15 119.718 0.001 . 1 . . . . 71 GLN N . 16742 1 236 . 1 1 72 72 THR H H 1 8.122 0.002 . 1 . . . . 72 THR HN . 16742 1 237 . 1 1 72 72 THR CA C 13 61.958 0.000 . 1 . . . . 72 THR CA . 16742 1 238 . 1 1 72 72 THR CB C 13 69.695 0.000 . 1 . . . . 72 THR CB . 16742 1 239 . 1 1 72 72 THR N N 15 114.623 0.003 . 1 . . . . 72 THR N . 16742 1 240 . 1 1 73 73 ASN H H 1 8.372 0.000 . 1 . . . . 73 ASN HN . 16742 1 241 . 1 1 73 73 ASN CA C 13 53.263 0.000 . 1 . . . . 73 ASN CA . 16742 1 242 . 1 1 73 73 ASN CB C 13 38.895 0.000 . 1 . . . . 73 ASN CB . 16742 1 243 . 1 1 73 73 ASN N N 15 120.647 0.007 . 1 . . . . 73 ASN N . 16742 1 244 . 1 1 74 74 CYS H H 1 8.123 0.001 . 1 . . . . 74 CYS HN . 16742 1 245 . 1 1 74 74 CYS CA C 13 58.421 0.000 . 1 . . . . 74 CYS CA . 16742 1 246 . 1 1 74 74 CYS CB C 13 28.063 0.000 . 1 . . . . 74 CYS CB . 16742 1 247 . 1 1 74 74 CYS N N 15 118.885 0.012 . 1 . . . . 74 CYS N . 16742 1 248 . 1 1 75 75 TYR H H 1 8.136 0.001 . 1 . . . . 75 TYR HN . 16742 1 249 . 1 1 75 75 TYR CA C 13 58.126 0.000 . 1 . . . . 75 TYR CA . 16742 1 250 . 1 1 75 75 TYR CB C 13 38.600 0.000 . 1 . . . . 75 TYR CB . 16742 1 251 . 1 1 75 75 TYR N N 15 122.129 0.010 . 1 . . . . 75 TYR N . 16742 1 252 . 1 1 76 76 GLN H H 1 8.066 0.000 . 1 . . . . 76 GLN HN . 16742 1 253 . 1 1 76 76 GLN CA C 13 55.842 0.000 . 1 . . . . 76 GLN CA . 16742 1 254 . 1 1 76 76 GLN CB C 13 29.684 0.000 . 1 . . . . 76 GLN CB . 16742 1 255 . 1 1 76 76 GLN N N 15 121.473 0.002 . 1 . . . . 76 GLN N . 16742 1 256 . 1 1 77 77 SER H H 1 8.098 0.001 . 1 . . . . 77 SER HN . 16742 1 257 . 1 1 77 77 SER CA C 13 58.200 0.000 . 1 . . . . 77 SER CA . 16742 1 258 . 1 1 77 77 SER CB C 13 63.800 0.000 . 1 . . . . 77 SER CB . 16742 1 259 . 1 1 77 77 SER N N 15 116.499 0.004 . 1 . . . . 77 SER N . 16742 1 260 . 1 1 78 78 TYR H H 1 8.053 0.000 . 1 . . . . 78 TYR HN . 16742 1 261 . 1 1 78 78 TYR CA C 13 58.053 0.000 . 1 . . . . 78 TYR CA . 16742 1 262 . 1 1 78 78 TYR CB C 13 38.821 0.000 . 1 . . . . 78 TYR CB . 16742 1 263 . 1 1 78 78 TYR N N 15 121.660 0.009 . 1 . . . . 78 TYR N . 16742 1 264 . 1 1 79 79 SER H H 1 8.135 0.001 . 1 . . . . 79 SER HN . 16742 1 265 . 1 1 79 79 SER CA C 13 58.200 0.000 . 1 . . . . 79 SER CA . 16742 1 266 . 1 1 79 79 SER CB C 13 63.874 0.000 . 1 . . . . 79 SER CB . 16742 1 267 . 1 1 79 79 SER N N 15 116.499 0.004 . 1 . . . . 79 SER N . 16742 1 268 . 1 1 80 80 THR H H 1 8.035 0.000 . 