################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30834 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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 '3D 1H-13C NOESY aliphatic' . . . 30834 1 2 '3D HNCACB' . . . 30834 1 3 '3D 1H-15N NOESY' . . . 30834 1 4 '3D HCCH-TOCSY' . . . 30834 1 5 '3D HNCA' . . . 30834 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 3 3 VAL HA H 1 3.977 0.004 . 1 . . 272 . A 3 VAL HA . 30834 1 2 . 1 . 1 3 3 VAL HB H 1 2.174 0.004 . 1 . . 274 . A 3 VAL HB . 30834 1 3 . 1 . 1 3 3 VAL HG11 H 1 1.013 0.015 . 1 . . 318 . A 3 VAL HG11 . 30834 1 4 . 1 . 1 3 3 VAL HG12 H 1 1.013 0.015 . 1 . . 318 . A 3 VAL HG12 . 30834 1 5 . 1 . 1 3 3 VAL HG13 H 1 1.013 0.015 . 1 . . 318 . A 3 VAL HG13 . 30834 1 6 . 1 . 1 3 3 VAL CA C 13 63.136 . . 1 . . 320 . A 3 VAL CA . 30834 1 7 . 1 . 1 3 3 VAL CB C 13 32.261 . . 1 . . 319 . A 3 VAL CB . 30834 1 8 . 1 . 1 4 4 ILE H H 1 7.907 0.007 . 1 . . 280 . A 4 ILE H . 30834 1 9 . 1 . 1 4 4 ILE HA H 1 3.941 0.003 . 1 . . 322 . A 4 ILE HA . 30834 1 10 . 1 . 1 4 4 ILE HB H 1 2.008 0.008 . 1 . . 324 . A 4 ILE HB . 30834 1 11 . 1 . 1 4 4 ILE HG12 H 1 1.241 . . 2 . . 325 . A 4 ILE HG12 . 30834 1 12 . 1 . 1 4 4 ILE HG13 H 1 2.029 . . 2 . . 275 . A 4 ILE HG13 . 30834 1 13 . 1 . 1 4 4 ILE HD11 H 1 0.925 . . 1 . . 326 . A 4 ILE HD11 . 30834 1 14 . 1 . 1 4 4 ILE HD12 H 1 0.925 . . 1 . . 326 . A 4 ILE HD12 . 30834 1 15 . 1 . 1 4 4 ILE HD13 H 1 0.925 . . 1 . . 326 . A 4 ILE HD13 . 30834 1 16 . 1 . 1 4 4 ILE CA C 13 63.960 . . 1 . . 273 . A 4 ILE CA . 30834 1 17 . 1 . 1 4 4 ILE CB C 13 38.523 . . 1 . . 286 . A 4 ILE CB . 30834 1 18 . 1 . 1 4 4 ILE N N 15 120.536 . . 1 . . 281 . A 4 ILE N . 30834 1 19 . 1 . 1 5 5 LEU H H 1 8.211 0.004 . 1 . . 118 . A 5 LEU H . 30834 1 20 . 1 . 1 5 5 LEU HA H 1 4.008 0.014 . 1 . . 120 . A 5 LEU HA . 30834 1 21 . 1 . 1 5 5 LEU HB2 H 1 1.848 0.011 . 2 . . 309 . A 5 LEU HB2 . 30834 1 22 . 1 . 1 5 5 LEU HB3 H 1 1.823 0.008 . 2 . . 121 . A 5 LEU HB3 . 30834 1 23 . 1 . 1 5 5 LEU HG H 1 1.565 0.008 . 1 . . 122 . A 5 LEU HG . 30834 1 24 . 1 . 1 5 5 LEU HD11 H 1 0.918 0.013 . 2 . . 123 . A 5 LEU HD11 . 30834 1 25 . 1 . 1 5 5 LEU HD12 H 1 0.918 0.013 . 2 . . 123 . A 5 LEU HD12 . 30834 1 26 . 1 . 1 5 5 LEU HD13 H 1 0.918 0.013 . 2 . . 