################################### # 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 27136 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' . . . 27136 1 2 '3D CBCA(CO)NH' . . . 27136 1 3 '3D HNCACB' . . . 27136 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 SER H H 1 8.171 0.02 . 1 . . . . 0 SER H . 27136 1 2 . 1 1 4 4 SER CA C 13 58.366 0.3 . 1 . . . . 0 SER CA . 27136 1 3 . 1 1 4 4 SER CB C 13 63.931 0.3 . 1 . . . . 0 SER CB . 27136 1 4 . 1 1 4 4 SER N N 15 115.378 0.2 . 1 . . . . 0 SER N . 27136 1 5 . 1 1 5 5 MET H H 1 8.437 0.02 . 1 . . . . 1 MET H . 27136 1 6 . 1 1 5 5 MET CA C 13 55.027 0.3 . 1 . . . . 1 MET CA . 27136 1 7 . 1 1 5 5 MET CB C 13 32.891 0.3 . 1 . . . . 1 MET CB . 27136 1 8 . 1 1 5 5 MET N N 15 122.174 0.2 . 1 . . . . 1 MET N . 27136 1 9 . 1 1 6 6 SER H H 1 8.1 0.02 . 1 . . . . 2 SER H . 27136 1 10 . 1 1 6 6 SER CA C 13 57.253 0.3 . 1 . . . . 2 SER CA . 27136 1 11 . 1 1 6 6 SER CB C 13 64.302 0.3 . 1 . . . . 2 SER CB . 27136 1 12 . 1 1 6 6 SER N N 15 116.719 0.2 . 1 . . . . 2 SER N . 27136 1 13 . 1 1 7 7 PHE H H 1 9.608 0.02 . 1 . . . . 3 PHE H . 27136 1 14 . 1 1 7 7 PHE CA C 13 59.788 0.3 . 1 . . . . 3 PHE CA . 27136 1 15 . 1 1 7 7 PHE CB C 13 40.744 0.3 . 1 . . . . 3 PHE CB . 27136 1 16 . 1 1 7 7 PHE N N 15 122.095 0.2 . 1 . . . . 3 PHE N . 27136 1 17 . 1 1 8 8 SER H H 1 8.302 0.02 . 1 . . . . 4 SER H . 27136 1 18 . 1 1 8 8 SER CA C 13 60.035 0.3 . 1 . . . . 4 SER CA . 27136 1 19 . 1 1 8 8 SER CB C 13 63.683 0.3 . 1 . . . . 4 SER CB . 27136 1 20 . 1 1 8 8 SER N N 15 116.247 0.2 . 1 . . . . 4 SER N . 27136 1 21 . 1 1 9 9 GLY H H 1 8.821 0.02 . 1 . . . . 5 GLY H . 27136 1 22 . 1 1 9 9 GLY CA C 13 44.578 0.3 . 1 . . . . 5 GLY CA . 27136 1 23 . 1 1 9 9 GLY N N 15 110.893 0.2 . 1 . . . . 5 GLY N . 27136 1 24 . 1 1 10 10 LYS H H 1 8.041 0.02 . 1 . . . . 6 LYS H . 27136 1 25 . 1 1 10 10 LYS CA C 13 55.151 0.3 . 1 . . . . 6 LYS CA . 27136 1 26 . 1 1 10 10 LYS CB C 13 34.87 0.3 . 1 . . . . 6 LYS CB . 27136 1 27 . 1 1 10 10 LYS N N 15 119.941 0.2 . 1 . . . . 6 LYS N . 27136 1 28 . 1 1 11 11 TYR H H 1 9.151 0.02 . 1 . . . . 7 TYR H . 27136 1 29 . 1 1 11 11 TYR CA C 13 56.325 0.3 . 1 . . . . 7 TYR CA . 27136 1 30 . 1 1 11 11 TYR CB C 13 41.548 0.3 . 1 . . . . 7 TYR CB . 27136 1 31 . 1 1 11 11 TYR N N 15 120.739 0.2 . 1 . . . . 7 TYR N . 27136 1 32 . 1 1 12 12 GLN H H 1 8.989 0.02 . 1 . . . . 8 GLN H . 27136 1 33 . 1 1 12 12 GLN CA C 13 53.976 0.3 . 1 . . . . 8 GLN CA . 27136 1 34 . 1 1 12 12 GLN CB C 13 31.593 0.3 . 1 . . . . 8 GLN CB . 27136 1 35 . 1 1 12 12 GLN N N 15 123.76 0.2 . 1 . . . . 8 GLN N . 27136 1 36 . 1 1 13 13 LEU H H 1 8.583 0.02 . 1 . . . . 9 LEU H . 27136 1 37 . 1 1 13 13 LEU CA C 13 57.191 0.3 . 1 . . . . 9 LEU CA . 27136 1 38 . 1 1 13 13 LEU CB C 13 42.475 0.3 . 1 . . . . 9 LEU CB . 27136 1 39 . 1 1 13 13 LEU N N 15 131.748 0.2 . 1 . . . . 9 LEU N . 27136 1 40 . 1 1 14 14 GLN H H 1 9.944 0.02 . 1 . . . . 10 GLN H . 27136 1 41 . 1 1 14 14 GLN CA C 13 56.202 0.3 . 1 . . . . 10 GLN CA . 27136 1 42 . 1 1 14 14 GLN CB C 13 31.717 0.3 . 1 . . . . 10 GLN CB . 27136 1 43 . 1 1 14 14 GLN N N 15 125.17 0.2 . 1 . . . . 10 GLN N . 27136 1 44 . 1 1 15 15 SER H H 1 7.901 0.02 . 1 . . . . 11 SER H . 27136 1 45 . 1 1 15 15 SER CA C 13 57.624 0.3 . 1 . . . . 11 SER CA . 27136 1 46 . 1 1 15 15 SER CB C 13 64.92 0.3 . 1 . . . . 11 SER CB . 27136 1 47 . 1 1 15 15 SER N N 15 110.541 0.2 . 1 . . . . 11 SER N . 27136 1 48 . 1 1 16 16 GLN H H 1 8.54 0.02 . 1 . . . . 12 GLN H . 27136 1 49 . 1 1 16 16 GLN CA C 13 54.1 0.3 . 1 . . . . 12 GLN CA . 27136 1 50 . 1 1 16 16 GLN CB C 13 32.768 0.3 . 1 . . . . 12 GLN CB . 27136 1 51 . 1 1 16 16 GLN N N 15 115.687 0.2 . 1 . . . . 12 GLN N . 27136 1 52 . 1 1 17 17 GLU H H 1 8.99 0.02 . 1 . . . . 13 GLU H . 27136 1 53 . 1 1 17 17 GLU CA C 13 55.212 0.3 . 1 . . . . 13 GLU CA . 27136 1 54 . 1 1 17 17 GLU CB C 13 33.633 0.3 . 1 . . . . 13 GLU CB . 27136 1 55 . 1 1 17 17 GLU N N 15 121.009 0.2 . 1 . . . . 13 GLU N . 27136 1 56 . 1 1 18 18 ASN H H 1 9.237 0.02 . 1 . . . . 14 ASN H . 27136 1 57 . 1 1 18 18 ASN CB C 13 36.23 0.3 . 1 . . . . 14 ASN CB . 27136 1 58 . 1 1 18 18 ASN N N 15 118.409 0.2 . 1 . . . . 14 ASN N . 27136 1 59 . 1 1 19 19 PHE H H 1 8.319 0.02 . 1 . . . . 15 PHE H . 27136 1 60 . 1 1 19 19 PHE CA C 13 61.334 0.3 . 1 . . . . 15 PHE CA . 