1 . . . . 80 THR HN . 16742 1 269 . 1 1 80 80 THR CA C 13 62.032 0.000 . 1 . . . . 80 THR CA . 16742 1 270 . 1 1 80 80 THR CB C 13 69.547 0.000 . 1 . . . . 80 THR CB . 16742 1 271 . 1 1 80 80 THR N N 15 115.205 0.001 . 1 . . . . 80 THR N . 16742 1 272 . 1 1 81 81 MET H H 1 8.135 0.001 . 1 . . . . 81 MET HN . 16742 1 273 . 1 1 81 81 MET CA C 13 55.768 0.000 . 1 . . . . 81 MET CA . 16742 1 274 . 1 1 81 81 MET CB C 13 33.295 0.000 . 1 . . . . 81 MET CB . 16742 1 275 . 1 1 81 81 MET N N 15 121.942 0.001 . 1 . . . . 81 MET N . 16742 1 276 . 1 1 82 82 SER H H 1 8.240 0.001 . 1 . . . . 82 SER HN . 16742 1 277 . 1 1 82 82 SER CA C 13 58.126 0.000 . 1 . . . . 82 SER CA . 16742 1 278 . 1 1 82 82 SER CB C 13 63.800 0.000 . 1 . . . . 82 SER CB . 16742 1 279 . 1 1 82 82 SER N N 15 116.969 0.005 . 1 . . . . 82 SER N . 16742 1 280 . 1 1 83 83 ILE H H 1 8.109 0.000 . 1 . . . . 83 ILE HN . 16742 1 281 . 1 1 83 83 ILE CA C 13 61.516 0.000 . 1 . . . . 83 ILE CA . 16742 1 282 . 1 1 83 83 ILE CB C 13 38.821 0.000 . 1 . . . . 83 ILE CB . 16742 1 283 . 1 1 83 83 ILE N N 15 122.289 0.006 . 1 . . . . 83 ILE N . 16742 1 284 . 1 1 84 84 THR H H 1 8.037 0.001 . 1 . . . . 84 THR HN . 16742 1 285 . 1 1 84 84 THR CA C 13 61.958 0.000 . 1 . . . . 84 THR CA . 16742 1 286 . 1 1 84 84 THR CB C 13 69.695 0.000 . 1 . . . . 84 THR CB . 16742 1 287 . 1 1 84 84 THR N N 15 116.669 0.002 . 1 . . . . 84 THR N . 16742 1 288 . 1 1 85 85 ASP H H 1 8.156 0.001 . 1 . . . . 85 ASP HN . 16742 1 289 . 1 1 85 85 ASP CA C 13 54.295 0.000 . 1 . . . . 85 ASP CA . 16742 1 290 . 1 1 85 85 ASP CB C 13 41.474 0.000 . 1 . . . . 85 ASP CB . 16742 1 291 . 1 1 85 85 ASP N N 15 122.711 0.006 . 1 . . . . 85 ASP N . 16742 1 292 . 1 1 86 86 CYS H H 1 8.234 0.000 . 1 . . . . 86 CYS HN . 16742 1 293 . 1 1 86 86 CYS CA C 13 58.642 0.000 . 1 . . . . 86 CYS CA . 16742 1 294 . 1 1 86 86 CYS CB C 13 27.842 0.000 . 1 . . . . 86 CYS CB . 16742 1 295 . 1 1 86 86 CYS N N 15 119.906 0.013 . 1 . . . . 86 CYS N . 16742 1 296 . 1 1 87 87 ARG H H 1 8.337 0.000 . 1 . . . . 87 ARG HN . 16742 1 297 . 1 1 87 87 ARG CA C 13 56.579 0.000 . 1 . . . . 87 ARG CA . 16742 1 298 . 1 1 87 87 ARG CB C 13 30.716 0.000 . 1 . . . . 87 ARG CB . 16742 1 299 . 1 1 87 87 ARG N N 15 122.984 0.014 . 1 . . . . 87 ARG N . 16742 1 300 . 1 1 88 88 GLU H H 1 8.313 0.001 . 1 . . . . 88 GLU HN . 16742 1 301 . 1 1 88 88 GLU CA C 13 56.726 0.000 . 