123 . A 5 LEU HD13 . 30834 1 27 . 1 . 1 5 5 LEU HD21 H 1 0.881 0.02 . 2 . . 310 . A 5 LEU HD21 . 30834 1 28 . 1 . 1 5 5 LEU HD22 H 1 0.881 0.02 . 2 . . 310 . A 5 LEU HD22 . 30834 1 29 . 1 . 1 5 5 LEU HD23 H 1 0.881 0.02 . 2 . . 310 . A 5 LEU HD23 . 30834 1 30 . 1 . 1 5 5 LEU CA C 13 57.906 . . 1 . . 254 . A 5 LEU CA . 30834 1 31 . 1 . 1 5 5 LEU CB C 13 41.309 . . 1 . . 255 . A 5 LEU CB . 30834 1 32 . 1 . 1 5 5 LEU N N 15 118.990 . . 1 . . 119 . A 5 LEU N . 30834 1 33 . 1 . 1 6 6 SER HA H 1 4.082 0.001 . 1 . . 282 . A 6 SER HA . 30834 1 34 . 1 . 1 6 6 SER HB2 H 1 3.819 0.002 . 1 . . 284 . A 6 SER HB2 . 30834 1 35 . 1 . 1 6 6 SER CA C 13 63.205 . . 1 . . 283 . A 6 SER CA . 30834 1 36 . 1 . 1 6 6 SER CB C 13 63.708 . . 1 . . 285 . A 6 SER CB . 30834 1 37 . 1 . 1 7 7 ILE H H 1 7.741 0.002 . 1 . . 131 . A 7 ILE H . 30834 1 38 . 1 . 1 7 7 ILE HA H 1 3.973 0.014 . 1 . . 191 . A 7 ILE HA . 30834 1 39 . 1 . 1 7 7 ILE HB H 1 2.036 0.012 . 1 . . 193 . A 7 ILE HB . 30834 1 40 . 1 . 1 7 7 ILE HG12 H 1 1.739 0.009 . 2 . . 321 . A 7 ILE HG12 . 30834 1 41 . 1 . 1 7 7 ILE HG13 H 1 1.234 0.005 . 2 . . 195 . A 7 ILE HG13 . 30834 1 42 . 1 . 1 7 7 ILE HG21 H 1 0.938 0.018 . 1 . . 147 . A 7 ILE HG21 . 30834 1 43 . 1 . 1 7 7 ILE HG22 H 1 0.938 0.018 . 1 . . 147 . A 7 ILE HG22 . 30834 1 44 . 1 . 1 7 7 ILE HG23 H 1 0.938 0.018 . 1 . . 147 . A 7 ILE HG23 . 30834 1 45 . 1 . 1 7 7 ILE HD11 H 1 0.875 . . 1 . . 307 . A 7 ILE HD11 . 30834 1 46 . 1 . 1 7 7 ILE HD12 H 1 0.875 . . 1 . . 307 . A 7 ILE HD12 . 30834 1 47 . 1 . 1 7 7 ILE HD13 H 1 0.875 . . 1 . . 307 . A 7 ILE HD13 . 30834 1 48 . 1 . 1 7 7 ILE CA C 13 64.551 . . 1 . . 192 . A 7 ILE CA . 30834 1 49 . 1 . 1 7 7 ILE CB C 13 38.308 . . 1 . . 234 . A 7 ILE CB . 30834 1 50 . 1 . 1 7 7 ILE N N 15 121.625 0.008 . 1 . . 133 . A 7 ILE N . 30834 1 51 . 1 . 1 8 8 VAL H H 1 8.128 0.003 . 1 . . 75 . A 8 VAL H . 30834 1 52 . 1 . 1 8 8 VAL HA H 1 3.654 0.013 . 1 . . 77 . A 8 VAL HA . 30834 1 53 . 1 . 1 8 8 VAL HB H 1 2.210 0.006 . 1 . . 78 . A 8 VAL HB . 30834 1 54 . 1 . 1 8 8 VAL HG11 H 1 1.046 0.009 . 2 . . 79 . A 8 VAL HG11 . 30834 1 55 . 1 . 1 8 8 VAL HG12 H 1 1.046 0.009 . 2 . . 79 . A 8 VAL HG12 . 30834 1 56 . 1 . 1 8 8 VAL HG13 H 1 1.046 0.009 . 2 . . 79 . A 8 VAL HG13 . 30834 1 57 . 1 . 1 8 8 VAL HG21 H 1 0.931 0.009 . 