################################### # 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 27757 _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' . . . 27757 1 2 '3D HNCO' . . . 27757 1 3 '3D HN(CA)CO' . . . 27757 1 4 '3D HNCA' . . . 27757 1 5 '3D HNCACB' . . . 27757 1 6 '3D CBCA(CO)NH' . . . 27757 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.Ambiguity_set_ID _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 23 23 ARG C C 13 178.943 0.00 . 1 . . . . . 23 ARG C . 27757 1 2 . 1 1 23 23 ARG CA C 13 49.752 0.05 . 1 . . . . . 23 ARG CA . 27757 1 3 . 1 1 24 24 GLY H H 1 8.199 0.01 . 1 . . . . . 24 GLY H . 27757 1 4 . 1 1 24 24 GLY C C 13 179.747 0.00 . 1 . . . . . 24 GLY C . 27757 1 5 . 1 1 24 24 GLY CA C 13 44.581 0.03 . 1 . . . . . 24 GLY CA . 27757 1 6 . 1 1 24 24 GLY N N 15 114.400 0.00 . 1 . . . . . 24 GLY N . 27757 1 7 . 1 1 25 25 LEU H H 1 7.919 0.00 . 1 . . . . . 25 LEU H . 27757 1 8 . 1 1 25 25 LEU C C 13 178.984 0.00 . 1 . . . . . 25 LEU C . 27757 1 9 . 1 1 25 25 LEU CA C 13 54.457 0.05 . 1 . . . . . 25 LEU CA . 27757 1 10 . 1 1 25 25 LEU CB C 13 42.886 0.00 . 1 . . . . . 25 LEU CB . 27757 1 11 . 1 1 25 25 LEU N N 15 121.394 0.00 . 1 . . . . . 25 LEU N . 27757 1 12 . 1 1 26 26 SER H H 1 8.770 0.00 . 1 . . . . . 26 SER H . 27757 1 13 . 1 1 26 26 SER C C 13 175.001 0.00 . 1 . . . . . 26 SER C . 27757 1 14 . 1 1 26 26 SER CA C 13 58.041 0.02 . 1 . . . . . 26 SER CA . 27757 1 15 . 1 1 26 26 SER CB C 13 65.307 0.02 . 1 . . . . . 26 SER CB . 27757 1 16 . 1 1 26 26 SER N N 15 118.498 0.00 . 1 . . . . . 26 SER N . 27757 1 17 . 1 1 27 27 GLU H H 1 8.620 0.01 . 1 . . . . . 27 GLU H . 27757 1 18 . 1 1 27 27 GLU C C 13 178.201 0.00 . 1 . . . . . 27 GLU C . 27757 1 19 . 1 1 27 27 GLU CA C 13 55.359 0.06 . 1 . . . . . 27 GLU CA . 27757 1 20 . 1 1 27 27 GLU CB C 13 28.658 0.29 . 1 . . . . . 27 GLU CB . 27757 1 21 . 1 1 27 27 GLU N N 15 117.386 0.01 . 1 . . . . . 27 GLU N . 27757 1 22 . 1 1 28 28 ALA H H 1 8.822 0.01 . 1 . . . . . 28 ALA H . 27757 1 23 . 1 1 28 28 ALA C C 13 178.465 0.12 . 1 . . . . . 28 ALA C . 27757 1 24 . 1 1 28 28 ALA CA C 13 51.432 0.06 . 1 . . . . . 28 ALA CA . 27757 1 25 . 1 1 28 28 ALA CB C 13 17.987 0.00 . 1 . . . . . 28 ALA CB . 27757 1 26 . 1 1 28 28 ALA N N 15 125.125 0.01 . 1 . . . . . 28 ALA N . 27757 1 27 . 1 1 29 29 LYS H H 1 8.434 0.00 . 1 . . . . . 29 LYS H . 27757 1 28 . 1 1 29 29 LYS C C 13 174.688 0.00 . 1 . . . . . 29 LYS C . 27757 1 29 . 1 1 29 29 LYS CA C 13 52.429 0.05 . 1 . . . . . 29 LYS CA . 27757 1 30 . 1 1 29 29 LYS CB C 13 34.221 0.00 . 1 . . . . . 29 LYS CB . 27757 1 31 . 1 1 29 29 LYS N N 15 122.125 0.02 . 1 . . . . . 29 LYS N . 27757 1 32 . 1 1 30 30 PRO C C 13 177.980 0.00 . 1 . . . . . 30 PRO C . 27757 1 33 . 1 1 30 30 PRO CA C 13 61.691 0.01 . 1 . . . . . 30 PRO CA . 27757 1 34 . 1 1 30 30 PRO CB C 13 31.293 0.00 . 1 . . . . . 30 PRO CB . 27757 1 35 . 1 1 31 31 ALA H H 1 7.251 0.01 . 1 . . . . . 31 ALA H . 27757 1 36 . 1 1 31 31 ALA C C 13 176.546 0.00 . 1 . . . . . 31 ALA C . 27757 1 37 . 1 1 31 31 ALA CA C 13 52.942 0.03 . 1 . . . . . 31 ALA CA . 27757 1 38 . 1 1 31 31 ALA CB C 13 18.627 0.00 . 1 . . . . . 31 ALA CB . 27757 1 39 . 1 1 31 31 ALA N N 15 120.515 0.03 . 1 . . . . . 31 ALA N . 27757 1 40 . 1 1 32 32 THR H H 1 6.148 0.01 . 1 . . . . . 32 THR H . 27757 1 41 . 1 1 32 32 THR C C 13 175.319 0.02 . 1 . . . . . 32 THR C . 27757 1 42 . 1 1 32 32 THR CA C 13 58.127 0.00 . 1 . . . . . 32 THR CA . 27757 1 43 . 1 1 32 32 THR CB C 13 68.389 0.00 . 1 . . . . . 32 THR CB . 27757 1 44 . 1 1 32 32 THR N N 15 110.008 0.09 . 1 . . . . . 32 THR N . 27757 1 45 . 1 1 33 33 PRO C C 13 179.890 0.00 . 1 . . . . . 33 PRO C . 27757 1 46 . 1 1 33 33 PRO CA C 13 65.238 0.05 . 1 . . . . . 33 PRO CA . 27757 1 47 . 1 1 34 34 GLU H H 1 8.470 0.00 . 1 . . . . . 34 GLU H . 27757 1 48 . 1 1 34 34 GLU C C 13 179.781 0.00 . 1 . . . . . 34 GLU C . 27757 1 49 . 1 1 34 34 GLU CA C 13 59.021 0.08 . 1 . . . . . 34 GLU CA . 27757 1 50 . 1 1 34 34 GLU CB C 13 27.983 0.00 . 1 . . . . . 34 GLU CB . 27757 1 51 . 1 1 34 34 GLU N N 15 117.493 0.01 . 1 . . . . . 34 GLU N . 27757 1 52 . 1 1 35 35 ILE H H 1 7.244 0.01 . 1 . . . . . 35 ILE H . 27757 1 53 . 1 1 35 35 ILE C C 13 179.325 0.01 . 1 . . . . . 35 ILE C . 27757 1 54 . 1 1 35 35 ILE CA C 13 59.960 0.02 . 1 . . . . . 35 ILE CA . 27757 1 55 . 1 1 35 35 ILE CB C 13 34.520 0.00 . 1 . . . . . 35 ILE CB . 27757 1 56 . 1 1 35 35 ILE N N 15 119.600 0.00 . 1 . . . . . 