27136 1 61 . 1 1 19 19 PHE CB C 13 39.817 0.3 . 1 . . . . 15 PHE CB . 27136 1 62 . 1 1 19 19 PHE N N 15 117.796 0.2 . 1 . . . . 15 PHE N . 27136 1 63 . 1 1 20 20 GLU H H 1 9.437 0.02 . 1 . . . . 16 GLU H . 27136 1 64 . 1 1 20 20 GLU CB C 13 28.13 0.3 . 1 . . . . 16 GLU CB . 27136 1 65 . 1 1 20 20 GLU N N 15 119.034 0.2 . 1 . . . . 16 GLU N . 27136 1 66 . 1 1 21 21 ALA H H 1 8.183 0.02 . 1 . . . . 17 ALA H . 27136 1 67 . 1 1 21 21 ALA CA C 13 54.594 0.3 . 1 . . . . 17 ALA CA . 27136 1 68 . 1 1 21 21 ALA CB C 13 18.114 0.3 . 1 . . . . 17 ALA CB . 27136 1 69 . 1 1 21 21 ALA N N 15 119.325 0.2 . 1 . . . . 17 ALA N . 27136 1 70 . 1 1 22 22 PHE H H 1 7.62 0.02 . 1 . . . . 18 PHE H . 27136 1 71 . 1 1 22 22 PHE CA C 13 62.199 0.3 . 1 . . . . 18 PHE CA . 27136 1 72 . 1 1 22 22 PHE CB C 13 39.569 0.3 . 1 . . . . 18 PHE CB . 27136 1 73 . 1 1 22 22 PHE N N 15 118.674 0.2 . 1 . . . . 18 PHE N . 27136 1 74 . 1 1 23 23 MET H H 1 7.856 0.02 . 1 . . . . 19 MET H . 27136 1 75 . 1 1 23 23 MET CA C 13 56.573 0.3 . 1 . . . . 19 MET CA . 27136 1 76 . 1 1 23 23 MET CB C 13 32.149 0.3 . 1 . . . . 19 MET CB . 27136 1 77 . 1 1 23 23 MET N N 15 115.542 0.2 . 1 . . . . 19 MET N . 27136 1 78 . 1 1 24 24 LYS H H 1 7.849 0.02 . 1 . . . . 20 LYS H . 27136 1 79 . 1 1 24 24 LYS CA C 13 58.675 0.3 . 1 . . . . 20 LYS CA . 27136 1 80 . 1 1 24 24 LYS N N 15 116.988 0.2 . 1 . . . . 20 LYS N . 27136 1 81 . 1 1 25 25 ALA H H 1 7.54 0.02 . 1 . . . . 21 ALA H . 27136 1 82 . 1 1 25 25 ALA CA C 13 54.656 0.3 . 1 . . . . 21 ALA CA . 27136 1 83 . 1 1 25 25 ALA CB C 13 18.299 0.3 . 1 . . . . 21 ALA CB . 27136 1 84 . 1 1 25 25 ALA N N 15 123.084 0.2 . 1 . . . . 21 ALA N . 27136 1 85 . 1 1 26 26 ILE H H 1 7.267 0.02 . 1 . . . . 22 ILE H . 27136 1 86 . 1 1 26 26 ILE CA C 13 61.828 0.3 . 1 . . . . 22 ILE CA . 27136 1 87 . 1 1 26 26 ILE CB C 13 37.281 0.3 . 1 . . . . 22 ILE CB . 27136 1 88 . 1 1 26 26 ILE N N 15 109.935 0.2 . 1 . . . . 22 ILE N . 27136 1 89 . 1 1 27 27 GLY H H 1 7.368 0.02 . 1 . . . . 23 GLY H . 27136 1 90 . 1 1 27 27 GLY CA C 13 45.814 0.3 . 1 . . . . 23 GLY CA . 27136 1 91 . 1 1 27 27 GLY N N 15 108.925 0.2 . 1 . . . . 23 GLY N . 27136 1 92 . 1 1 28 28 LEU H H 1 7.437 0.02 . 1 . . . . 24 LEU H . 27136 1 93 . 1 1 28 28 LEU CA C 13 52.801 0.3 . 1 . . . . 24 LEU CA . 27136 1 94 . 1 1 28 28 LEU CB C 13 40.868 0.3 . 1 . . . . 24 LEU CB . 27136 1 95 . 1 1 28 28 LEU N N 15 121.767 0.2 . 1 . . . . 24 LEU N . 27136 1 96 . 1 1 30 30 GLU H H 1 8.657 0.02 . 1 . . . . 26 GLU H . 27136 1 97 . 1 1 30 30 GLU CA C 13 59.355 0.3 . 1 . . . . 26 GLU CA . 27136 1 98 . 1 1 30 30 GLU CB C 13 29.305 0.3 . 1 . . . . 26 GLU CB . 27136 1 99 . 1 1 30 30 GLU N N 15 122.107 0.2 . 1 . . . . 26 GLU N . 27136 1 100 . 1 1 31 31 GLU H H 1 9.168 0.02 . 1 . . . . 27 GLU H . 27136 1 101 . 1 1 31 31 GLU CA C 13 59.726 0.3 . 1 . . . . 27 GLU CA . 27136 1 102 . 1 1 31 31 GLU CB C 13 28.934 0.3 . 1 . . . . 27 GLU CB . 27136 1 103 . 1 1 31 31 GLU N N 15 117.524 0.2 . 1 . . . . 27 GLU N . 27136 1 104 . 1 1 32 32 LEU H H 1 7.176 0.02 . 1 . . . . 28 LEU H . 27136 1 105 . 1 1 32 32 LEU CA C 13 56.696 0.3 . 1 . . . . 28 LEU CA . 27136 1 106 . 1 1 32 32 LEU CB C 13 41.733 0.3 . 1 . . . . 28 LEU CB . 27136 1 107 . 1 1 32 32 LEU N N 15 117.078 0.2 . 1 . . . . 28 LEU N . 27136 1 108 . 1 1 33 33 ILE H H 1 7.434 0.02 . 1 . . . . 29 ILE H . 27136 1 109 . 1 1 33 33 ILE CA C 13 65.724 0.3 . 1 . . . . 29 ILE CA . 27136 1 110 . 1 1 33 33 ILE CB C 13 37.22 0.3 . 1 . . . . 29 ILE CB . 27136 1 111 . 1 1 33 33 ILE N N 15 120.969 0.2 . 1 . . . . 29 ILE N . 27136 1 112 . 1 1 34 34 GLN H H 1 8.127 0.02 . 1 . . . . 30 GLN H . 27136 1 113 . 1 1 34 34 GLN CA C 13 58.49 0.3 . 1 . . . . 30 GLN CA . 27136 1 114 . 1 1 34 34 GLN CB C 13 27.759 0.3 . 1 . . . . 30 GLN CB . 27136 1 115 . 1 1 34 34 GLN N N 15 116.353 0.2 . 1 . . . . 30 GLN N . 27136 1 116 . 1 1 35 35 LYS H H 1 7.48 0.02 . 1 . . . . 31 LYS H . 27136 1 117 . 1 1 35 35 LYS CB C 13 33.201 0.3 . 1 . . . . 31 LYS CB . 27136 1 118 . 1 1 35 35 LYS N N 15 116.1 0.2 . 1 . . . . 31 LYS N . 27136 1 119 . 1 1 36 36 GLY H H 1 8.076 0.02 . 1 . . . . 32 GLY H . 27136 1 120 . 1 1 36 36 GLY CA C 13 46.061 0.3 . 1 . . . . 32 GLY CA . 27136 1 121 . 1 1 36 36 GLY N N 15 104.127 0.2 . 1 . . . . 32 GLY N . 27136 1 122 . 1 1 37 37 LYS H H 1 7.497 0.02 . 1 . . . . 33 LYS H . 27136 1 123 . 