2 . . 80 . A 8 VAL HG21 . 30834 1 58 . 1 . 1 8 8 VAL HG22 H 1 0.931 0.009 . 2 . . 80 . A 8 VAL HG22 . 30834 1 59 . 1 . 1 8 8 VAL HG23 H 1 0.931 0.009 . 2 . . 80 . A 8 VAL HG23 . 30834 1 60 . 1 . 1 8 8 VAL CA C 13 66.310 . . 1 . . 178 . A 8 VAL CA . 30834 1 61 . 1 . 1 8 8 VAL CB C 13 32.063 . . 1 . . 237 . A 8 VAL CB . 30834 1 62 . 1 . 1 8 8 VAL CG1 C 13 22.256 . . 1 . . 265 . A 8 VAL CG1 . 30834 1 63 . 1 . 1 8 8 VAL N N 15 118.114 . . 1 . . 76 . A 8 VAL N . 30834 1 64 . 1 . 1 9 9 GLY H H 1 8.580 0.008 . 1 . . 1 . A 9 GLY H . 30834 1 65 . 1 . 1 9 9 GLY HA2 H 1 3.688 0.003 . 2 . . 4 . A 9 GLY HA2 . 30834 1 66 . 1 . 1 9 9 GLY HA3 H 1 3.933 0.006 . 2 . . 3 . A 9 GLY HA3 . 30834 1 67 . 1 . 1 9 9 GLY CA C 13 47.402 . . 1 . . 196 . A 9 GLY CA . 30834 1 68 . 1 . 1 9 9 GLY N N 15 106.437 . . 1 . . 2 . A 9 GLY N . 30834 1 69 . 1 . 1 10 10 THR H H 1 7.973 0.004 . 1 . . 57 . A 10 THR H . 30834 1 70 . 1 . 1 10 10 THR HA H 1 4.036 0.017 . 1 . . 164 . A 10 THR HA . 30834 1 71 . 1 . 1 10 10 THR HB H 1 4.341 0.007 . 1 . . 158 . A 10 THR HB . 30834 1 72 . 1 . 1 10 10 THR HG21 H 1 1.286 0.002 . 1 . . 160 . A 10 THR HG1 . 30834 1 73 . 1 . 1 10 10 THR HG22 H 1 1.286 0.002 . 1 . . 160 . A 10 THR HG1 . 30834 1 74 . 1 . 1 10 10 THR HG23 H 1 1.286 0.002 . 1 . . 160 . A 10 THR HG1 . 30834 1 75 . 1 . 1 10 10 THR CA C 13 65.633 . . 1 . . 165 . A 10 THR CA . 30834 1 76 . 1 . 1 10 10 THR CB C 13 68.906 . . 1 . . 159 . A 10 THR CB . 30834 1 77 . 1 . 1 10 10 THR CG2 C 13 22.206 . . 1 . . 288 . A 10 THR CG2 . 30834 1 78 . 1 . 1 10 10 THR N N 15 117.285 . . 1 . . 58 . A 10 THR N . 30834 1 79 . 1 . 1 11 11 VAL H H 1 7.966 0.005 . 1 . . 136 . A 11 VAL H . 30834 1 80 . 1 . 1 11 11 VAL HA H 1 3.942 0.008 . 1 . . 166 . A 11 VAL HA . 30834 1 81 . 1 . 1 11 11 VAL HB H 1 2.209 0.007 . 1 . . 154 . A 11 VAL HB . 30834 1 82 . 1 . 1 11 11 VAL HG11 H 1 1.112 0.003 . 2 . . 156 . A 11 VAL HG11 . 30834 1 83 . 1 . 1 11 11 VAL HG12 H 1 1.112 0.003 . 2 . . 156 . A 11 VAL HG12 . 30834 1 84 . 1 . 1 11 11 VAL HG13 H 1 1.112 0.003 . 2 . . 156 . A 11 VAL HG13 . 30834 1 85 . 1 . 1 11 11 VAL HG21 H 1 1.014 0.006 . 2 . . 157 . A 11 VAL HG21 . 30834 1 86 . 1 . 1 11 11 VAL HG22 H 1 1.014 0.006 . 2 . . 157 . A 11 VAL HG22 . 30834 1 87 . 1 . 1 11 11 VAL HG23 H 1 1.014 0.006 . 