35 ILE N . 27757 1 57 . 1 1 36 36 GLN H H 1 7.947 0.01 . 1 . . . . . 36 GLN H . 27757 1 58 . 1 1 36 36 GLN C C 13 178.049 0.02 . 1 . . . . . 36 GLN C . 27757 1 59 . 1 1 36 36 GLN CA C 13 57.866 0.05 . 1 . . . . . 36 GLN CA . 27757 1 60 . 1 1 36 36 GLN N N 15 120.813 0.02 . 1 . . . . . 36 GLN N . 27757 1 61 . 1 1 37 37 GLU H H 1 7.926 0.01 . 1 . . . . . 37 GLU H . 27757 1 62 . 1 1 37 37 GLU C C 13 180.029 0.01 . 1 . . . . . 37 GLU C . 27757 1 63 . 1 1 37 37 GLU CA C 13 58.959 0.09 . 1 . . . . . 37 GLU CA . 27757 1 64 . 1 1 37 37 GLU CB C 13 28.310 0.00 . 1 . . . . . 37 GLU CB . 27757 1 65 . 1 1 37 37 GLU N N 15 118.284 0.01 . 1 . . . . . 37 GLU N . 27757 1 66 . 1 1 38 38 ILE H H 1 7.031 0.01 . 1 . . . . . 38 ILE H . 27757 1 67 . 1 1 38 38 ILE C C 13 178.653 0.02 . 1 . . . . . 38 ILE C . 27757 1 68 . 1 1 38 38 ILE CA C 13 65.530 0.04 . 1 . . . . . 38 ILE CA . 27757 1 69 . 1 1 38 38 ILE CB C 13 36.899 0.07 . 1 . . . . . 38 ILE CB . 27757 1 70 . 1 1 38 38 ILE N N 15 118.817 0.01 . 1 . . . . . 38 ILE N . 27757 1 71 . 1 1 39 39 VAL H H 1 7.420 0.00 . 1 . . . . . 39 VAL H . 27757 1 72 . 1 1 39 39 VAL C C 13 178.046 0.01 . 1 . . . . . 39 VAL C . 27757 1 73 . 1 1 39 39 VAL CA C 13 66.508 0.03 . 1 . . . . . 39 VAL CA . 27757 1 74 . 1 1 39 39 VAL CB C 13 29.947 0.21 . 1 . . . . . 39 VAL CB . 27757 1 75 . 1 1 39 39 VAL N N 15 118.968 0.02 . 1 . . . . . 39 VAL N . 27757 1 76 . 1 1 40 40 ASP H H 1 8.617 0.01 . 1 . . . . . 40 ASP H . 27757 1 77 . 1 1 40 40 ASP C C 13 180.714 0.02 . 1 . . . . . 40 ASP C . 27757 1 78 . 1 1 40 40 ASP CA C 13 56.771 0.06 . 1 . . . . . 40 ASP CA . 27757 1 79 . 1 1 40 40 ASP CB C 13 39.267 0.05 . 1 . . . . . 40 ASP CB . 27757 1 80 . 1 1 40 40 ASP N N 15 119.094 0.01 . 1 . . . . . 40 ASP N . 27757 1 81 . 1 1 41 41 LYS H H 1 7.861 0.01 . 1 . . . . . 41 LYS H . 27757 1 82 . 1 1 41 41 LYS C C 13 180.305 0.01 . 1 . . . . . 41 LYS C . 27757 1 83 . 1 1 41 41 LYS CA C 13 57.646 0.03 . 1 . . . . . 41 LYS CA . 27757 1 84 . 1 1 41 41 LYS CB C 13 31.626 0.02 . 1 . . . . . 41 LYS CB . 27757 1 85 . 1 1 41 41 LYS N N 15 118.209 0.01 . 1 . . . . . 41 LYS N . 27757 1 86 . 1 1 42 42 VAL H H 1 7.886 0.01 . 1 . . . . . 42 VAL H . 27757 1 87 . 1 1 42 42 VAL C C 13 177.929 0.01 . 1 . . . . . 42 VAL C . 27757 1 88 . 1 1 42 42 VAL CA C 13 60.970 0.06 . 1 . . . . . 42 VAL CA . 27757 1 89 . 1 1 42 42 VAL CB C 13 31.415 0.00 . 1 . . . . . 42 VAL CB . 27757 1 90 . 1 1 42 42 VAL N N 15 110.237 0.02 . 1 . . . . . 42 VAL N . 27757 1 91 . 1 1 43 43 LYS H H 1 7.885 0.01 . 1 . . . . . 43 LYS H . 27757 1 92 . 1 1 43 43 LYS C C 13 174.942 0.00 . 1 . . . . . 43 LYS C . 27757 1 93 . 1 1 43 43 LYS CA C 13 61.550 0.01 . 1 . . . . . 43 LYS CA . 27757 1 94 . 1 1 43 43 LYS CB C 13 29.427 0.00 . 1 . . . . . 43 LYS CB . 27757 1 95 . 1 1 43 43 LYS N N 15 126.105 0.01 . 1 . . . . . 43 LYS N . 27757 1 96 . 1 1 44 44 PRO C C 13 181.473 0.00 . 1 . . . . . 44 PRO C . 27757 1 97 . 1 1 44 44 PRO CA C 13 65.331 0.04 . 1 . . . . . 44 PRO CA . 27757 1 98 . 1 1 44 44 PRO CB C 13 29.974 0.00 . 1 . . . . . 44 PRO CB . 27757 1 99 . 1 1 45 45 GLN H H 1 7.321 0.01 . 1 . . . . . 45 GLN H . 27757 1 100 . 1 1 45 45 GLN C C 13 179.847 0.03 . 1 . . . . . 45 GLN C . 27757 1 101 . 1 1 45 45 GLN CA C 13 57.870 0.05 . 1 . . . . . 45 GLN CA . 27757 1 102 . 1 1 45 45 GLN CB C 13 28.446 0.00 . 1 . . . . . 45 GLN CB . 27757 1 103 . 1 1 45 45 GLN N N 15 116.081 0.01 . 1 . . . . . 45 GLN N . 27757 1 104 . 1 1 46 46 LEU H H 1 7.724 0.01 . 1 . . . . . 46 LEU H . 27757 1 105 . 1 1 46 46 LEU C C 13 180.142 0.02 . 1 . . . . . 46 LEU C . 27757 1 106 . 1 1 46 46 LEU CA C 13 56.923 0.09 . 1 . . . . . 46 LEU CA . 27757 1 107 . 1 1 46 46 LEU CB C 13 41.486 0.03 . 1 . . . . . 46 LEU CB . 27757 1 108 . 1 1 46 46 LEU N N 15 121.089 0.02 . 1 . . . . . 46 LEU N . 27757 1 109 . 1 1 47 47 GLU H H 1 8.368 0.01 . 1 . . . . . 47 GLU H . 27757 1 110 . 1 1 47 47 GLU C C 13 180.865 0.03 . 1 . . . . . 47 GLU C . 27757 1 111 . 1 1 47 47 GLU CA C 13 58.884 0.09 . 1 . . . . . 47 GLU CA . 27757 1 112 . 1 1 47 47 GLU CB C 13 28.922 0.12 . 1 . . . . . 47 GLU CB . 27757 1 113 . 1 1 47 47 GLU N N 15 118.895 0.01 . 1 . . . . . 47 GLU N . 27757 1 114 . 1 1 48 48 GLU H H 1 7.616 0.01 . 1 . . . . . 48 GLU H . 27757 1 115 . 1 1 48 48 GLU C C 13 179.811 0.04 . 1 . . . . . 48 GLU C . 27757 1 116 . 1 1 48 48 GLU CA C 13 58.161 0.07 . 1 . . . . . 48 GLU CA . 27757 1 117 . 1 1 48 48 GLU CB C 13 28.814 0.01 . 1 . . . . . 48 GLU CB . 27757 1 118 . 