1 . . . . 88 GLU CA . 16742 1 302 . 1 1 88 88 GLU CB C 13 30.200 0.000 . 1 . . . . 88 GLU CB . 16742 1 303 . 1 1 88 88 GLU N N 15 121.070 0.004 . 1 . . . . 88 GLU N . 16742 1 304 . 1 1 89 89 THR H H 1 8.105 0.001 . 1 . . . . 89 THR HN . 16742 1 305 . 1 1 89 89 THR CA C 13 62.032 0.000 . 1 . . . . 89 THR CA . 16742 1 306 . 1 1 89 89 THR CB C 13 69.695 0.000 . 1 . . . . 89 THR CB . 16742 1 307 . 1 1 89 89 THR N N 15 114.314 0.013 . 1 . . . . 89 THR N . 16742 1 308 . 1 1 90 90 GLY H H 1 8.374 0.000 . 1 . . . . 90 GLY HN . 16742 1 309 . 1 1 90 90 GLY CA C 13 45.605 0.000 . 1 . . . . 90 GLY CA . 16742 1 310 . 1 1 90 90 GLY N N 15 109.910 0.000 . 1 . . . . 90 GLY N . 16742 1 311 . 1 1 91 91 SER H H 1 8.105 0.000 . 1 . . . . 91 SER HN . 16742 1 312 . 1 1 91 91 SER CA C 13 58.421 0.000 . 1 . . . . 91 SER CA . 16742 1 313 . 1 1 91 91 SER CB C 13 63.874 0.000 . 1 . . . . 91 SER CB . 16742 1 314 . 1 1 91 91 SER N N 15 115.309 0.014 . 1 . . . . 91 SER N . 16742 1 315 . 1 1 92 92 SER H H 1 8.180 0.001 . 1 . . . . 92 SER HN . 16742 1 316 . 1 1 92 92 SER CA C 13 58.568 0.000 . 1 . . . . 92 SER CA . 16742 1 317 . 1 1 92 92 SER CB C 13 63.800 0.000 . 1 . . . . 92 SER CB . 16742 1 318 . 1 1 92 92 SER N N 15 117.307 0.008 . 1 . . . . 92 SER N . 16742 1 319 . 1 1 93 93 LYS H H 1 8.065 0.000 . 1 . . . . 93 LYS HN . 16742 1 320 . 1 1 93 93 LYS CA C 13 56.358 0.000 . 1 . . . . 93 LYS CA . 16742 1 321 . 1 1 93 93 LYS CB C 13 33.147 0.000 . 1 . . . . 93 LYS CB . 16742 1 322 . 1 1 93 93 LYS N N 15 122.299 0.004 . 1 . . . . 93 LYS N . 16742 1 323 . 1 1 96 96 ASN H H 1 8.354 0.000 . 1 . . . . 96 ASN HN . 16742 1 324 . 1 1 96 96 ASN CA C 13 53.484 0.000 . 1 . . . . 96 ASN CA . 16742 1 325 . 1 1 96 96 ASN CB C 13 38.821 0.000 . 1 . . . . 96 ASN CB . 16742 1 326 . 1 1 96 96 ASN N N 15 118.124 0.012 . 1 . . . . 96 ASN N . 16742 1 327 . 1 1 97 97 CYS H H 1 8.145 0.003 . 1 . . . . 97 CYS HN . 16742 1 328 . 1 1 97 97 CYS CA C 13 58.568 0.000 . 1 . . . . 97 CYS CA . 16742 1 329 . 1 1 97 97 CYS CB C 13 28.063 0.000 . 1 . . . . 97 CYS CB . 16742 1 330 . 1 1 97 97 CYS N N 15 118.902 0.004 . 1 . . . . 97 CYS N . 16742 1 331 . 1 1 98 98 ALA H H 1 8.225 0.000 . 1 . . . . 98 ALA HN . 16742 1 332 . 1 1 98 98 ALA CA C 13 52.747 0.000 . 1 . . . . 98 ALA CA . 16742 1 333 . 1 1 98 98 ALA CB C 13 19.221 0.000 . 1 . . . . 98 ALA CB . 16742 1 334 . 1 1 98 98 ALA N N 15 125.808 0.002 . 