2 . . 157 . A 11 VAL HG23 . 30834 1 88 . 1 . 1 11 11 VAL CA C 13 65.686 . . 1 . . 167 . A 11 VAL CA . 30834 1 89 . 1 . 1 11 11 VAL CB C 13 31.834 . . 1 . . 238 . A 11 VAL CB . 30834 1 90 . 1 . 1 11 11 VAL CG1 C 13 22.766 . . 2 . . 263 . A 11 VAL CG1 . 30834 1 91 . 1 . 1 11 11 VAL CG2 C 13 22.910 . . 2 . . 264 . A 11 VAL CG2 . 30834 1 92 . 1 . 1 11 11 VAL N N 15 120.884 0.062 . 1 . . 137 . A 11 VAL N . 30834 1 93 . 1 . 1 12 12 LEU H H 1 8.373 0.002 . 1 . . 67 . A 12 LEU H . 30834 1 94 . 1 . 1 12 12 LEU HA H 1 4.121 0.016 . 1 . . 69 . A 12 LEU HA . 30834 1 95 . 1 . 1 12 12 LEU HB2 H 1 1.840 0.017 . 2 . . 71 . A 12 LEU HB2 . 30834 1 96 . 1 . 1 12 12 LEU HB3 H 1 1.580 0.013 . 2 . . 72 . A 12 LEU HB3 . 30834 1 97 . 1 . 1 12 12 LEU HG H 1 1.841 . . 1 . . 70 . A 12 LEU HG . 30834 1 98 . 1 . 1 12 12 LEU HD11 H 1 0.879 0.004 . 2 . . 73 . A 12 LEU HD11 . 30834 1 99 . 1 . 1 12 12 LEU HD12 H 1 0.879 0.004 . 2 . . 73 . A 12 LEU HD12 . 30834 1 100 . 1 . 1 12 12 LEU HD13 H 1 0.879 0.004 . 2 . . 73 . A 12 LEU HD13 . 30834 1 101 . 1 . 1 12 12 LEU HD21 H 1 0.869 0.021 . 2 . . 74 . A 12 LEU HD21 . 30834 1 102 . 1 . 1 12 12 LEU HD22 H 1 0.869 0.021 . 2 . . 74 . A 12 LEU HD22 . 30834 1 103 . 1 . 1 12 12 LEU HD23 H 1 0.869 0.021 . 2 . . 74 . A 12 LEU HD23 . 30834 1 104 . 1 . 1 12 12 LEU CA C 13 57.760 . . 1 . . 198 . A 12 LEU CA . 30834 1 105 . 1 . 1 12 12 LEU CB C 13 42.113 . . 1 . . 222 . A 12 LEU CB . 30834 1 106 . 1 . 1 12 12 LEU N N 15 117.893 0.018 . 1 . . 68 . A 12 LEU N . 30834 1 107 . 1 . 1 13 13 SER H H 1 8.129 0.002 . 1 . . 5 . A 13 SER H . 30834 1 108 . 1 . 1 13 13 SER HA H 1 4.228 0.028 . 1 . . 183 . A 13 SER HA . 30834 1 109 . 1 . 1 13 13 SER HB2 H 1 3.996 0.012 . 1 . . 151 . A 13 SER HB2 . 30834 1 110 . 1 . 1 13 13 SER CA C 13 61.157 . . 1 . . 185 . A 13 SER CA . 30834 1 111 . 1 . 1 13 13 SER CB C 13 62.942 . . 1 . . 180 . A 13 SER CB . 30834 1 112 . 1 . 1 13 13 SER N N 15 113.203 0.006 . 1 . . 6 . A 13 SER N . 30834 1 113 . 1 . 1 14 14 ASP H H 1 7.913 0.007 . 1 . . 138 . A 14 ASP H . 30834 1 114 . 1 . 1 14 14 ASP HA H 1 4.464 0.002 . 1 . . 142 . A 14 ASP HA . 30834 1 115 . 1 . 1 14 14 ASP HB2 H 1 2.686 0.009 . 2 . . 141 . A 14 ASP HB2 . 30834 1 116 . 1 . 1 14 14 ASP HB3 H 1 2.880 0.007 . 2 . . 140 . A 14 ASP HB3 . 30834 1 117 . 1 . 