1 1 48 48 GLU N N 15 118.405 0.00 . 1 . . . . . 48 GLU N . 27757 1 119 . 1 1 49 49 LYS H H 1 7.497 0.01 . 1 . . . . . 49 LYS H . 27757 1 120 . 1 1 49 49 LYS C C 13 176.025 0.00 . 1 . . . . . 49 LYS C . 27757 1 121 . 1 1 49 49 LYS CA C 13 57.364 0.06 . 1 . . . . . 49 LYS CA . 27757 1 122 . 1 1 49 49 LYS CB C 13 32.233 0.03 . 1 . . . . . 49 LYS CB . 27757 1 123 . 1 1 49 49 LYS N N 15 116.626 0.02 . 1 . . . . . 49 LYS N . 27757 1 124 . 1 1 50 50 THR H H 1 8.190 0.00 . 1 . . . . . 50 THR H . 27757 1 125 . 1 1 50 50 THR C C 13 177.071 0.00 . 1 . . . . . 50 THR C . 27757 1 126 . 1 1 50 50 THR CA C 13 61.239 0.07 . 1 . . . . . 50 THR CA . 27757 1 127 . 1 1 50 50 THR CB C 13 70.166 0.05 . 1 . . . . . 50 THR CB . 27757 1 128 . 1 1 50 50 THR N N 15 106.813 0.01 . 1 . . . . . 50 THR N . 27757 1 129 . 1 1 51 51 ASN H H 1 7.981 0.01 . 1 . . . . . 51 ASN H . 27757 1 130 . 1 1 51 51 ASN C C 13 174.569 0.01 . 1 . . . . . 51 ASN C . 27757 1 131 . 1 1 51 51 ASN CA C 13 53.977 0.05 . 1 . . . . . 51 ASN CA . 27757 1 132 . 1 1 51 51 ASN CB C 13 36.980 0.07 . 1 . . . . . 51 ASN CB . 27757 1 133 . 1 1 51 51 ASN N N 15 117.299 0.00 . 1 . . . . . 51 ASN N . 27757 1 134 . 1 1 52 52 GLU H H 1 7.492 0.01 . 1 . . . . . 52 GLU H . 27757 1 135 . 1 1 52 52 GLU C C 13 174.925 0.01 . 1 . . . . . 52 GLU C . 27757 1 136 . 1 1 52 52 GLU CA C 13 53.985 0.01 . 1 . . . . . 52 GLU CA . 27757 1 137 . 1 1 52 52 GLU CB C 13 31.578 0.03 . 1 . . . . . 52 GLU CB . 27757 1 138 . 1 1 52 52 GLU N N 15 117.867 0.05 . 1 . . . . . 52 GLU N . 27757 1 139 . 1 1 53 53 THR H H 1 7.559 0.01 . 1 . . . . . 53 THR H . 27757 1 140 . 1 1 53 53 THR C C 13 175.475 0.02 . 1 . . . . . 53 THR C . 27757 1 141 . 1 1 53 53 THR CA C 13 59.350 0.09 . 1 . . . . . 53 THR CA . 27757 1 142 . 1 1 53 53 THR CB C 13 69.950 0.06 . 1 . . . . . 53 THR CB . 27757 1 143 . 1 1 53 53 THR N N 15 111.294 0.01 . 1 . . . . . 53 THR N . 27757 1 144 . 1 1 54 54 TYR H H 1 8.877 0.01 . 1 . . . . . 54 TYR H . 27757 1 145 . 1 1 54 54 TYR C C 13 177.547 0.00 . 1 . . . . . 54 TYR C . 27757 1 146 . 1 1 54 54 TYR CA C 13 56.044 0.08 . 1 . . . . . 54 TYR CA . 27757 1 147 . 1 1 54 54 TYR CB C 13 40.104 0.00 . 1 . . . . . 54 TYR CB . 27757 1 148 . 1 1 54 54 TYR N N 15 123.787 0.01 . 1 . . . . . 54 TYR N . 27757 1 149 . 1 1 55 55 GLY C C 13 175.081 0.00 . 1 . . . . . 55 GLY C . 27757 1 150 . 1 1 55 55 GLY CA C 13 45.321 0.03 . 1 . . . . . 55 GLY CA . 27757 1 151 . 1 1 56 56 LYS H H 1 7.870 0.01 . 1 . . . . . 56 LYS H . 27757 1 152 . 1 1 56 56 LYS C C 13 176.257 0.00 . 1 . . . . . 56 LYS C . 27757 1 153 . 1 1 56 56 LYS CA C 13 55.376 0.04 . 1 . . . . . 56 LYS CA . 27757 1 154 . 1 1 56 56 LYS CB C 13 33.403 0.00 . 1 . . . . . 56 LYS CB . 27757 1 155 . 1 1 56 56 LYS N N 15 120.296 0.09 . 1 . . . . . 56 LYS N . 27757 1 156 . 1 1 57 57 LEU H H 1 8.492 0.00 . 1 . . . . . 57 LEU H . 27757 1 157 . 1 1 57 57 LEU C C 13 176.202 0.00 . 1 . . . . . 57 LEU C . 27757 1 158 . 1 1 57 57 LEU CA C 13 52.653 0.10 . 1 . . . . . 57 LEU CA . 27757 1 159 . 1 1 57 57 LEU CB C 13 43.114 0.01 . 1 . . . . . 57 LEU CB . 27757 1 160 . 1 1 57 57 LEU N N 15 125.796 0.00 . 1 . . . . . 57 LEU N . 27757 1 161 . 1 1 58 58 GLU H H 1 8.461 0.01 . 1 . . . . . 58 GLU H . 27757 1 162 . 1 1 58 58 GLU C C 13 177.235 0.00 . 1 . . . . . 58 GLU C . 27757 1 163 . 1 1 58 58 GLU CA C 13 54.047 0.07 . 1 . . . . . 58 GLU CA . 27757 1 164 . 1 1 58 58 GLU CB C 13 31.578 0.03 . 1 . . . . . 58 GLU CB . 27757 1 165 . 1 1 58 58 GLU N N 15 124.519 0.02 . 1 . . . . . 58 GLU N . 27757 1 166 . 1 1 59 59 ALA H H 1 9.642 0.00 . 1 . . . . . 59 ALA H . 27757 1 167 . 1 1 59 59 ALA C C 13 178.000 0.02 . 1 . . . . . 59 ALA C . 27757 1 168 . 1 1 59 59 ALA CA C 13 51.889 0.04 . 1 . . . . . 59 ALA CA . 27757 1 169 . 1 1 59 59 ALA CB C 13 18.259 0.05 . 1 . . . . . 59 ALA CB . 27757 1 170 . 1 1 59 59 ALA N N 15 128.831 0.02 . 1 . . . . . 59 ALA N . 27757 1 171 . 1 1 60 60 VAL H H 1 9.004 0.00 . 1 . . . . . 60 VAL H . 27757 1 172 . 1 1 60 60 VAL C C 13 178.024 0.00 . 1 . . . . . 60 VAL C . 27757 1 173 . 1 1 60 60 VAL CA C 13 63.007 0.05 . 1 . . . . . 60 VAL CA . 27757 1 174 . 1 1 60 60 VAL CB C 13 33.751 0.09 . 1 . . . . . 60 VAL CB . 27757 1 175 . 1 1 60 60 VAL N N 15 118.611 0.02 . 1 . . . . . 60 VAL N . 27757 1 176 . 1 1 61 61 GLN H H 1 7.628 0.01 . 1 . . . . . 61 GLN H . 27757 1 177 . 1 1 61 61 GLN C C 13 174.460 0.02 . 1 . . . . . 61 GLN C . 27757 1 178 . 1 1 61 61 GLN CA C 13 54.060 0.11 . 1 . . . . . 61 GLN CA . 27757 1 179 . 