1 1 37 37 LYS CA C 13 58.799 0.3 . 1 . . . . 33 LYS CA . 27136 1 124 . 1 1 37 37 LYS CB C 13 32.026 0.3 . 1 . . . . 33 LYS CB . 27136 1 125 . 1 1 37 37 LYS N N 15 119.309 0.2 . 1 . . . . 33 LYS N . 27136 1 126 . 1 1 38 38 ASP H H 1 7.605 0.02 . 1 . . . . 34 ASP H . 27136 1 127 . 1 1 38 38 ASP CA C 13 54.223 0.3 . 1 . . . . 34 ASP CA . 27136 1 128 . 1 1 38 38 ASP CB C 13 41.424 0.3 . 1 . . . . 34 ASP CB . 27136 1 129 . 1 1 38 38 ASP N N 15 117.165 0.2 . 1 . . . . 34 ASP N . 27136 1 130 . 1 1 39 39 ILE H H 1 7.272 0.02 . 1 . . . . 35 ILE H . 27136 1 131 . 1 1 39 39 ILE CA C 13 60.839 0.3 . 1 . . . . 35 ILE CA . 27136 1 132 . 1 1 39 39 ILE CB C 13 37.529 0.3 . 1 . . . . 35 ILE CB . 27136 1 133 . 1 1 39 39 ILE N N 15 120.271 0.2 . 1 . . . . 35 ILE N . 27136 1 134 . 1 1 41 41 GLY H H 1 7.788 0.02 . 1 . . . . 37 GLY H . 27136 1 135 . 1 1 41 41 GLY CA C 13 45.258 0.3 . 1 . . . . 37 GLY CA . 27136 1 136 . 1 1 41 41 GLY N N 15 111.121 0.2 . 1 . . . . 37 GLY N . 27136 1 137 . 1 1 42 42 VAL H H 1 8.154 0.02 . 1 . . . . 38 VAL H . 27136 1 138 . 1 1 42 42 VAL CA C 13 60.654 0.3 . 1 . . . . 38 VAL CA . 27136 1 139 . 1 1 42 42 VAL CB C 13 35.674 0.3 . 1 . . . . 38 VAL CB . 27136 1 140 . 1 1 42 42 VAL N N 15 120.114 0.2 . 1 . . . . 38 VAL N . 27136 1 141 . 1 1 43 43 SER H H 1 8.948 0.02 . 1 . . . . 39 SER H . 27136 1 142 . 1 1 43 43 SER CA C 13 56.882 0.3 . 1 . . . . 39 SER CA . 27136 1 143 . 1 1 43 43 SER CB C 13 65.662 0.3 . 1 . . . . 39 SER CB . 27136 1 144 . 1 1 43 43 SER N N 15 119.979 0.2 . 1 . . . . 39 SER N . 27136 1 145 . 1 1 44 44 GLU H H 1 9.336 0.02 . 1 . . . . 40 GLU H . 27136 1 146 . 1 1 44 44 GLU CA C 13 54.903 0.3 . 1 . . . . 40 GLU CA . 27136 1 147 . 1 1 44 44 GLU CB C 13 31.84 0.3 . 1 . . . . 40 GLU CB . 27136 1 148 . 1 1 44 44 GLU N N 15 126.565 0.2 . 1 . . . . 40 GLU N . 27136 1 149 . 1 1 45 45 ILE H H 1 9.496 0.02 . 1 . . . . 41 ILE H . 27136 1 150 . 1 1 45 45 ILE CA C 13 60.221 0.3 . 1 . . . . 41 ILE CA . 27136 1 151 . 1 1 45 45 ILE CB C 13 39.507 0.3 . 1 . . . . 41 ILE CB . 27136 1 152 . 1 1 45 45 ILE N N 15 126.151 0.2 . 1 . . . . 41 ILE N . 27136 1 153 . 1 1 46 46 VAL H H 1 8.937 0.02 . 1 . . . . 42 VAL H . 27136 1 154 . 1 1 46 46 VAL CA C 13 62.261 0.3 . 1 . . . . 42 VAL CA . 27136 1 155 . 1 1 46 46 VAL CB C 13 33.819 0.3 . 1 . . . . 42 VAL CB . 27136 1 156 . 1 1 46 46 VAL N N 15 128.59 0.2 . 1 . . . . 42 VAL N . 27136 1 157 . 1 1 47 47 GLN H H 1 8.42 0.02 . 1 . . . . 43 GLN H . 27136 1 158 . 1 1 47 47 GLN CA C 13 53.419 0.3 . 1 . . . . 43 GLN CA . 27136 1 159 . 1 1 47 47 GLN CB C 13 29.553 0.3 . 1 . . . . 43 GLN CB . 27136 1 160 . 1 1 47 47 GLN N N 15 131.142 0.2 . 1 . . . . 43 GLN N . 27136 1 161 . 1 1 48 48 ASN H H 1 8.939 0.02 . 1 . . . . 44 ASN H . 27136 1 162 . 1 1 48 48 ASN CA C 13 51.874 0.3 . 1 . . . . 44 ASN CA . 27136 1 163 . 1 1 48 48 ASN CB C 13 39.384 0.3 . 1 . . . . 44 ASN CB . 27136 1 164 . 1 1 48 48 ASN N N 15 127.196 0.2 . 1 . . . . 44 ASN N . 27136 1 165 . 1 1 50 50 LYS H H 1 8.677 0.02 . 1 . . . . 46 LYS H . 27136 1 166 . 1 1 50 50 LYS CB C 13 33.51 0.3 . 1 . . . . 46 LYS CB . 27136 1 167 . 1 1 50 50 LYS N N 15 125.932 0.2 . 1 . . . . 46 LYS N . 27136 1 168 . 1 1 51 51 HIS H H 1 7.928 0.02 . 1 . . . . 47 HIS H . 27136 1 169 . 1 1 51 51 HIS CA C 13 56.078 0.3 . 1 . . . . 47 HIS CA . 27136 1 170 . 1 1 51 51 HIS CB C 13 31.593 0.3 . 1 . . . . 47 HIS CB . 27136 1 171 . 1 1 51 51 HIS N N 15 120.018 0.2 . 1 . . . . 47 HIS N . 27136 1 172 . 1 1 52 52 PHE H H 1 8.707 0.02 . 1 . . . . 48 PHE H . 27136 1 173 . 1 1 52 52 PHE CA C 13 56.635 0.3 . 1 . . . . 48 PHE CA . 27136 1 174 . 1 1 52 52 PHE CB C 13 43.341 0.3 . 1 . . . . 48 PHE CB . 27136 1 175 . 1 1 52 52 PHE N N 15 124.879 0.2 . 1 . . . . 48 PHE N . 27136 1 176 . 1 1 53 53 LYS H H 1 8.096 0.02 . 1 . . . . 49 LYS H . 27136 1 177 . 1 1 53 53 LYS CA C 13 55.398 0.3 . 1 . . . . 49 LYS CA . 27136 1 178 . 1 1 53 53 LYS CB C 13 35.55 0.3 . 1 . . . . 49 LYS CB . 27136 1 179 . 1 1 53 53 LYS N N 15 118.969 0.2 . 1 . . . . 49 LYS N . 27136 1 180 . 1 1 54 54 PHE H H 1 9.459 0.02 . 1 . . . . 50 PHE H . 27136 1 181 . 1 1 54 54 PHE CA C 13 56.511 0.3 . 1 . . . . 50 PHE CA . 27136 1 182 . 1 1 54 54 PHE CB C 13 42.846 0.3 . 1 . . . . 50 PHE CB . 27136 1 183 . 1 1 54 54 PHE N N 15 125.218 0.2 . 1 . . . . 50 PHE N . 27136 1 184 . 1 1 55 55 THR H H 1 9.301 0.02 . 