1 14 14 ASP CA C 13 57.703 . . 1 . . 200 . A 14 ASP CA . 30834 1 118 . 1 . 1 14 14 ASP CB C 13 41.141 . . 1 . . 225 . A 14 ASP CB . 30834 1 119 . 1 . 1 14 14 ASP N N 15 120.646 . . 1 . . 139 . A 14 ASP N . 30834 1 120 . 1 . 1 15 15 ILE H H 1 8.002 0.007 . 1 . . 101 . A 15 ILE H . 30834 1 121 . 1 . 1 15 15 ILE HA H 1 3.895 0.007 . 1 . . 103 . A 15 ILE HA . 30834 1 122 . 1 . 1 15 15 ILE HB H 1 2.140 0.008 . 1 . . 104 . A 15 ILE HB . 30834 1 123 . 1 . 1 15 15 ILE HG12 H 1 1.359 0.004 . 2 . . 106 . A 15 ILE HG12 . 30834 1 124 . 1 . 1 15 15 ILE HG13 H 1 1.901 0.007 . 2 . . 105 . A 15 ILE HG13 . 30834 1 125 . 1 . 1 15 15 ILE HG21 H 1 1.042 0.005 . 1 . . 107 . A 15 ILE HG21 . 30834 1 126 . 1 . 1 15 15 ILE HG22 H 1 1.042 0.005 . 1 . . 107 . A 15 ILE HG22 . 30834 1 127 . 1 . 1 15 15 ILE HG23 H 1 1.042 0.005 . 1 . . 107 . A 15 ILE HG23 . 30834 1 128 . 1 . 1 15 15 ILE HD11 H 1 0.925 0.007 . 1 . . 108 . A 15 ILE HD11 . 30834 1 129 . 1 . 1 15 15 ILE HD12 H 1 0.925 0.007 . 1 . . 108 . A 15 ILE HD12 . 30834 1 130 . 1 . 1 15 15 ILE HD13 H 1 0.925 0.007 . 1 . . 108 . A 15 ILE HD13 . 30834 1 131 . 1 . 1 15 15 ILE CA C 13 64.147 . . 1 . . 174 . A 15 ILE CA . 30834 1 132 . 1 . 1 15 15 ILE CB C 13 38.319 . . 1 . . 233 . A 15 ILE CB . 30834 1 133 . 1 . 1 15 15 ILE N N 15 119.098 . . 1 . . 102 . A 15 ILE N . 30834 1 134 . 1 . 1 16 16 ILE H H 1 8.449 0.003 . 1 . . 113 . A 16 ILE H . 30834 1 135 . 1 . 1 16 16 ILE HA H 1 3.810 0.004 . 1 . . 115 . A 16 ILE HA . 30834 1 136 . 1 . 1 16 16 ILE HB H 1 2.038 0.005 . 1 . . 116 . A 16 ILE HB . 30834 1 137 . 1 . 1 16 16 ILE HG12 H 1 1.124 0.016 . 2 . . 267 . A 16 ILE HG12 . 30834 1 138 . 1 . 1 16 16 ILE HG13 H 1 1.738 0.006 . 2 . . 117 . A 16 ILE HG13 . 30834 1 139 . 1 . 1 16 16 ILE HG21 H 1 0.902 0.013 . 1 . . 152 . A 16 ILE HG21 . 30834 1 140 . 1 . 1 16 16 ILE HG22 H 1 0.902 0.013 . 1 . . 152 . A 16 ILE HG22 . 30834 1 141 . 1 . 1 16 16 ILE HG23 H 1 0.902 0.013 . 1 . . 152 . A 16 ILE HG23 . 30834 1 142 . 1 . 1 16 16 ILE HD11 H 1 0.777 0.004 . 1 . . 302 . A 16 ILE HD11 . 30834 1 143 . 1 . 1 16 16 ILE HD12 H 1 0.777 0.004 . 1 . . 302 . A 16 ILE HD12 . 30834 1 144 . 1 . 1 16 16 ILE HD13 H 1 0.777 0.004 . 1 . . 302 . A 16 ILE HD13 . 30834 1 145 . 1 . 1 16 16 ILE CA C 13 64.320 . . 1 . . 173 . A 16 ILE CA . 