1 . . . . 98 ALA N . 16742 1 335 . 1 1 99 99 TYR H H 1 7.851 0.000 . 1 . . . . 99 TYR HN . 16742 1 336 . 1 1 99 99 TYR CA C 13 57.832 0.000 . 1 . . . . 99 TYR CA . 16742 1 337 . 1 1 99 99 TYR CB C 13 38.821 0.000 . 1 . . . . 99 TYR CB . 16742 1 338 . 1 1 99 99 TYR N N 15 118.659 0.005 . 1 . . . . 99 TYR N . 16742 1 339 . 1 1 100 100 LYS H H 1 8.026 0.002 . 1 . . . . 100 LYS HN . 16742 1 340 . 1 1 100 100 LYS CA C 13 56.284 0.000 . 1 . . . . 100 LYS CA . 16742 1 341 . 1 1 100 100 LYS CB C 13 33.295 0.000 . 1 . . . . 100 LYS CB . 16742 1 342 . 1 1 100 100 LYS N N 15 122.299 0.004 . 1 . . . . 100 LYS N . 16742 1 343 . 1 1 101 101 THR H H 1 8.031 0.001 . 1 . . . . 101 THR HN . 16742 1 344 . 1 1 101 101 THR CA C 13 61.884 0.000 . 1 . . . . 101 THR CA . 16742 1 345 . 1 1 101 101 THR CB C 13 69.695 0.000 . 1 . . . . 101 THR CB . 16742 1 346 . 1 1 101 101 THR N N 15 114.744 0.007 . 1 . . . . 101 THR N . 16742 1 347 . 1 1 102 102 THR H H 1 8.075 0.000 . 1 . . . . 102 THR HN . 16742 1 348 . 1 1 102 102 THR CA C 13 61.884 0.000 . 1 . . . . 102 THR CA . 16742 1 349 . 1 1 102 102 THR CB C 13 69.768 0.000 . 1 . . . . 102 THR CB . 16742 1 350 . 1 1 102 102 THR N N 15 115.721 0.012 . 1 . . . . 102 THR N . 16742 1 351 . 1 1 103 103 GLN H H 1 8.249 0.000 . 1 . . . . 103 GLN HN . 16742 1 352 . 1 1 103 103 GLN CA C 13 56.063 0.000 . 1 . . . . 103 GLN CA . 16742 1 353 . 1 1 103 103 GLN CB C 13 29.389 0.000 . 1 . . . . 103 GLN CB . 16742 1 354 . 1 1 103 103 GLN N N 15 122.186 0.007 . 1 . . . . 103 GLN N . 16742 1 355 . 1 1 104 104 ALA H H 1 8.184 0.001 . 1 . . . . 104 ALA HN . 16742 1 356 . 1 1 104 104 ALA CA C 13 52.895 0.000 . 1 . . . . 104 ALA CA . 16742 1 357 . 1 1 104 104 ALA CB C 13 19.221 0.000 . 1 . . . . 104 ALA CB . 16742 1 358 . 1 1 104 104 ALA N N 15 124.531 0.010 . 1 . . . . 104 ALA N . 16742 1 359 . 1 1 107 107 HIS H H 1 8.359 0.000 . 1 . . . . 107 HIS HN . 16742 1 360 . 1 1 107 107 HIS CA C 13 55.400 0.000 . 1 . . . . 107 HIS CA . 16742 1 361 . 1 1 107 107 HIS CB C 13 29.389 0.000 . 1 . . . . 107 HIS CB . 16742 1 362 . 1 1 107 107 HIS N N 15 119.371 0.005 . 1 . . . . 107 HIS N . 16742 1 363 . 1 1 108 108 ILE H H 1 7.988 0.000 . 1 . . . . 108 ILE HN . 16742 1 364 . 1 1 108 108 ILE CA C 13 61.000 0.000 . 1 . . . . 108 ILE CA . 16742 1 365 . 1 1 108 108 ILE CB C 13 39.042 0.000 . 1 . . . . 108 ILE CB . 16742 1 366 . 1 1 108 108 ILE N N 15 122.242 0.006 . 