1 . . . . 51 THR H . 27136 1 185 . 1 1 55 55 THR CA C 13 62.57 0.3 . 1 . . . . 51 THR CA . 27136 1 186 . 1 1 55 55 THR CB C 13 69.805 0.3 . 1 . . . . 51 THR CB . 27136 1 187 . 1 1 55 55 THR N N 15 120.989 0.2 . 1 . . . . 51 THR N . 27136 1 188 . 1 1 56 56 ILE H H 1 9.42 0.02 . 1 . . . . 52 ILE H . 27136 1 189 . 1 1 56 56 ILE CA C 13 60.53 0.3 . 1 . . . . 52 ILE CA . 27136 1 190 . 1 1 56 56 ILE CB C 13 40.311 0.3 . 1 . . . . 52 ILE CB . 27136 1 191 . 1 1 56 56 ILE N N 15 130.916 0.2 . 1 . . . . 52 ILE N . 27136 1 192 . 1 1 57 57 THR H H 1 8.844 0.02 . 1 . . . . 53 THR H . 27136 1 193 . 1 1 57 57 THR CA C 13 61.581 0.3 . 1 . . . . 53 THR CA . 27136 1 194 . 1 1 57 57 THR CB C 13 70.361 0.3 . 1 . . . . 53 THR CB . 27136 1 195 . 1 1 57 57 THR N N 15 122.26 0.2 . 1 . . . . 53 THR N . 27136 1 196 . 1 1 58 58 ALA H H 1 8.94 0.02 . 1 . . . . 54 ALA H . 27136 1 197 . 1 1 58 58 ALA CA C 13 51.132 0.3 . 1 . . . . 54 ALA CA . 27136 1 198 . 1 1 58 58 ALA CB C 13 19.969 0.3 . 1 . . . . 54 ALA CB . 27136 1 199 . 1 1 58 58 ALA N N 15 130.344 0.2 . 1 . . . . 54 ALA N . 27136 1 200 . 1 1 59 59 GLY H H 1 8.912 0.02 . 1 . . . . 55 GLY H . 27136 1 201 . 1 1 59 59 GLY CA C 13 46.68 0.3 . 1 . . . . 55 GLY CA . 27136 1 202 . 1 1 59 59 GLY N N 15 115.119 0.2 . 1 . . . . 55 GLY N . 27136 1 203 . 1 1 60 60 SER H H 1 8.885 0.02 . 1 . . . . 56 SER H . 27136 1 204 . 1 1 60 60 SER N N 15 122.273 0.2 . 1 . . . . 56 SER N . 27136 1 205 . 1 1 61 61 LYS H H 1 7.771 0.02 . 1 . . . . 57 LYS H . 27136 1 206 . 1 1 61 61 LYS CA C 13 55.583 0.3 . 1 . . . . 57 LYS CA . 27136 1 207 . 1 1 61 61 LYS CB C 13 34.004 0.3 . 1 . . . . 57 LYS CB . 27136 1 208 . 1 1 61 61 LYS N N 15 124.155 0.2 . 1 . . . . 57 LYS N . 27136 1 209 . 1 1 62 62 VAL H H 1 8.223 0.02 . 1 . . . . 58 VAL H . 27136 1 210 . 1 1 62 62 VAL CA C 13 60.654 0.3 . 1 . . . . 58 VAL CA . 27136 1 211 . 1 1 62 62 VAL N N 15 125.433 0.2 . 1 . . . . 58 VAL N . 27136 1 212 . 1 1 63 63 ILE H H 1 8.991 0.02 . 1 . . . . 59 ILE H . 27136 1 213 . 1 1 63 63 ILE CA C 13 58.984 0.3 . 1 . . . . 59 ILE CA . 27136 1 214 . 1 1 63 63 ILE CB C 13 41.486 0.3 . 1 . . . . 59 ILE CB . 27136 1 215 . 1 1 63 63 ILE N N 15 125.17 0.2 . 1 . . . . 59 ILE N . 27136 1 216 . 1 1 65 65 ASN H H 1 9.104 0.02 . 1 . . . . 61 ASN H . 27136 1 217 . 1 1 65 65 ASN CA C 13 52.059 0.3 . 1 . . . . 61 ASN CA . 27136 1 218 . 1 1 65 65 ASN CB C 13 44.825 0.3 . 1 . . . . 61 ASN CB . 27136 1 219 . 1 1 65 65 ASN N N 15 121.865 0.2 . 1 . . . . 61 ASN N . 27136 1 220 . 1 1 66 66 GLU H H 1 8.979 0.02 . 1 . . . . 62 GLU H . 27136 1 221 . 1 1 66 66 GLU CA C 13 54.842 0.3 . 1 . . . . 62 GLU CA . 27136 1 222 . 1 1 66 66 GLU CB C 13 33.448 0.3 . 1 . . . . 62 GLU CB . 27136 1 223 . 1 1 66 66 GLU N N 15 122.211 0.2 . 1 . . . . 62 GLU N . 27136 1 224 . 1 1 67 67 PHE H H 1 8.221 0.02 . 1 . . . . 63 PHE H . 27136 1 225 . 1 1 67 67 PHE CA C 13 56.573 0.3 . 1 . . . . 63 PHE CA . 27136 1 226 . 1 1 67 67 PHE CB C 13 41.3 0.3 . 1 . . . . 63 PHE CB . 27136 1 227 . 1 1 67 67 PHE N N 15 115.486 0.2 . 1 . . . . 63 PHE N . 27136 1 228 . 1 1 68 68 THR H H 1 9.019 0.02 . 1 . . . . 64 THR H . 27136 1 229 . 1 1 68 68 THR CA C 13 61.025 0.3 . 1 . . . . 64 THR CA . 27136 1 230 . 1 1 68 68 THR CB C 13 70.361 0.3 . 1 . . . . 64 THR CB . 27136 1 231 . 1 1 68 68 THR N N 15 118.014 0.2 . 1 . . . . 64 THR N . 27136 1 232 . 1 1 69 69 VAL H H 1 9.137 0.02 . 1 . . . . 65 VAL H . 27136 1 233 . 1 1 69 69 VAL CA C 13 64.116 0.3 . 1 . . . . 65 VAL CA . 27136 1 234 . 1 1 69 69 VAL CB C 13 31.778 0.3 . 1 . . . . 65 VAL CB . 27136 1 235 . 1 1 69 69 VAL N N 15 125.17 0.2 . 1 . . . . 65 VAL N . 27136 1 236 . 1 1 70 70 GLY H H 1 8.787 0.02 . 1 . . . . 66 GLY H . 27136 1 237 . 1 1 70 70 GLY CA C 13 45.134 0.3 . 1 . . . . 66 GLY CA . 27136 1 238 . 1 1 70 70 GLY N N 15 109.412 0.2 . 1 . . . . 66 GLY N . 27136 1 239 . 1 1 71 71 GLU H H 1 7.753 0.02 . 1 . . . . 67 GLU H . 27136 1 240 . 1 1 71 71 GLU CA C 13 54.038 0.3 . 1 . . . . 67 GLU CA . 27136 1 241 . 1 1 71 71 GLU CB C 13 31.655 0.3 . 1 . . . . 67 GLU CB . 27136 1 242 . 1 1 71 71 GLU N N 15 119.065 0.2 . 1 . . . . 67 GLU N . 27136 1 243 . 1 1 72 72 GLU H H 1 8.98 0.02 . 1 . . . . 68 GLU H . 27136 1 244 . 1 1 72 72 GLU CA C 13 57.995 0.3 . 1 . . . . 68 GLU CA . 27136 1 245 . 1 1 72 72 GLU CB C 13 29.862 0.3 . 1 . . . . 68 GLU CB . 