30834 1 146 . 1 . 1 16 16 ILE CB C 13 37.519 . . 1 . . 231 . A 16 ILE CB . 30834 1 147 . 1 . 1 16 16 ILE N N 15 119.297 . . 1 . . 114 . A 16 ILE N . 30834 1 148 . 1 . 1 17 17 GLN H H 1 8.070 0.007 . 1 . . 29 . A 17 GLN H . 30834 1 149 . 1 . 1 17 17 GLN HA H 1 3.939 0.008 . 1 . . 31 . A 17 GLN HA . 30834 1 150 . 1 . 1 17 17 GLN HB2 H 1 2.249 0.023 . 2 . . 33 . A 17 GLN HB2 . 30834 1 151 . 1 . 1 17 17 GLN HB3 H 1 2.163 0.011 . 2 . . 32 . A 17 GLN HB3 . 30834 1 152 . 1 . 1 17 17 GLN HG2 H 1 2.525 0.005 . 1 . . 34 . A 17 GLN HG2 . 30834 1 153 . 1 . 1 17 17 GLN HE21 H 1 7.203 0.003 . 1 . . 148 . A 17 GLN HE21 . 30834 1 154 . 1 . 1 17 17 GLN HE22 H 1 6.721 . . 1 . . 150 . A 17 GLN HE22 . 30834 1 155 . 1 . 1 17 17 GLN CA C 13 59.429 . . 1 . . 189 . A 17 GLN CA . 30834 1 156 . 1 . 1 17 17 GLN CB C 13 29.250 . . 1 . . 235 . A 17 GLN CB . 30834 1 157 . 1 . 1 17 17 GLN N N 15 116.670 0.0 . 1 . . 30 . A 17 GLN N . 30834 1 158 . 1 . 1 17 17 GLN NE2 N 15 111.107 . . 1 . . 149 . A 17 GLN NE2 . 30834 1 159 . 1 . 1 18 18 LYS H H 1 7.799 0.012 . 1 . . 25 . A 18 LYS H . 30834 1 160 . 1 . 1 18 18 LYS HA H 1 3.997 0.004 . 1 . . 27 . A 18 LYS HA . 30834 1 161 . 1 . 1 18 18 LYS HB2 H 1 1.625 0.019 . 2 . . 28 . A 18 LYS HB2 . 30834 1 162 . 1 . 1 18 18 LYS HB3 H 1 1.355 0.003 . 2 . . 311 . A 18 LYS HB3 . 30834 1 163 . 1 . 1 18 18 LYS HG2 H 1 0.873 0.002 . 1 . . 313 . A 18 LYS HG2 . 30834 1 164 . 1 . 1 18 18 LYS HD2 H 1 1.212 0.006 . 1 . . 312 . A 18 LYS HD2 . 30834 1 165 . 1 . 1 18 18 LYS CA C 13 58.853 . . 1 . . 204 . A 18 LYS CA . 30834 1 166 . 1 . 1 18 18 LYS CB C 13 33.456 . . 1 . . 239 . A 18 LYS CB . 30834 1 167 . 1 . 1 18 18 LYS N N 15 116.670 . . 1 . . 26 . A 18 LYS N . 30834 1 168 . 1 . 1 19 19 TYR H H 1 7.884 0.006 . 1 . . 7 . A 19 TYR H . 30834 1 169 . 1 . 1 19 19 TYR HA H 1 4.607 0.01 . 1 . . 9 . A 19 TYR HA . 30834 1 170 . 1 . 1 19 19 TYR HB2 H 1 2.611 0.011 . 2 . . 11 . A 19 TYR HB2 . 30834 1 171 . 1 . 1 19 19 TYR HB3 H 1 2.848 0.014 . 2 . . 10 . A 19 TYR HB3 . 30834 1 172 . 1 . 1 19 19 TYR HD1 H 1 7.153 0.009 . 1 . . 257 . A 19 TYR HD1 . 30834 1 173 . 1 . 1 19 19 TYR HD2 H 1 7.153 0.009 . 1 . . 257 . A 19 TYR HD2 . 30834 1 174 . 1 . 1 19 19 TYR HE1 H 1 6.770 . . 1 . . 270 . A 19 TYR HE1 . 30834 1 175 . 1 . 1 19 19 TYR HE2 H 1 6.770 . . 1 . . 