1 1 61 61 GLN CB C 13 33.456 0.06 . 1 . . . . . 61 GLN CB . 27757 1 180 . 1 1 61 61 GLN N N 15 117.715 0.02 . 1 . . . . . 61 GLN N . 27757 1 181 . 1 1 62 62 TYR H H 1 9.622 0.00 . 1 . . . . . 62 TYR H . 27757 1 182 . 1 1 62 62 TYR C C 13 173.245 0.02 . 1 . . . . . 62 TYR C . 27757 1 183 . 1 1 62 62 TYR CA C 13 55.788 0.03 . 1 . . . . . 62 TYR CA . 27757 1 184 . 1 1 62 62 TYR CB C 13 42.523 0.05 . 1 . . . . . 62 TYR CB . 27757 1 185 . 1 1 62 62 TYR N N 15 121.359 0.05 . 1 . . . . . 62 TYR N . 27757 1 186 . 1 1 63 63 LYS H H 1 9.295 0.01 . 1 . . . . . 63 LYS H . 27757 1 187 . 1 1 63 63 LYS C C 13 176.846 0.01 . 1 . . . . . 63 LYS C . 27757 1 188 . 1 1 63 63 LYS CA C 13 54.706 0.08 . 1 . . . . . 63 LYS CA . 27757 1 189 . 1 1 63 63 LYS CB C 13 39.481 0.02 . 1 . . . . . 63 LYS CB . 27757 1 190 . 1 1 63 63 LYS N N 15 117.985 0.01 . 1 . . . . . 63 LYS N . 27757 1 191 . 1 1 64 64 THR H H 1 8.706 0.01 . 1 . . . . . 64 THR H . 27757 1 192 . 1 1 64 64 THR C C 13 175.125 0.00 . 1 . . . . . 64 THR C . 27757 1 193 . 1 1 64 64 THR CA C 13 59.185 0.16 . 1 . . . . . 64 THR CA . 27757 1 194 . 1 1 64 64 THR CB C 13 71.282 0.09 . 1 . . . . . 64 THR CB . 27757 1 195 . 1 1 64 64 THR N N 15 110.418 0.02 . 1 . . . . . 64 THR N . 27757 1 196 . 1 1 65 65 GLN H H 1 8.697 0.01 . 1 . . . . . 65 GLN H . 27757 1 197 . 1 1 65 65 GLN C C 13 175.307 0.00 . 1 . . . . . 65 GLN C . 27757 1 198 . 1 1 65 65 GLN CA C 13 53.855 0.01 . 1 . . . . . 65 GLN CA . 27757 1 199 . 1 1 65 65 GLN N N 15 122.292 0.01 . 1 . . . . . 65 GLN N . 27757 1 200 . 1 1 66 66 VAL H H 1 8.655 0.02 . 1 . . . . . 66 VAL H . 27757 1 201 . 1 1 66 66 VAL C C 13 176.805 0.00 . 1 . . . . . 66 VAL C . 27757 1 202 . 1 1 66 66 VAL CA C 13 62.370 0.06 . 1 . . . . . 66 VAL CA . 27757 1 203 . 1 1 66 66 VAL CB C 13 31.696 0.13 . 1 . . . . . 66 VAL CB . 27757 1 204 . 1 1 66 66 VAL N N 15 129.098 0.00 . 1 . . . . . 66 VAL N . 27757 1 205 . 1 1 67 67 LEU H H 1 8.379 0.00 . 1 . . . . . 67 LEU H . 27757 1 206 . 1 1 67 67 LEU CA C 13 53.814 0.07 . 1 . . . . . 67 LEU CA . 27757 1 207 . 1 1 67 67 LEU CB C 13 42.010 0.00 . 1 . . . . . 67 LEU CB . 27757 1 208 . 1 1 67 67 LEU N N 15 127.197 0.00 . 1 . . . . . 67 LEU N . 27757 1 209 . 1 1 70 70 TYR C C 13 177.503 0.00 . 1 . . . . . 70 TYR C . 27757 1 210 . 1 1 70 70 TYR CA C 13 54.536 0.07 . 1 . . . . . 70 TYR CA . 27757 1 211 . 1 1 70 70 TYR CB C 13 41.847 0.00 . 1 . . . . . 70 TYR CB . 27757 1 212 . 1 1 71 71 ARG H H 1 7.695 0.00 . 1 . . . . . 71 ARG H . 27757 1 213 . 1 1 71 71 ARG C C 13 175.971 0.00 . 1 . . . . . 71 ARG C . 27757 1 214 . 1 1 71 71 ARG CA C 13 58.338 0.01 . 1 . . . . . 71 ARG CA . 27757 1 215 . 1 1 71 71 ARG CB C 13 33.485 0.00 . 1 . . . . . 71 ARG CB . 27757 1 216 . 1 1 71 71 ARG N N 15 119.006 0.01 . 1 . . . . . 71 ARG N . 27757 1 217 . 1 1 73 73 ILE C C 13 177.597 0.00 . 1 . . . . . 73 ILE C . 27757 1 218 . 1 1 73 73 ILE CA C 13 55.805 0.09 . 1 . . . . . 73 ILE CA . 27757 1 219 . 1 1 74 74 LEU H H 1 8.142 0.00 . 1 . . . . . 74 LEU H . 27757 1 220 . 1 1 74 74 LEU C C 13 177.339 0.00 . 1 . . . . . 74 LEU C . 27757 1 221 . 1 1 74 74 LEU CA C 13 54.270 0.24 . 1 . . . . . 74 LEU CA . 27757 1 222 . 1 1 74 74 LEU CB C 13 41.614 0.12 . 1 . . . . . 74 LEU CB . 27757 1 223 . 1 1 74 74 LEU N N 15 122.005 0.01 . 1 . . . . . 74 LEU N . 27757 1 224 . 1 1 75 75 ALA H H 1 8.057 0.01 . 1 . . . . . 75 ALA H . 27757 1 225 . 1 1 75 75 ALA C C 13 178.804 0.03 . 1 . . . . . 75 ALA C . 27757 1 226 . 1 1 75 75 ALA CA C 13 51.890 0.09 . 1 . . . . . 75 ALA CA . 27757 1 227 . 1 1 75 75 ALA CB C 13 18.893 0.07 . 1 . . . . . 75 ALA CB . 27757 1 228 . 1 1 75 75 ALA N N 15 124.165 0.04 . 1 . . . . . 75 ALA N . 27757 1 229 . 1 1 76 76 SER H H 1 8.238 0.01 . 1 . . . . . 76 SER H . 27757 1 230 . 1 1 76 76 SER C C 13 174.350 0.00 . 1 . . . . . 76 SER C . 27757 1 231 . 1 1 76 76 SER CA C 13 57.550 0.15 . 1 . . . . . 76 SER CA . 27757 1 232 . 1 1 76 76 SER CB C 13 64.493 0.08 . 1 . . . . . 76 SER CB . 27757 1 233 . 1 1 76 76 SER N N 15 116.401 0.00 . 1 . . . . . 76 SER N . 27757 1 234 . 1 1 77 77 THR H H 1 8.115 0.01 . 1 . . . . . 77 THR H . 27757 1 235 . 1 1 77 77 THR CA C 13 61.015 0.02 . 1 . . . . . 77 THR CA . 27757 1 236 . 1 1 77 77 THR CB C 13 71.890 0.00 . 1 . . . . . 77 THR CB . 27757 1 237 . 1 1 77 77 THR N N 15 116.409 0.01 . 1 . . . . . 77 THR N . 27757 1 238 . 1 1 78 78 ASN C C 13 176.117 0.00 . 1 . . . . . 78 ASN C . 27757 1 239 . 1 1 78 78 ASN CA C 13 50.934 0.01 . 1 . . . . . 