27136 1 246 . 1 1 72 72 GLU N N 15 125.997 0.2 . 1 . . . . 68 GLU N . 27136 1 247 . 1 1 73 73 CYS H H 1 8.958 0.02 . 1 . . . . 69 CYS H . 27136 1 248 . 1 1 73 73 CYS CA C 13 55.212 0.3 . 1 . . . . 69 CYS CA . 27136 1 249 . 1 1 73 73 CYS CB C 13 32.026 0.3 . 1 . . . . 69 CYS CB . 27136 1 250 . 1 1 73 73 CYS N N 15 121.97 0.2 . 1 . . . . 69 CYS N . 27136 1 251 . 1 1 74 74 GLU H H 1 8.387 0.02 . 1 . . . . 70 GLU H . 27136 1 252 . 1 1 74 74 GLU CA C 13 55.027 0.3 . 1 . . . . 70 GLU CA . 27136 1 253 . 1 1 74 74 GLU CB C 13 31.778 0.3 . 1 . . . . 70 GLU CB . 27136 1 254 . 1 1 74 74 GLU N N 15 119.979 0.2 . 1 . . . . 70 GLU N . 27136 1 255 . 1 1 75 75 LEU H H 1 8.933 0.02 . 1 . . . . 71 LEU H . 27136 1 256 . 1 1 75 75 LEU CA C 13 52.801 0.3 . 1 . . . . 71 LEU CA . 27136 1 257 . 1 1 75 75 LEU CB C 13 44.145 0.3 . 1 . . . . 71 LEU CB . 27136 1 258 . 1 1 75 75 LEU N N 15 126.478 0.2 . 1 . . . . 71 LEU N . 27136 1 259 . 1 1 76 76 GLU H H 1 8.741 0.02 . 1 . . . . 72 GLU H . 27136 1 260 . 1 1 76 76 GLU CA C 13 54.842 0.3 . 1 . . . . 72 GLU CA . 27136 1 261 . 1 1 76 76 GLU CB C 13 32.026 0.3 . 1 . . . . 72 GLU CB . 27136 1 262 . 1 1 76 76 GLU N N 15 123.273 0.2 . 1 . . . . 72 GLU N . 27136 1 263 . 1 1 77 77 THR H H 1 8.47 0.02 . 1 . . . . 73 THR H . 27136 1 264 . 1 1 77 77 THR CA C 13 59.541 0.3 . 1 . . . . 73 THR CA . 27136 1 265 . 1 1 77 77 THR CB C 13 70.485 0.3 . 1 . . . . 73 THR CB . 27136 1 266 . 1 1 77 77 THR N N 15 114.292 0.2 . 1 . . . . 73 THR N . 27136 1 267 . 1 1 78 78 MET H H 1 9.457 0.02 . 1 . . . . 74 MET H . 27136 1 268 . 1 1 78 78 MET CA C 13 57.995 0.3 . 1 . . . . 74 MET CA . 27136 1 269 . 1 1 78 78 MET CB C 13 32.582 0.3 . 1 . . . . 74 MET CB . 27136 1 270 . 1 1 78 78 MET N N 15 117.899 0.2 . 1 . . . . 74 MET N . 27136 1 271 . 1 1 79 79 THR H H 1 7.879 0.02 . 1 . . . . 75 THR H . 27136 1 272 . 1 1 79 79 THR CA C 13 61.767 0.3 . 1 . . . . 75 THR CA . 27136 1 273 . 1 1 79 79 THR CB C 13 69.186 0.3 . 1 . . . . 75 THR CB . 27136 1 274 . 1 1 79 79 THR N N 15 107.136 0.2 . 1 . . . . 75 THR N . 27136 1 275 . 1 1 80 80 GLY H H 1 7.67 0.02 . 1 . . . . 76 GLY H . 27136 1 276 . 1 1 80 80 GLY CA C 13 44.639 0.3 . 1 . . . . 76 GLY CA . 27136 1 277 . 1 1 80 80 GLY N N 15 110.023 0.2 . 1 . . . . 76 GLY N . 27136 1 278 . 1 1 81 81 GLU H H 1 7.18 0.02 . 1 . . . . 77 GLU H . 27136 1 279 . 1 1 81 81 GLU CA C 13 56.14 0.3 . 1 . . . . 77 GLU CA . 27136 1 280 . 1 1 81 81 GLU CB C 13 29.862 0.3 . 1 . . . . 77 GLU CB . 27136 1 281 . 1 1 81 81 GLU N N 15 121.469 0.2 . 1 . . . . 77 GLU N . 27136 1 282 . 1 1 82 82 LYS H H 1 8.28 0.02 . 1 . . . . 78 LYS H . 27136 1 283 . 1 1 82 82 LYS CA C 13 54.471 0.3 . 1 . . . . 78 LYS CA . 27136 1 284 . 1 1 82 82 LYS CB C 13 33.695 0.3 . 1 . . . . 78 LYS CB . 27136 1 285 . 1 1 82 82 LYS N N 15 121.655 0.2 . 1 . . . . 78 LYS N . 27136 1 286 . 1 1 83 83 VAL H H 1 8.741 0.02 . 1 . . . . 79 VAL H . 27136 1 287 . 1 1 83 83 VAL CA C 13 60.097 0.3 . 1 . . . . 79 VAL CA . 27136 1 288 . 1 1 83 83 VAL N N 15 122.51 0.2 . 1 . . . . 79 VAL N . 27136 1 289 . 1 1 84 84 LYS H H 1 8.081 0.02 . 1 . . . . 80 LYS H . 27136 1 290 . 1 1 84 84 LYS CA C 13 54.78 0.3 . 1 . . . . 80 LYS CA . 27136 1 291 . 1 1 84 84 LYS CB C 13 33.139 0.3 . 1 . . . . 80 LYS CB . 27136 1 292 . 1 1 84 84 LYS N N 15 126.155 0.2 . 1 . . . . 80 LYS N . 27136 1 293 . 1 1 85 85 THR H H 1 8.372 0.02 . 1 . . . . 81 THR H . 27136 1 294 . 1 1 85 85 THR CA C 13 59.417 0.3 . 1 . . . . 81 THR CA . 27136 1 295 . 1 1 85 85 THR CB C 13 69.557 0.3 . 1 . . . . 81 THR CB . 27136 1 296 . 1 1 85 85 THR N N 15 117.988 0.2 . 1 . . . . 81 THR N . 27136 1 297 . 1 1 86 86 VAL H H 1 8.079 0.02 . 1 . . . . 82 VAL H . 27136 1 298 . 1 1 86 86 VAL CA C 13 61.396 0.3 . 1 . . . . 82 VAL CA . 27136 1 299 . 1 1 86 86 VAL CB C 13 34.561 0.3 . 1 . . . . 82 VAL CB . 27136 1 300 . 1 1 86 86 VAL N N 15 120.094 0.2 . 1 . . . . 82 VAL N . 27136 1 301 . 1 1 87 87 VAL H H 1 9.743 0.02 . 1 . . . . 83 VAL H . 27136 1 302 . 1 1 87 87 VAL CA C 13 61.025 0.3 . 1 . . . . 83 VAL CA . 27136 1 303 . 1 1 87 87 VAL CB C 13 31.717 0.3 . 1 . . . . 83 VAL CB . 27136 1 304 . 1 1 87 87 VAL N N 15 133.832 0.2 . 1 . . . . 83 VAL N . 27136 1 305 . 1 1 88 88 GLN H H 1 8.811 0.02 . 1 . . . . 84 GLN H . 27136 1 306 . 1 1 88 88 GLN CA C 13 53.667 0.3 . 1 . . . . 84 GLN CA . 27136 1 307 . 1 1 88 88 GLN CB C 13 30.666 0.3 . 