270 . A 19 TYR HE2 . 30834 1 176 . 1 . 1 19 19 TYR CA C 13 59.648 . . 1 . . 271 . A 19 TYR CA . 30834 1 177 . 1 . 1 19 19 TYR CB C 13 39.825 . . 1 . . 242 . A 19 TYR CB . 30834 1 178 . 1 . 1 19 19 TYR N N 15 114.250 . . 1 . . 8 . A 19 TYR N . 30834 1 179 . 1 . 1 20 20 PHE H H 1 8.072 0.007 . 1 . . 35 . A 20 PHE H . 30834 1 180 . 1 . 1 20 20 PHE HA H 1 4.568 0.011 . 1 . . 37 . A 20 PHE HA . 30834 1 181 . 1 . 1 20 20 PHE HB2 H 1 3.127 0.016 . 2 . . 259 . A 20 PHE HB2 . 30834 1 182 . 1 . 1 20 20 PHE HB3 H 1 3.113 0.01 . 2 . . 38 . A 20 PHE HB3 . 30834 1 183 . 1 . 1 20 20 PHE HD1 H 1 7.105 0.012 . 1 . . 258 . A 20 PHE HD1 . 30834 1 184 . 1 . 1 20 20 PHE HD2 H 1 7.105 0.012 . 1 . . 258 . A 20 PHE HD2 . 30834 1 185 . 1 . 1 20 20 PHE CA C 13 58.738 . . 1 . . 202 . A 20 PHE CA . 30834 1 186 . 1 . 1 20 20 PHE CB C 13 39.589 . . 1 . . 228 . A 20 PHE CB . 30834 1 187 . 1 . 1 20 20 PHE N N 15 117.126 0.014 . 1 . . 36 . A 20 PHE N . 30834 1 188 . 1 . 1 21 21 PHE H H 1 7.699 0.004 . 1 . . 39 . A 21 PHE H . 30834 1 189 . 1 . 1 21 21 PHE HA H 1 4.582 0.015 . 1 . . 41 . A 21 PHE HA . 30834 1 190 . 1 . 1 21 21 PHE HB2 H 1 3.137 0.005 . 2 . . 43 . A 21 PHE HB2 . 30834 1 191 . 1 . 1 21 21 PHE HB3 H 1 3.247 0.006 . 2 . . 42 . A 21 PHE HB3 . 30834 1 192 . 1 . 1 21 21 PHE HD1 H 1 7.269 0.012 . 1 . . 268 . A 21 PHE HD1 . 30834 1 193 . 1 . 1 21 21 PHE HD2 H 1 7.269 0.012 . 1 . . 268 . A 21 PHE HD2 . 30834 1 194 . 1 . 1 21 21 PHE CA C 13 57.530 . . 1 . . 201 . A 21 PHE CA . 30834 1 195 . 1 . 1 21 21 PHE CB C 13 38.277 . . 1 . . 229 . A 21 PHE CB . 30834 1 196 . 1 . 1 21 21 PHE N N 15 116.793 0.0 . 1 . . 40 . A 21 PHE N . 30834 1 197 . 1 . 1 23 23 PRO HA H 1 4.346 0.004 . 1 . . 205 . A 23 PRO HA . 30834 1 198 . 1 . 1 23 23 PRO HB2 H 1 2.432 0.004 . 2 . . 208 . A 23 PRO HB2 . 30834 1 199 . 1 . 1 23 23 PRO HB3 H 1 2.017 0.004 . 2 . . 244 . A 23 PRO HB3 . 30834 1 200 . 1 . 1 23 23 PRO HG2 H 1 2.151 0.005 . 2 . . 292 . A 23 PRO HG2 . 30834 1 201 . 1 . 1 23 23 PRO HG3 H 1 2.023 0.007 . 2 . . 209 . A 23 PRO HG3 . 30834 1 202 . 1 . 1 23 23 PRO HD2 H 1 3.874 0.005 . 2 . . 316 . A 23 PRO HD2 . 30834 1 203 . 1 . 1 23 23 PRO HD3 H 1 3.148 . . 2 . . 207 . A 23 PRO HD3 . 30834 1 204 . 1 . 1 23 23 PRO CA C 13 64.437 . . 1 . . 206 . A 23 PRO CA . 30834 1 205 . 1 . 