78 ASN CA . 27757 1 240 . 1 1 78 78 ASN CB C 13 40.512 0.00 . 1 . . . . . 78 ASN CB . 27757 1 241 . 1 1 79 79 TYR H H 1 9.501 0.01 . 1 . . . . . 79 TYR H . 27757 1 242 . 1 1 79 79 TYR C C 13 175.835 0.00 . 1 . . . . . 79 TYR C . 27757 1 243 . 1 1 79 79 TYR CA C 13 56.232 0.03 . 1 . . . . . 79 TYR CA . 27757 1 244 . 1 1 79 79 TYR CB C 13 40.103 0.03 . 1 . . . . . 79 TYR CB . 27757 1 245 . 1 1 79 79 TYR N N 15 120.397 0.00 . 1 . . . . . 79 TYR N . 27757 1 246 . 1 1 80 80 TYR H H 1 9.019 0.01 . 1 . . . . . 80 TYR H . 27757 1 247 . 1 1 80 80 TYR C C 13 177.186 0.00 . 1 . . . . . 80 TYR C . 27757 1 248 . 1 1 80 80 TYR CA C 13 55.980 0.13 . 1 . . . . . 80 TYR CA . 27757 1 249 . 1 1 80 80 TYR CB C 13 38.971 0.07 . 1 . . . . . 80 TYR CB . 27757 1 250 . 1 1 80 80 TYR N N 15 121.688 0.02 . 1 . . . . . 80 TYR N . 27757 1 251 . 1 1 81 81 ILE H H 1 9.475 0.01 . 1 . . . . . 81 ILE H . 27757 1 252 . 1 1 81 81 ILE C C 13 176.638 0.01 . 1 . . . . . 81 ILE C . 27757 1 253 . 1 1 81 81 ILE CA C 13 59.541 0.04 . 1 . . . . . 81 ILE CA . 27757 1 254 . 1 1 81 81 ILE CB C 13 42.310 0.11 . 1 . . . . . 81 ILE CB . 27757 1 255 . 1 1 81 81 ILE N N 15 121.312 0.01 . 1 . . . . . 81 ILE N . 27757 1 256 . 1 1 82 82 LYS H H 1 9.122 0.00 . 1 . . . . . 82 LYS H . 27757 1 257 . 1 1 82 82 LYS C C 13 176.130 0.00 . 1 . . . . . 82 LYS C . 27757 1 258 . 1 1 82 82 LYS CA C 13 54.921 0.06 . 1 . . . . . 82 LYS CA . 27757 1 259 . 1 1 82 82 LYS CB C 13 32.559 0.00 . 1 . . . . . 82 LYS CB . 27757 1 260 . 1 1 82 82 LYS N N 15 129.901 0.00 . 1 . . . . . 82 LYS N . 27757 1 261 . 1 1 83 83 VAL H H 1 9.461 0.00 . 1 . . . . . 83 VAL H . 27757 1 262 . 1 1 83 83 VAL C C 13 174.361 0.05 . 1 . . . . . 83 VAL C . 27757 1 263 . 1 1 83 83 VAL CA C 13 57.509 0.07 . 1 . . . . . 83 VAL CA . 27757 1 264 . 1 1 83 83 VAL CB C 13 33.873 0.01 . 1 . . . . . 83 VAL CB . 27757 1 265 . 1 1 83 83 VAL N N 15 123.007 0.03 . 1 . . . . . 83 VAL N . 27757 1 266 . 1 1 84 84 ARG H H 1 9.100 0.00 . 1 . . . . . 84 ARG H . 27757 1 267 . 1 1 84 84 ARG C C 13 176.458 0.01 . 1 . . . . . 84 ARG C . 27757 1 268 . 1 1 84 84 ARG CA C 13 53.952 0.04 . 1 . . . . . 84 ARG CA . 27757 1 269 . 1 1 84 84 ARG CB C 13 32.314 0.08 . 1 . . . . . 84 ARG CB . 27757 1 270 . 1 1 84 84 ARG N N 15 124.006 0.00 . 1 . . . . . 84 ARG N . 27757 1 271 . 1 1 85 85 ALA H H 1 8.686 0.00 . 1 . . . . . 85 ALA H . 27757 1 272 . 1 1 85 85 ALA C C 13 177.632 0.01 . 1 . . . . . 85 ALA C . 27757 1 273 . 1 1 85 85 ALA CA C 13 49.690 0.07 . 1 . . . . . 85 ALA CA . 27757 1 274 . 1 1 85 85 ALA CB C 13 19.948 0.03 . 1 . . . . . 85 ALA CB . 27757 1 275 . 1 1 85 85 ALA N N 15 130.676 0.04 . 1 . . . . . 85 ALA N . 27757 1 276 . 1 1 86 86 GLY H H 1 7.975 0.00 . 1 . . . . . 86 GLY H . 27757 1 277 . 1 1 86 86 GLY C C 13 174.509 0.12 . 1 . . . . . 86 GLY C . 27757 1 278 . 1 1 86 86 GLY CA C 13 44.402 0.03 . 1 . . . . . 86 GLY CA . 27757 1 279 . 1 1 86 86 GLY N N 15 108.044 0.05 . 1 . . . . . 86 GLY N . 27757 1 280 . 1 1 87 87 ASP H H 1 8.131 0.01 . 1 . . . . . 87 ASP H . 27757 1 281 . 1 1 87 87 ASP C C 13 178.865 0.00 . 1 . . . . . 87 ASP C . 27757 1 282 . 1 1 87 87 ASP CA C 13 54.502 0.02 . 1 . . . . . 87 ASP CA . 27757 1 283 . 1 1 87 87 ASP N N 15 122.794 0.14 . 1 . . . . . 87 ASP N . 27757 1 284 . 1 1 88 88 ASN H H 1 8.697 0.00 . 1 . . . . . 88 ASN H . 27757 1 285 . 1 1 88 88 ASN C C 13 175.096 0.00 . 1 . . . . . 88 ASN C . 27757 1 286 . 1 1 88 88 ASN CA C 13 52.978 0.05 . 1 . . . . . 88 ASN CA . 27757 1 287 . 1 1 88 88 ASN CB C 13 38.006 0.00 . 1 . . . . . 88 ASN CB . 27757 1 288 . 1 1 88 88 ASN N N 15 120.214 0.00 . 1 . . . . . 88 ASN N . 27757 1 289 . 1 1 89 89 LYS H H 1 7.103 0.01 . 1 . . . . . 89 LYS H . 27757 1 290 . 1 1 89 89 LYS C C 13 175.814 0.02 . 1 . . . . . 89 LYS C . 27757 1 291 . 1 1 89 89 LYS CA C 13 54.888 0.08 . 1 . . . . . 89 LYS CA . 27757 1 292 . 1 1 89 89 LYS CB C 13 33.147 0.07 . 1 . . . . . 89 LYS CB . 27757 1 293 . 1 1 89 89 LYS N N 15 118.979 0.02 . 1 . . . . . 89 LYS N . 27757 1 294 . 1 1 90 90 TYR H H 1 8.398 0.01 . 1 . . . . . 90 TYR H . 27757 1 295 . 1 1 90 90 TYR C C 13 176.666 0.03 . 1 . . . . . 90 TYR C . 27757 1 296 . 1 1 90 90 TYR CA C 13 55.702 0.08 . 1 . . . . . 90 TYR CA . 27757 1 297 . 1 1 90 90 TYR CB C 13 40.193 0.06 . 1 . . . . . 90 TYR CB . 27757 1 298 . 1 1 90 90 TYR N N 15 120.516 0.01 . 1 . . . . . 90 TYR N . 27757 1 299 . 1 1 91 91 MET H H 1 8.866 0.01 . 1 . . . . . 91 MET H . 27757 1 300 . 1 1 91 91 MET C C 13 175.976 0.00 . 