1 . . . . 84 GLN CB . 27136 1 308 . 1 1 88 88 GLN N N 15 124.549 0.2 . 1 . . . . 84 GLN N . 27136 1 309 . 1 1 89 89 LEU H H 1 8.454 0.02 . 1 . . . . 85 LEU H . 27136 1 310 . 1 1 89 89 LEU CA C 13 53.914 0.3 . 1 . . . . 85 LEU CA . 27136 1 311 . 1 1 89 89 LEU CB C 13 44.33 0.3 . 1 . . . . 85 LEU CB . 27136 1 312 . 1 1 89 89 LEU N N 15 123.386 0.2 . 1 . . . . 85 LEU N . 27136 1 313 . 1 1 90 90 GLU H H 1 9.033 0.02 . 1 . . . . 86 GLU H . 27136 1 314 . 1 1 90 90 GLU CA C 13 55.212 0.3 . 1 . . . . 86 GLU CA . 27136 1 315 . 1 1 90 90 GLU CB C 13 31.407 0.3 . 1 . . . . 86 GLU CB . 27136 1 316 . 1 1 90 90 GLU N N 15 128.253 0.2 . 1 . . . . 86 GLU N . 27136 1 317 . 1 1 91 91 GLY H H 1 8.387 0.02 . 1 . . . . 87 GLY H . 27136 1 318 . 1 1 91 91 GLY CA C 13 45.752 0.3 . 1 . . . . 87 GLY CA . 27136 1 319 . 1 1 91 91 GLY N N 15 112.615 0.2 . 1 . . . . 87 GLY N . 27136 1 320 . 1 1 92 92 ASP H H 1 8.416 0.02 . 1 . . . . 88 ASP H . 27136 1 321 . 1 1 92 92 ASP CA C 13 54.594 0.3 . 1 . . . . 88 ASP CA . 27136 1 322 . 1 1 92 92 ASP CB C 13 41.548 0.3 . 1 . . . . 88 ASP CB . 27136 1 323 . 1 1 92 92 ASP N N 15 117.902 0.2 . 1 . . . . 88 ASP N . 27136 1 324 . 1 1 93 93 ASN H H 1 8.111 0.02 . 1 . . . . 89 ASN H . 27136 1 325 . 1 1 93 93 ASN CA C 13 53.172 0.3 . 1 . . . . 89 ASN CA . 27136 1 326 . 1 1 93 93 ASN CB C 13 39.446 0.3 . 1 . . . . 89 ASN CB . 27136 1 327 . 1 1 93 93 ASN N N 15 114.472 0.2 . 1 . . . . 89 ASN N . 27136 1 328 . 1 1 94 94 LYS H H 1 7.4 0.02 . 1 . . . . 90 LYS H . 27136 1 329 . 1 1 94 94 LYS CA C 13 55.027 0.3 . 1 . . . . 90 LYS CA . 27136 1 330 . 1 1 94 94 LYS CB C 13 35.798 0.3 . 1 . . . . 90 LYS CB . 27136 1 331 . 1 1 94 94 LYS N N 15 118.29 0.2 . 1 . . . . 90 LYS N . 27136 1 332 . 1 1 95 95 LEU H H 1 8.902 0.02 . 1 . . . . 91 LEU H . 27136 1 333 . 1 1 95 95 LEU CA C 13 52.677 0.3 . 1 . . . . 91 LEU CA . 27136 1 334 . 1 1 95 95 LEU CB C 13 44.207 0.3 . 1 . . . . 91 LEU CB . 27136 1 335 . 1 1 95 95 LEU N N 15 123.741 0.2 . 1 . . . . 91 LEU N . 27136 1 336 . 1 1 96 96 VAL H H 1 9.234 0.02 . 1 . . . . 92 VAL H . 27136 1 337 . 1 1 96 96 VAL CA C 13 60.468 0.3 . 1 . . . . 92 VAL CA . 27136 1 338 . 1 1 96 96 VAL CB C 13 35.55 0.3 . 1 . . . . 92 VAL CB . 27136 1 339 . 1 1 96 96 VAL N N 15 123.067 0.2 . 1 . . . . 92 VAL N . 27136 1 340 . 1 1 97 97 THR H H 1 8.726 0.02 . 1 . . . . 93 THR H . 27136 1 341 . 1 1 97 97 THR CA C 13 61.272 0.3 . 1 . . . . 93 THR CA . 27136 1 342 . 1 1 97 97 THR CB C 13 69.372 0.3 . 1 . . . . 93 THR CB . 27136 1 343 . 1 1 97 97 THR N N 15 119.902 0.2 . 1 . . . . 93 THR N . 27136 1 344 . 1 1 98 98 THR H H 1 8.048 0.02 . 1 . . . . 94 THR H . 27136 1 345 . 1 1 98 98 THR CA C 13 60.468 0.3 . 1 . . . . 94 THR CA . 27136 1 346 . 1 1 98 98 THR CB C 13 71.289 0.3 . 1 . . . . 94 THR CB . 27136 1 347 . 1 1 98 98 THR N N 15 118.94 0.2 . 1 . . . . 94 THR N . 27136 1 348 . 1 1 99 99 PHE H H 1 8.649 0.02 . 1 . . . . 95 PHE H . 27136 1 349 . 1 1 99 99 PHE CA C 13 57.253 0.3 . 1 . . . . 95 PHE CA . 27136 1 350 . 1 1 99 99 PHE CB C 13 41.424 0.3 . 1 . . . . 95 PHE CB . 27136 1 351 . 1 1 99 99 PHE N N 15 124.869 0.2 . 1 . . . . 95 PHE N . 27136 1 352 . 1 1 100 100 LYS H H 1 8.774 0.02 . 1 . . . . 96 LYS H . 27136 1 353 . 1 1 100 100 LYS CA C 13 58.428 0.3 . 1 . . . . 96 LYS CA . 27136 1 354 . 1 1 100 100 LYS CB C 13 29.553 0.3 . 1 . . . . 96 LYS CB . 27136 1 355 . 1 1 100 100 LYS N N 15 124.994 0.2 . 1 . . . . 96 LYS N . 27136 1 356 . 1 1 102 102 ILE H H 1 8.563 0.02 . 1 . . . . 98 ILE H . 27136 1 357 . 1 1 102 102 ILE CA C 13 60.901 0.3 . 1 . . . . 98 ILE CA . 27136 1 358 . 1 1 102 102 ILE CB C 13 39.817 0.3 . 1 . . . . 98 ILE CB . 27136 1 359 . 1 1 102 102 ILE N N 15 121.963 0.2 . 1 . . . . 98 ILE N . 27136 1 360 . 1 1 103 103 LYS H H 1 8.345 0.02 . 1 . . . . 99 LYS H . 27136 1 361 . 1 1 103 103 LYS CA C 13 55.027 0.3 . 1 . . . . 99 LYS CA . 27136 1 362 . 1 1 103 103 LYS CB C 13 33.881 0.3 . 1 . . . . 99 LYS CB . 27136 1 363 . 1 1 103 103 LYS N N 15 127.623 0.2 . 1 . . . . 99 LYS N . 27136 1 364 . 1 1 104 104 SER H H 1 8.862 0.02 . 1 . . . . 100 SER H . 27136 1 365 . 1 1 104 104 SER CA C 13 56.078 0.3 . 1 . . . . 100 SER CA . 27136 1 366 . 1 1 104 104 SER CB C 13 64.487 0.3 . 1 . . . . 100 SER CB . 27136 1 367 . 1 1 104 104 SER N N 15 120.653 0.2 . 1 . . . . 100 SER N . 27136 1 368 . 