1 . . . . 108 ILE N . 16742 1 367 . 1 1 109 109 ILE H H 1 8.160 0.001 . 1 . . . . 109 ILE HN . 16742 1 368 . 1 1 109 109 ILE CA C 13 60.853 0.000 . 1 . . . . 109 ILE CA . 16742 1 369 . 1 1 109 109 ILE CB C 13 38.674 0.000 . 1 . . . . 109 ILE CB . 16742 1 370 . 1 1 109 109 ILE N N 15 125.470 0.011 . 1 . . . . 109 ILE N . 16742 1 371 . 1 1 110 110 VAL H H 1 8.111 0.000 . 1 . . . . 110 VAL HN . 16742 1 372 . 1 1 110 110 VAL CA C 13 61.958 0.000 . 1 . . . . 110 VAL CA . 16742 1 373 . 1 1 110 110 VAL CB C 13 33.000 0.000 . 1 . . . . 110 VAL CB . 16742 1 374 . 1 1 110 110 VAL N N 15 124.748 0.008 . 1 . . . . 110 VAL N . 16742 1 375 . 1 1 111 111 ALA H H 1 8.279 0.000 . 1 . . . . 111 ALA HN . 16742 1 376 . 1 1 111 111 ALA CA C 13 52.526 0.000 . 1 . . . . 111 ALA CA . 16742 1 377 . 1 1 111 111 ALA CB C 13 19.368 0.000 . 1 . . . . 111 ALA CB . 16742 1 378 . 1 1 111 111 ALA N N 15 127.732 0.012 . 1 . . . . 111 ALA N . 16742 1 379 . 1 1 112 112 CYS H H 1 8.232 0.001 . 1 . . . . 112 CYS HN . 16742 1 380 . 1 1 112 112 CYS CA C 13 58.274 0.000 . 1 . . . . 112 CYS CA . 16742 1 381 . 1 1 112 112 CYS CB C 13 28.137 0.000 . 1 . . . . 112 CYS CB . 16742 1 382 . 1 1 112 112 CYS N N 15 118.377 0.007 . 1 . . . . 112 CYS N . 16742 1 383 . 1 1 113 113 GLU H H 1 8.457 0.000 . 1 . . . . 113 GLU HN . 16742 1 384 . 1 1 113 113 GLU CA C 13 56.947 0.000 . 1 . . . . 113 GLU CA . 16742 1 385 . 1 1 113 113 GLU CB C 13 30.274 0.000 . 1 . . . . 113 GLU CB . 16742 1 386 . 1 1 113 113 GLU N N 15 123.245 0.014 . 1 . . . . 113 GLU N . 16742 1 387 . 1 1 114 114 GLY H H 1 8.309 0.000 . 1 . . . . 114 GLY HN . 16742 1 388 . 1 1 114 114 GLY CA C 13 45.172 0.000 . 1 . . . . 114 GLY CA . 16742 1 389 . 1 1 114 114 GLY N N 15 109.910 0.000 . 1 . . . . 114 GLY N . 16742 1 390 . 1 1 115 115 ASN H H 1 8.127 0.001 . 1 . . . . 115 ASN HN . 16742 1 391 . 1 1 115 115 ASN CA C 13 51.126 0.000 . 1 . . . . 115 ASN CA . 16742 1 392 . 1 1 115 115 ASN CB C 13 39.189 0.000 . 1 . . . . 115 ASN CB . 16742 1 393 . 1 1 115 115 ASN N N 15 119.362 0.004 . 1 . . . . 115 ASN N . 16742 1 394 . 1 1 117 117 TYR H H 1 8.072 0.001 . 1 . . . . 117 TYR HN . 16742 1 395 . 1 1 117 117 TYR CA C 13 57.905 0.000 . 1 . . . . 117 TYR CA . 16742 1 396 . 1 1 117 117 TYR CB C 13 38.526 0.000 . 1 . . . . 117 TYR CB . 16742 1 397 . 1 1 117 117 TYR N N 15 119.948 0.005 . 1 . . . . 117 TYR N . 16742 1 398 . 1 1 118 118 VAL H H 1 7.618 0.000 . 