1 . . . . . 91 MET C . 27757 1 301 . 1 1 91 91 MET CA C 13 53.506 0.14 . 1 . . . . . 91 MET CA . 27757 1 302 . 1 1 91 91 MET CB C 13 37.207 0.02 . 1 . . . . . 91 MET CB . 27757 1 303 . 1 1 91 91 MET N N 15 116.630 0.05 . 1 . . . . . 91 MET N . 27757 1 304 . 1 1 92 92 HIS H H 1 9.030 0.00 . 1 . . . . . 92 HIS H . 27757 1 305 . 1 1 92 92 HIS C C 13 175.065 0.00 . 1 . . . . . 92 HIS C . 27757 1 306 . 1 1 92 92 HIS CA C 13 51.921 0.06 . 1 . . . . . 92 HIS CA . 27757 1 307 . 1 1 92 92 HIS CB C 13 31.131 0.12 . 1 . . . . . 92 HIS CB . 27757 1 308 . 1 1 92 92 HIS N N 15 120.889 0.01 . 1 . . . . . 92 HIS N . 27757 1 309 . 1 1 93 93 LEU H H 1 9.776 0.01 . 1 . . . . . 93 LEU H . 27757 1 310 . 1 1 93 93 LEU C C 13 175.436 0.00 . 1 . . . . . 93 LEU C . 27757 1 311 . 1 1 93 93 LEU CA C 13 52.987 0.05 . 1 . . . . . 93 LEU CA . 27757 1 312 . 1 1 93 93 LEU CB C 13 43.672 0.00 . 1 . . . . . 93 LEU CB . 27757 1 313 . 1 1 93 93 LEU N N 15 122.587 0.01 . 1 . . . . . 93 LEU N . 27757 1 314 . 1 1 94 94 LYS H H 1 8.450 0.00 . 1 . . . . . 94 LYS H . 27757 1 315 . 1 1 94 94 LYS C C 13 175.736 0.76 . 1 . . . . . 94 LYS C . 27757 1 316 . 1 1 94 94 LYS CA C 13 54.409 0.05 . 1 . . . . . 94 LYS CA . 27757 1 317 . 1 1 94 94 LYS CB C 13 34.227 0.10 . 1 . . . . . 94 LYS CB . 27757 1 318 . 1 1 94 94 LYS N N 15 124.504 0.01 . 1 . . . . . 94 LYS N . 27757 1 319 . 1 1 95 95 VAL H H 1 9.038 0.01 . 1 . . . . . 95 VAL H . 27757 1 320 . 1 1 95 95 VAL C C 13 175.409 0.00 . 1 . . . . . 95 VAL C . 27757 1 321 . 1 1 95 95 VAL CA C 13 59.685 0.04 . 1 . . . . . 95 VAL CA . 27757 1 322 . 1 1 95 95 VAL CB C 13 34.997 0.00 . 1 . . . . . 95 VAL CB . 27757 1 323 . 1 1 95 95 VAL N N 15 126.419 0.03 . 1 . . . . . 95 VAL N . 27757 1 324 . 1 1 96 96 PHE H H 1 9.275 0.01 . 1 . . . . . 96 PHE H . 27757 1 325 . 1 1 96 96 PHE C C 13 175.777 0.00 . 1 . . . . . 96 PHE C . 27757 1 326 . 1 1 96 96 PHE CA C 13 56.502 0.05 . 1 . . . . . 96 PHE CA . 27757 1 327 . 1 1 96 96 PHE CB C 13 40.539 0.00 . 1 . . . . . 96 PHE CB . 27757 1 328 . 1 1 96 96 PHE N N 15 129.183 0.01 . 1 . . . . . 96 PHE N . 27757 1 329 . 1 1 97 97 ASN H H 1 8.311 0.01 . 1 . . . . . 97 ASN H . 27757 1 330 . 1 1 97 97 ASN CA C 13 51.588 0.04 . 1 . . . . . 97 ASN CA . 27757 1 331 . 1 1 97 97 ASN N N 15 126.603 0.00 . 1 . . . . . 97 ASN N . 27757 1 332 . 1 1 99 99 PRO C C 13 178.034 0.00 . 1 . . . . . 99 PRO C . 27757 1 333 . 1 1 99 99 PRO CA C 13 62.353 0.00 . 1 . . . . . 99 PRO CA . 27757 1 334 . 1 1 100 100 GLU H H 1 8.376 0.00 . 1 . . . . . 100 GLU H . 27757 1 335 . 1 1 100 100 GLU C C 13 177.458 0.00 . 1 . . . . . 100 GLU C . 27757 1 336 . 1 1 100 100 GLU CA C 13 55.740 0.10 . 1 . . . . . 100 GLU CA . 27757 1 337 . 1 1 100 100 GLU N N 15 121.901 0.00 . 1 . . . . . 100 GLU N . 27757 1 338 . 1 1 101 101 GLN H H 1 8.168 0.01 . 1 . . . . . 101 GLN H . 27757 1 339 . 1 1 101 101 GLN C C 13 178.284 0.00 . 1 . . . . . 101 GLN C . 27757 1 340 . 1 1 101 101 GLN CA C 13 60.471 0.00 . 1 . . . . . 101 GLN CA . 27757 1 341 . 1 1 101 101 GLN N N 15 122.855 0.04 . 1 . . . . . 101 GLN N . 27757 1 342 . 1 1 102 102 LYS H H 1 7.925 0.00 . 1 . . . . . 102 LYS H . 27757 1 343 . 1 1 102 102 LYS C C 13 177.112 0.00 . 1 . . . . . 102 LYS C . 27757 1 344 . 1 1 102 102 LYS CA C 13 57.880 0.00 . 1 . . . . . 102 LYS CA . 27757 1 345 . 1 1 102 102 LYS N N 15 124.100 0.00 . 1 . . . . . 102 LYS N . 27757 1 346 . 1 1 103 103 LEU H H 1 8.196 0.01 . 1 . . . . . 103 LEU H . 27757 1 347 . 1 1 103 103 LEU C C 13 178.572 0.00 . 1 . . . . . 103 LEU C . 27757 1 348 . 1 1 103 103 LEU CA C 13 54.542 0.03 . 1 . . . . . 103 LEU CA . 27757 1 349 . 1 1 103 103 LEU CB C 13 41.663 0.12 . 1 . . . . . 103 LEU CB . 27757 1 350 . 1 1 103 103 LEU N N 15 123.877 0.02 . 1 . . . . . 103 LEU N . 27757 1 351 . 1 1 104 104 ILE H H 1 8.023 0.00 . 1 . . . . . 104 ILE H . 27757 1 352 . 1 1 104 104 ILE C C 13 177.327 0.01 . 1 . . . . . 104 ILE C . 27757 1 353 . 1 1 104 104 ILE CA C 13 60.706 0.07 . 1 . . . . . 104 ILE CA . 27757 1 354 . 1 1 104 104 ILE CB C 13 37.700 0.13 . 1 . . . . . 104 ILE CB . 27757 1 355 . 1 1 104 104 ILE N N 15 120.310 0.01 . 1 . . . . . 104 ILE N . 27757 1 356 . 1 1 105 105 SER H H 1 8.139 0.00 . 1 . . . . . 105 SER H . 27757 1 357 . 1 1 105 105 SER C C 13 178.170 0.00 . 1 . . . . . 105 SER C . 27757 1 358 . 1 1 105 105 SER CA C 13 57.436 0.15 . 1 . . . . . 105 SER CA . 27757 1 359 . 1 1 105 105 SER CB C 13 63.541 0.00 . 1 . . . . . 105 SER CB . 27757 1 360 . 1 1 105 105 SER N N 15 117.895 0.01 . 