1 1 105 105 VAL H H 1 8.867 0.02 . 1 . . . . 101 VAL H . 27136 1 369 . 1 1 105 105 VAL CA C 13 61.519 0.3 . 1 . . . . 101 VAL CA . 27136 1 370 . 1 1 105 105 VAL CB C 13 34.994 0.3 . 1 . . . . 101 VAL CB . 27136 1 371 . 1 1 105 105 VAL N N 15 128.33 0.2 . 1 . . . . 101 VAL N . 27136 1 372 . 1 1 106 106 THR H H 1 9.278 0.02 . 1 . . . . 102 THR H . 27136 1 373 . 1 1 106 106 THR CA C 13 61.952 0.3 . 1 . . . . 102 THR CA . 27136 1 374 . 1 1 106 106 THR CB C 13 70.052 0.3 . 1 . . . . 102 THR CB . 27136 1 375 . 1 1 106 106 THR N N 15 128.167 0.2 . 1 . . . . 102 THR N . 27136 1 376 . 1 1 107 107 GLU H H 1 8.94 0.02 . 1 . . . . 103 GLU H . 27136 1 377 . 1 1 107 107 GLU CA C 13 53.79 0.3 . 1 . . . . 103 GLU CA . 27136 1 378 . 1 1 107 107 GLU CB C 13 33.819 0.3 . 1 . . . . 103 GLU CB . 27136 1 379 . 1 1 107 107 GLU N N 15 127.109 0.2 . 1 . . . . 103 GLU N . 27136 1 380 . 1 1 108 108 LEU H H 1 8.418 0.02 . 1 . . . . 104 LEU H . 27136 1 381 . 1 1 108 108 LEU CA C 13 53.605 0.3 . 1 . . . . 104 LEU CA . 27136 1 382 . 1 1 108 108 LEU CB C 13 44.516 0.3 . 1 . . . . 104 LEU CB . 27136 1 383 . 1 1 108 108 LEU N N 15 128.441 0.2 . 1 . . . . 104 LEU N . 27136 1 384 . 1 1 109 109 ASN H H 1 8.85 0.02 . 1 . . . . 105 ASN H . 27136 1 385 . 1 1 109 109 ASN CA C 13 52.43 0.3 . 1 . . . . 105 ASN CA . 27136 1 386 . 1 1 109 109 ASN CB C 13 40.126 0.3 . 1 . . . . 105 ASN CB . 27136 1 387 . 1 1 109 109 ASN N N 15 126.278 0.2 . 1 . . . . 105 ASN N . 27136 1 388 . 1 1 110 110 GLY H H 1 8.881 0.02 . 1 . . . . 106 GLY H . 27136 1 389 . 1 1 110 110 GLY CA C 13 47.669 0.3 . 1 . . . . 106 GLY CA . 27136 1 390 . 1 1 110 110 GLY N N 15 115.475 0.2 . 1 . . . . 106 GLY N . 27136 1 391 . 1 1 111 111 ASP H H 1 8.86 0.02 . 1 . . . . 107 ASP H . 27136 1 392 . 1 1 111 111 ASP CA C 13 53.852 0.3 . 1 . . . . 107 ASP CA . 27136 1 393 . 1 1 111 111 ASP CB C 13 41.795 0.3 . 1 . . . . 107 ASP CB . 27136 1 394 . 1 1 111 111 ASP N N 15 127.109 0.2 . 1 . . . . 107 ASP N . 27136 1 395 . 1 1 112 112 ILE H H 1 7.87 0.02 . 1 . . . . 108 ILE H . 27136 1 396 . 1 1 112 112 ILE CA C 13 58.737 0.3 . 1 . . . . 108 ILE CA . 27136 1 397 . 1 1 112 112 ILE CB C 13 39.136 0.3 . 1 . . . . 108 ILE CB . 27136 1 398 . 1 1 112 112 ILE N N 15 119.931 0.2 . 1 . . . . 108 ILE N . 27136 1 399 . 1 1 113 113 ILE H H 1 8.701 0.02 . 1 . . . . 109 ILE H . 27136 1 400 . 1 1 113 113 ILE CA C 13 59.046 0.3 . 1 . . . . 109 ILE CA . 27136 1 401 . 1 1 113 113 ILE CB C 13 40.559 0.3 . 1 . . . . 109 ILE CB . 27136 1 402 . 1 1 113 113 ILE N N 15 126.364 0.2 . 1 . . . . 109 ILE N . 27136 1 403 . 1 1 114 114 THR H H 1 8.845 0.02 . 1 . . . . 110 THR H . 27136 1 404 . 1 1 114 114 THR CA C 13 61.21 0.3 . 1 . . . . 110 THR CA . 27136 1 405 . 1 1 114 114 THR CB C 13 69.743 0.3 . 1 . . . . 110 THR CB . 27136 1 406 . 1 1 114 114 THR N N 15 123.732 0.2 . 1 . . . . 110 THR N . 27136 1 407 . 1 1 115 115 ASN H H 1 9.149 0.02 . 1 . . . . 111 ASN H . 27136 1 408 . 1 1 115 115 ASN CA C 13 51.503 0.3 . 1 . . . . 111 ASN CA . 27136 1 409 . 1 1 115 115 ASN CB C 13 41.548 0.3 . 1 . . . . 111 ASN CB . 27136 1 410 . 1 1 115 115 ASN N N 15 127.349 0.2 . 1 . . . . 111 ASN N . 27136 1 411 . 1 1 116 116 THR H H 1 9.262 0.02 . 1 . . . . 112 THR H . 27136 1 412 . 1 1 116 116 THR CA C 13 61.828 0.3 . 1 . . . . 112 THR CA . 27136 1 413 . 1 1 116 116 THR CB C 13 69.495 0.3 . 1 . . . . 112 THR CB . 27136 1 414 . 1 1 116 116 THR N N 15 122.98 0.2 . 1 . . . . 112 THR N . 27136 1 415 . 1 1 117 117 MET H H 1 9.428 0.02 . 1 . . . . 113 MET H . 27136 1 416 . 1 1 117 117 MET CA C 13 53.914 0.3 . 1 . . . . 113 MET CA . 27136 1 417 . 1 1 117 117 MET CB C 13 36.23 0.3 . 1 . . . . 113 MET CB . 27136 1 418 . 1 1 117 117 MET N N 15 128.148 0.2 . 1 . . . . 113 MET N . 27136 1 419 . 1 1 118 118 THR H H 1 8.913 0.02 . 1 . . . . 114 THR H . 27136 1 420 . 1 1 118 118 THR CA C 13 60.839 0.3 . 1 . . . . 114 THR CA . 27136 1 421 . 1 1 118 118 THR CB C 13 70.794 0.3 . 1 . . . . 114 THR CB . 27136 1 422 . 1 1 118 118 THR N N 15 117.815 0.2 . 1 . . . . 114 THR N . 27136 1 423 . 1 1 119 119 LEU H H 1 8.668 0.02 . 1 . . . . 115 LEU H . 27136 1 424 . 1 1 119 119 LEU CA C 13 54.1 0.3 . 1 . . . . 115 LEU CA . 27136 1 425 . 1 1 119 119 LEU CB C 13 44.516 0.3 . 1 . . . . 115 LEU CB . 27136 1 426 . 1 1 119 119 LEU N N 15 128.811 0.2 . 1 . . . . 115 LEU N . 27136 1 427 . 