1 . . . . 118 VAL HN . 16742 1 399 . 1 1 118 118 VAL CA C 13 59.232 0.000 . 1 . . . . 118 VAL CA . 16742 1 400 . 1 1 118 118 VAL CB C 13 33.221 0.000 . 1 . . . . 118 VAL CB . 16742 1 401 . 1 1 118 118 VAL N N 15 124.240 0.012 . 1 . . . . 118 VAL N . 16742 1 402 . 1 1 120 120 VAL H H 1 8.112 0.000 . 1 . . . . 120 VAL HN . 16742 1 403 . 1 1 120 120 VAL CA C 13 62.253 0.000 . 1 . . . . 120 VAL CA . 16742 1 404 . 1 1 120 120 VAL CB C 13 33.000 0.000 . 1 . . . . 120 VAL CB . 16742 1 405 . 1 1 120 120 VAL N N 15 119.704 0.013 . 1 . . . . 120 VAL N . 16742 1 406 . 1 1 121 121 HIS H H 1 8.274 0.000 . 1 . . . . 121 HIS HN . 16742 1 407 . 1 1 121 121 HIS CA C 13 54.958 0.000 . 1 . . . . 121 HIS CA . 16742 1 408 . 1 1 121 121 HIS CB C 13 29.684 0.000 . 1 . . . . 121 HIS CB . 16742 1 409 . 1 1 121 121 HIS N N 15 121.652 0.000 . 1 . . . . 121 HIS N . 16742 1 410 . 1 1 122 122 PHE H H 1 8.219 0.000 . 1 . . . . 122 PHE HN . 16742 1 411 . 1 1 122 122 PHE CA C 13 57.537 0.000 . 1 . . . . 122 PHE CA . 16742 1 412 . 1 1 122 122 PHE CB C 13 40.000 0.000 . 1 . . . . 122 PHE CB . 16742 1 413 . 1 1 122 122 PHE N N 15 122.777 0.013 . 1 . . . . 122 PHE N . 16742 1 414 . 1 1 123 123 ASP H H 1 8.263 0.000 . 1 . . . . 123 ASP HN . 16742 1 415 . 1 1 123 123 ASP CA C 13 54.000 0.000 . 1 . . . . 123 ASP CA . 16742 1 416 . 1 1 123 123 ASP CB C 13 41.474 0.000 . 1 . . . . 123 ASP CB . 16742 1 417 . 1 1 123 123 ASP N N 15 122.533 0.004 . 1 . . . . 123 ASP N . 16742 1 418 . 1 1 124 124 ALA H H 1 8.080 0.001 . 1 . . . . 124 ALA HN . 16742 1 419 . 1 1 124 124 ALA CA C 13 52.453 0.000 . 1 . . . . 124 ALA CA . 16742 1 420 . 1 1 124 124 ALA CB C 13 19.368 0.000 . 1 . . . . 124 ALA CB . 16742 1 421 . 1 1 124 124 ALA N N 15 124.477 0.014 . 1 . . . . 124 ALA N . 16742 1 422 . 1 1 125 125 SER H H 1 8.274 0.001 . 1 . . . . 125 SER HN . 16742 1 423 . 1 1 125 125 SER CA C 13 58.716 0.000 . 1 . . . . 125 SER CA . 16742 1 424 . 1 1 125 125 SER CB C 13 63.874 0.000 . 1 . . . . 125 SER CB . 16742 1 425 . 1 1 125 125 SER N N 15 115.721 0.012 . 1 . . . . 125 SER N . 16742 1 426 . 1 1 126 126 VAL H H 1 7.548 0.000 . 1 . . . . 126 VAL HN . 16742 1 427 . 1 1 126 126 VAL CA C 13 63.505 0.000 . 1 . . . . 126 VAL CA . 16742 1 428 . 1 1 126 126 VAL CB C 13 33.295 0.000 . 1 . . . . 126 VAL CB . 16742 1 429 . 1 1 126 126 VAL N N 15 124.992 0.001 . 1 . . . . 126 VAL N . 16742 1 stop_ save_