1 . . . . . 105 SER N . 27757 1 361 . 1 1 106 106 GLU H H 1 8.396 0.00 . 1 . . . . . 106 GLU H . 27757 1 362 . 1 1 106 106 GLU C C 13 177.823 0.00 . 1 . . . . . 106 GLU C . 27757 1 363 . 1 1 106 106 GLU CA C 13 56.508 0.03 . 1 . . . . . 106 GLU CA . 27757 1 364 . 1 1 106 106 GLU CB C 13 29.209 0.00 . 1 . . . . . 106 GLU CB . 27757 1 365 . 1 1 106 106 GLU N N 15 120.502 0.00 . 1 . . . . . 106 GLU N . 27757 1 366 . 1 1 107 107 GLU H H 1 8.160 0.01 . 1 . . . . . 107 GLU H . 27757 1 367 . 1 1 107 107 GLU C C 13 177.544 0.27 . 1 . . . . . 107 GLU C . 27757 1 368 . 1 1 107 107 GLU CA C 13 56.033 0.14 . 1 . . . . . 107 GLU CA . 27757 1 369 . 1 1 107 107 GLU N N 15 119.489 0.02 . 1 . . . . . 107 GLU N . 27757 1 370 . 1 1 108 108 ASP H H 1 8.111 0.01 . 1 . . . . . 108 ASP H . 27757 1 371 . 1 1 108 108 ASP C C 13 177.196 0.00 . 1 . . . . . 108 ASP C . 27757 1 372 . 1 1 108 108 ASP CA C 13 53.591 0.15 . 1 . . . . . 108 ASP CA . 27757 1 373 . 1 1 108 108 ASP CB C 13 40.370 0.01 . 1 . . . . . 108 ASP CB . 27757 1 374 . 1 1 108 108 ASP N N 15 120.585 0.02 . 1 . . . . . 108 ASP N . 27757 1 375 . 1 1 109 109 LEU H H 1 7.980 0.00 . 1 . . . . . 109 LEU H . 27757 1 376 . 1 1 109 109 LEU C C 13 178.066 0.01 . 1 . . . . . 109 LEU C . 27757 1 377 . 1 1 109 109 LEU CA C 13 54.267 0.12 . 1 . . . . . 109 LEU CA . 27757 1 378 . 1 1 109 109 LEU CB C 13 41.820 0.00 . 1 . . . . . 109 LEU CB . 27757 1 379 . 1 1 109 109 LEU N N 15 122.510 0.00 . 1 . . . . . 109 LEU N . 27757 1 380 . 1 1 110 110 ALA H H 1 8.112 0.01 . 1 . . . . . 110 ALA H . 27757 1 381 . 1 1 110 110 ALA C C 13 178.095 0.00 . 1 . . . . . 110 ALA C . 27757 1 382 . 1 1 110 110 ALA CA C 13 51.524 0.06 . 1 . . . . . 110 ALA CA . 27757 1 383 . 1 1 110 110 ALA CB C 13 18.619 0.05 . 1 . . . . . 110 ALA CB . 27757 1 384 . 1 1 110 110 ALA N N 15 124.358 0.02 . 1 . . . . . 110 ALA N . 27757 1 385 . 1 1 111 111 ASP H H 1 8.197 0.01 . 1 . . . . . 111 ASP H . 27757 1 386 . 1 1 111 111 ASP C C 13 176.785 0.00 . 1 . . . . . 111 ASP C . 27757 1 387 . 1 1 111 111 ASP CA C 13 53.408 0.02 . 1 . . . . . 111 ASP CA . 27757 1 388 . 1 1 111 111 ASP CB C 13 40.349 0.00 . 1 . . . . . 111 ASP CB . 27757 1 389 . 1 1 111 111 ASP N N 15 120.197 0.00 . 1 . . . . . 111 ASP N . 27757 1 390 . 1 1 112 112 ARG H H 1 7.956 0.01 . 1 . . . . . 112 ARG H . 27757 1 391 . 1 1 112 112 ARG C C 13 176.720 0.00 . 1 . . . . . 112 ARG C . 27757 1 392 . 1 1 112 112 ARG CA C 13 54.825 0.06 . 1 . . . . . 112 ARG CA . 27757 1 393 . 1 1 112 112 ARG CB C 13 30.176 0.07 . 1 . . . . . 112 ARG CB . 27757 1 394 . 1 1 112 112 ARG N N 15 120.806 0.01 . 1 . . . . . 112 ARG N . 27757 1 395 . 1 1 113 113 VAL H H 1 8.475 0.01 . 1 . . . . . 113 VAL H . 27757 1 396 . 1 1 113 113 VAL C C 13 176.162 0.02 . 1 . . . . . 113 VAL C . 27757 1 397 . 1 1 113 113 VAL CA C 13 60.363 0.12 . 1 . . . . . 113 VAL CA . 27757 1 398 . 1 1 113 113 VAL CB C 13 34.929 0.22 . 1 . . . . . 113 VAL CB . 27757 1 399 . 1 1 113 113 VAL N N 15 121.492 0.01 . 1 . . . . . 113 VAL N . 27757 1 400 . 1 1 114 114 LEU H H 1 8.808 0.01 . 1 . . . . . 114 LEU H . 27757 1 401 . 1 1 114 114 LEU C C 13 177.112 0.00 . 1 . . . . . 114 LEU C . 27757 1 402 . 1 1 114 114 LEU CA C 13 54.156 0.15 . 1 . . . . . 114 LEU CA . 27757 1 403 . 1 1 114 114 LEU CB C 13 42.089 0.00 . 1 . . . . . 114 LEU CB . 27757 1 404 . 1 1 114 114 LEU N N 15 128.580 0.02 . 1 . . . . . 114 LEU N . 27757 1 405 . 1 1 115 115 THR H H 1 8.873 0.01 . 1 . . . . . 115 THR H . 27757 1 406 . 1 1 115 115 THR C C 13 177.198 0.02 . 1 . . . . . 115 THR C . 27757 1 407 . 1 1 115 115 THR CA C 13 61.279 0.09 . 1 . . . . . 115 THR CA . 27757 1 408 . 1 1 115 115 THR CB C 13 67.906 0.07 . 1 . . . . . 115 THR CB . 27757 1 409 . 1 1 115 115 THR N N 15 121.388 0.02 . 1 . . . . . 115 THR N . 27757 1 410 . 1 1 116 116 GLY H H 1 7.946 0.00 . 1 . . . . . 116 GLY H . 27757 1 411 . 1 1 116 116 GLY CA C 13 45.344 0.04 . 1 . . . . . 116 GLY CA . 27757 1 412 . 1 1 116 116 GLY N N 15 108.526 0.04 . 1 . . . . . 116 GLY N . 27757 1 413 . 1 1 117 117 TYR H H 1 8.285 0.12 . 1 . . . . . 117 TYR H . 27757 1 414 . 1 1 117 117 TYR C C 13 173.974 0.01 . 1 . . . . . 117 TYR C . 27757 1 415 . 1 1 117 117 TYR CA C 13 56.524 0.10 . 1 . . . . . 117 TYR CA . 27757 1 416 . 1 1 117 117 TYR CB C 13 39.926 0.01 . 1 . . . . . 117 TYR CB . 27757 1 417 . 1 1 117 117 TYR N N 15 115.779 0.02 . 1 . . . . . 117 TYR N . 27757 1 418 . 1 1 118 118 GLN H H 1 9.090 0.00 . 1 . . . . . 118 GLN H . 