1 1 120 120 GLY H H 1 9.246 0.02 . 1 . . . . 116 GLY H . 27136 1 428 . 1 1 120 120 GLY CA C 13 47.174 0.3 . 1 . . . . 116 GLY CA . 27136 1 429 . 1 1 120 120 GLY N N 15 117.937 0.2 . 1 . . . . 116 GLY N . 27136 1 430 . 1 1 121 121 ASP H H 1 8.617 0.02 . 1 . . . . 117 ASP H . 27136 1 431 . 1 1 121 121 ASP CA C 13 54.038 0.3 . 1 . . . . 117 ASP CA . 27136 1 432 . 1 1 121 121 ASP CB C 13 40.682 0.3 . 1 . . . . 117 ASP CB . 27136 1 433 . 1 1 121 121 ASP N N 15 126.268 0.2 . 1 . . . . 117 ASP N . 27136 1 434 . 1 1 122 122 ILE H H 1 8.291 0.02 . 1 . . . . 118 ILE H . 27136 1 435 . 1 1 122 122 ILE CA C 13 61.705 0.3 . 1 . . . . 118 ILE CA . 27136 1 436 . 1 1 122 122 ILE CB C 13 38.518 0.3 . 1 . . . . 118 ILE CB . 27136 1 437 . 1 1 122 122 ILE N N 15 122.549 0.2 . 1 . . . . 118 ILE N . 27136 1 438 . 1 1 123 123 VAL H H 1 8.331 0.02 . 1 . . . . 119 VAL H . 27136 1 439 . 1 1 123 123 VAL CA C 13 61.519 0.3 . 1 . . . . 119 VAL CA . 27136 1 440 . 1 1 123 123 VAL CB C 13 31.902 0.3 . 1 . . . . 119 VAL CB . 27136 1 441 . 1 1 123 123 VAL N N 15 127.537 0.2 . 1 . . . . 119 VAL N . 27136 1 442 . 1 1 124 124 PHE H H 1 9.268 0.02 . 1 . . . . 120 PHE H . 27136 1 443 . 1 1 124 124 PHE CA C 13 53.914 0.3 . 1 . . . . 120 PHE CA . 27136 1 444 . 1 1 124 124 PHE CB C 13 40.806 0.3 . 1 . . . . 120 PHE CB . 27136 1 445 . 1 1 124 124 PHE N N 15 131.541 0.2 . 1 . . . . 120 PHE N . 27136 1 446 . 1 1 125 125 LYS H H 1 7.982 0.02 . 1 . . . . 121 LYS H . 27136 1 447 . 1 1 125 125 LYS CA C 13 54.223 0.3 . 1 . . . . 121 LYS CA . 27136 1 448 . 1 1 125 125 LYS CB C 13 36.972 0.3 . 1 . . . . 121 LYS CB . 27136 1 449 . 1 1 125 125 LYS N N 15 127.902 0.2 . 1 . . . . 121 LYS N . 27136 1 450 . 1 1 126 126 ARG H H 1 8.612 0.02 . 1 . . . . 122 ARG H . 27136 1 451 . 1 1 126 126 ARG CA C 13 55.027 0.3 . 1 . . . . 122 ARG CA . 27136 1 452 . 1 1 126 126 ARG CB C 13 34.314 0.3 . 1 . . . . 122 ARG CB . 27136 1 453 . 1 1 126 126 ARG N N 15 121.914 0.2 . 1 . . . . 122 ARG N . 27136 1 454 . 1 1 127 127 ILE H H 1 8.678 0.02 . 1 . . . . 123 ILE H . 27136 1 455 . 1 1 127 127 ILE CA C 13 60.839 0.3 . 1 . . . . 123 ILE CA . 27136 1 456 . 1 1 127 127 ILE CB C 13 39.446 0.3 . 1 . . . . 123 ILE CB . 27136 1 457 . 1 1 127 127 ILE N N 15 125.893 0.2 . 1 . . . . 123 ILE N . 27136 1 458 . 1 1 128 128 SER H H 1 9.212 0.02 . 1 . . . . 124 SER H . 27136 1 459 . 1 1 128 128 SER CA C 13 57.315 0.3 . 1 . . . . 124 SER CA . 27136 1 460 . 1 1 128 128 SER CB C 13 65.415 0.3 . 1 . . . . 124 SER CB . 27136 1 461 . 1 1 128 128 SER N N 15 122.547 0.2 . 1 . . . . 124 SER N . 27136 1 462 . 1 1 129 129 LYS H H 1 8.592 0.02 . 1 . . . . 125 LYS H . 27136 1 463 . 1 1 129 129 LYS CA C 13 54.285 0.3 . 1 . . . . 125 LYS CA . 27136 1 464 . 1 1 129 129 LYS CB C 13 36.91 0.3 . 1 . . . . 125 LYS CB . 27136 1 465 . 1 1 129 129 LYS N N 15 122.905 0.2 . 1 . . . . 125 LYS N . 27136 1 466 . 1 1 130 130 ARG H H 1 9.21 0.02 . 1 . . . . 126 ARG H . 27136 1 467 . 1 1 130 130 ARG CA C 13 57.006 0.3 . 1 . . . . 126 ARG CA . 27136 1 468 . 1 1 130 130 ARG CB C 13 31.346 0.3 . 1 . . . . 126 ARG CB . 27136 1 469 . 1 1 130 130 ARG N N 15 129.334 0.2 . 1 . . . . 126 ARG N . 27136 1 470 . 1 1 131 131 ILE H H 1 8.604 0.02 . 1 . . . . 127 ILE H . 27136 1 471 . 1 1 131 131 ILE CA C 13 60.654 0.3 . 1 . . . . 127 ILE CA . 27136 1 472 . 1 1 131 131 ILE CB C 13 39.322 0.3 . 1 . . . . 127 ILE CB . 27136 1 473 . 1 1 131 131 ILE N N 15 126.172 0.2 . 1 . . . . 127 ILE N . 27136 1 474 . 1 1 132 132 LEU H H 1 8.269 0.02 . 1 . . . . 128 LEU H . 27136 1 475 . 1 1 132 132 LEU CA C 13 54.656 0.3 . 1 . . . . 128 LEU CA . 27136 1 476 . 1 1 132 132 LEU CB C 13 42.413 0.3 . 1 . . . . 128 LEU CB . 27136 1 477 . 1 1 132 132 LEU N N 15 127.056 0.2 . 1 . . . . 128 LEU N . 27136 1 478 . 1 1 133 133 VAL H H 1 8.017 0.02 . 1 . . . . 129 VAL H . 27136 1 479 . 1 1 133 133 VAL CA C 13 59.417 0.3 . 1 . . . . 129 VAL CA . 27136 1 480 . 1 1 133 133 VAL CB C 13 32.52 0.3 . 1 . . . . 129 VAL CB . 27136 1 481 . 1 1 133 133 VAL N N 15 122.963 0.2 . 1 . . . . 129 VAL N . 27136 1 482 . 1 1 135 135 ARG H H 1 7.93 0.02 . 1 . . . . 131 ARG H . 27136 1 483 . 1 1 135 135 ARG CA C 13 57.686 0.3 . 1 . . . . 131 ARG CA . 27136 1 484 . 1 1 135 135 ARG CB C 13 30.851 0.3 . 1 . . . . 131 ARG CB . 27136 1 485 . 1 1 135 135 ARG N N 15 125.395 0.2 . 1 . . . . 131 ARG N . 27136 1 stop_ save_