27757 1 419 . 1 1 118 118 GLN C C 13 177.505 0.00 . 1 . . . . . 118 GLN C . 27757 1 420 . 1 1 118 118 GLN CA C 13 53.544 0.09 . 1 . . . . . 118 GLN CA . 27757 1 421 . 1 1 118 118 GLN CB C 13 31.905 0.00 . 1 . . . . . 118 GLN CB . 27757 1 422 . 1 1 118 118 GLN N N 15 117.716 0.02 . 1 . . . . . 118 GLN N . 27757 1 423 . 1 1 119 119 VAL H H 1 8.282 0.01 . 1 . . . . . 119 VAL H . 27757 1 424 . 1 1 119 119 VAL C C 13 175.368 0.01 . 1 . . . . . 119 VAL C . 27757 1 425 . 1 1 119 119 VAL CA C 13 59.166 0.07 . 1 . . . . . 119 VAL CA . 27757 1 426 . 1 1 119 119 VAL CB C 13 32.459 0.02 . 1 . . . . . 119 VAL CB . 27757 1 427 . 1 1 119 119 VAL N N 15 115.175 0.07 . 1 . . . . . 119 VAL N . 27757 1 428 . 1 1 120 120 ASP H H 1 8.843 0.01 . 1 . . . . . 120 ASP H . 27757 1 429 . 1 1 120 120 ASP C C 13 176.954 0.03 . 1 . . . . . 120 ASP C . 27757 1 430 . 1 1 120 120 ASP CA C 13 54.475 0.06 . 1 . . . . . 120 ASP CA . 27757 1 431 . 1 1 120 120 ASP CB C 13 37.961 0.02 . 1 . . . . . 120 ASP CB . 27757 1 432 . 1 1 120 120 ASP N N 15 116.610 0.01 . 1 . . . . . 120 ASP N . 27757 1 433 . 1 1 121 121 LYS H H 1 7.279 0.01 . 1 . . . . . 121 LYS H . 27757 1 434 . 1 1 121 121 LYS C C 13 176.973 0.00 . 1 . . . . . 121 LYS C . 27757 1 435 . 1 1 121 121 LYS CA C 13 51.202 0.04 . 1 . . . . . 121 LYS CA . 27757 1 436 . 1 1 121 121 LYS CB C 13 30.455 0.05 . 1 . . . . . 121 LYS CB . 27757 1 437 . 1 1 121 121 LYS N N 15 114.395 0.00 . 1 . . . . . 121 LYS N . 27757 1 438 . 1 1 122 122 ASN H H 1 8.808 0.01 . 1 . . . . . 122 ASN H . 27757 1 439 . 1 1 122 122 ASN C C 13 177.868 0.01 . 1 . . . . . 122 ASN C . 27757 1 440 . 1 1 122 122 ASN CA C 13 50.514 0.06 . 1 . . . . . 122 ASN CA . 27757 1 441 . 1 1 122 122 ASN CB C 13 39.874 0.09 . 1 . . . . . 122 ASN CB . 27757 1 442 . 1 1 122 122 ASN N N 15 119.222 0.02 . 1 . . . . . 122 ASN N . 27757 1 443 . 1 1 123 123 LYS H H 1 8.645 0.01 . 1 . . . . . 123 LYS H . 27757 1 444 . 1 1 123 123 LYS C C 13 178.010 0.00 . 1 . . . . . 123 LYS C . 27757 1 445 . 1 1 123 123 LYS CA C 13 59.283 0.01 . 1 . . . . . 123 LYS CA . 27757 1 446 . 1 1 123 123 LYS CB C 13 31.804 0.00 . 1 . . . . . 123 LYS CB . 27757 1 447 . 1 1 123 123 LYS N N 15 124.132 0.02 . 1 . . . . . 123 LYS N . 27757 1 448 . 1 1 124 124 ASP H H 1 7.926 0.01 . 1 . . . . . 124 ASP H . 27757 1 449 . 1 1 124 124 ASP C C 13 177.897 0.00 . 1 . . . . . 124 ASP C . 27757 1 450 . 1 1 124 124 ASP CA C 13 53.282 0.06 . 1 . . . . . 124 ASP CA . 27757 1 451 . 1 1 124 124 ASP CB C 13 39.951 0.06 . 1 . . . . . 124 ASP CB . 27757 1 452 . 1 1 124 124 ASP N N 15 113.214 0.01 . 1 . . . . . 124 ASP N . 27757 1 453 . 1 1 125 125 ASP H H 1 7.010 0.00 . 1 . . . . . 125 ASP H . 27757 1 454 . 1 1 125 125 ASP C C 13 179.018 0.00 . 1 . . . . . 125 ASP C . 27757 1 455 . 1 1 125 125 ASP CA C 13 54.730 0.04 . 1 . . . . . 125 ASP CA . 27757 1 456 . 1 1 125 125 ASP CB C 13 40.866 0.00 . 1 . . . . . 125 ASP CB . 27757 1 457 . 1 1 125 125 ASP N N 15 119.684 0.02 . 1 . . . . . 125 ASP N . 27757 1 458 . 1 1 126 126 GLU C C 13 178.366 0.01 . 1 . . . . . 126 GLU C . 27757 1 459 . 1 1 126 126 GLU CA C 13 55.556 0.01 . 1 . . . . . 126 GLU CA . 27757 1 460 . 1 1 126 126 GLU CB C 13 29.535 0.02 . 1 . . . . . 126 GLU CB . 27757 1 461 . 1 1 127 127 LEU H H 1 9.086 0.01 . 1 . . . . . 127 LEU H . 27757 1 462 . 1 1 127 127 LEU CA C 13 54.096 0.07 . 1 . . . . . 127 LEU CA . 27757 1 463 . 1 1 127 127 LEU CB C 13 41.983 0.00 . 1 . . . . . 127 LEU CB . 27757 1 464 . 1 1 127 127 LEU N N 15 126.038 0.04 . 1 . . . . . 127 LEU N . 27757 1 465 . 1 1 128 128 THR C C 13 174.807 0.00 . 1 . . . . . 128 THR C . 27757 1 466 . 1 1 128 128 THR CA C 13 58.791 0.04 . 1 . . . . . 128 THR CA . 27757 1 467 . 1 1 128 128 THR CB C 13 70.312 0.00 . 1 . . . . . 128 THR CB . 27757 1 468 . 1 1 129 129 GLY H H 1 8.189 0.01 . 1 . . . . . 129 GLY H . 27757 1 469 . 1 1 129 129 GLY C C 13 175.963 1.11 . 1 . . . . . 129 GLY C . 27757 1 470 . 1 1 129 129 GLY CA C 13 44.843 0.04 . 1 . . . . . 129 GLY CA . 27757 1 471 . 1 1 129 129 GLY N N 15 106.812 0.01 . 1 . . . . . 129 GLY N . 27757 1 472 . 1 1 130 130 PHE H H 1 7.161 0.01 . 1 . . . . . 130 PHE H . 27757 1 473 . 1 1 130 130 PHE C C 13 179.971 0.00 . 1 . . . . . 130 PHE C . 27757 1 474 . 1 1 130 130 PHE CA C 13 57.744 0.12 . 1 . . . . . 130 PHE CA . 27757 1 475 . 1 1 130 130 PHE CB C 13 37.979 0.00 . 1 . . . . . 130 PHE CB . 27757 1 476 . 1 1 130 130 PHE N N 15 123.905 0.01 . 1 . . . . . 130 PHE N . 27757 1 stop_ save_