1 23 23 PRO CB C 13 32.183 . . 1 . . 245 . A 23 PRO CB . 30834 1 206 . 1 . 1 24 24 THR HA H 1 3.939 0.009 . 1 . . 168 . A 24 THR HA . 30834 1 207 . 1 . 1 24 24 THR HB H 1 4.059 0.013 . 1 . . 161 . A 24 THR HB . 30834 1 208 . 1 . 1 24 24 THR HG21 H 1 1.196 0.005 . 1 . . 163 . A 24 THR HG1 . 30834 1 209 . 1 . 1 24 24 THR HG22 H 1 1.196 0.005 . 1 . . 163 . A 24 THR HG1 . 30834 1 210 . 1 . 1 24 24 THR HG23 H 1 1.196 0.005 . 1 . . 163 . A 24 THR HG1 . 30834 1 211 . 1 . 1 24 24 THR CA C 13 65.686 . . 1 . . 169 . A 24 THR CA . 30834 1 212 . 1 . 1 24 24 THR CB C 13 68.363 . . 1 . . 162 . A 24 THR CB . 30834 1 213 . 1 . 1 24 24 THR CG2 C 13 22.361 . . 1 . . 262 . A 24 THR CG2 . 30834 1 214 . 1 . 1 25 25 LEU H H 1 7.651 0.009 . 1 . . 134 . A 25 LEU H . 30834 1 215 . 1 . 1 25 25 LEU HA H 1 3.975 0.008 . 1 . . 246 . A 25 LEU HA . 30834 1 216 . 1 . 1 25 25 LEU HB2 H 1 1.700 0.007 . 2 . . 248 . A 25 LEU HB2 . 30834 1 217 . 1 . 1 25 25 LEU HB3 H 1 1.586 0.008 . 2 . . 293 . A 25 LEU HB3 . 30834 1 218 . 1 . 1 25 25 LEU HD11 H 1 0.849 0.015 . 2 . . 295 . A 25 LEU HD11 . 30834 1 219 . 1 . 1 25 25 LEU HD12 H 1 0.849 0.015 . 2 . . 295 . A 25 LEU HD12 . 30834 1 220 . 1 . 1 25 25 LEU HD13 H 1 0.849 0.015 . 2 . . 295 . A 25 LEU HD13 . 30834 1 221 . 1 . 1 25 25 LEU HD21 H 1 0.804 0.025 . 2 . . 296 . A 25 LEU HD21 . 30834 1 222 . 1 . 1 25 25 LEU HD22 H 1 0.804 0.025 . 2 . . 296 . A 25 LEU HD22 . 30834 1 223 . 1 . 1 25 25 LEU HD23 H 1 0.804 0.025 . 2 . . 296 . A 25 LEU HD23 . 30834 1 224 . 1 . 1 25 25 LEU CA C 13 58.078 . . 1 . . 247 . A 25 LEU CA . 30834 1 225 . 1 . 1 25 25 LEU CB C 13 41.539 . . 1 . . 249 . A 25 LEU CB . 30834 1 226 . 1 . 1 25 25 LEU N N 15 121.187 . . 1 . . 135 . A 25 LEU N . 30834 1 227 . 1 . 1 26 26 PHE H H 1 7.820 0.001 . 1 . . 20 . A 26 PHE H . 30834 1 228 . 1 . 1 26 26 PHE HA H 1 4.234 0.004 . 1 . . 22 . A 26 PHE HA . 30834 1 229 . 1 . 1 26 26 PHE HB2 H 1 3.149 0.025 . 2 . . 24 . A 26 PHE HB2 . 30834 1 230 . 1 . 1 26 26 PHE HB3 H 1 3.225 0.008 . 2 . . 23 . A 26 PHE HB3 . 30834 1 231 . 1 . 1 26 26 PHE HD1 H 1 7.255 0.011 . 1 . . 256 . A 26 PHE HD1 . 30834 1 232 . 1 . 1 26 26 PHE HD2 H 1 7.255 0.011 . 1 . . 256 . A 26 PHE HD2 . 30834 1 233 . 1 . 1 26 26 PHE CA C 13 60.984 . . 1 . . 186 . A 26 PHE CA . 30834 1 234 . 1 . 1 26 26 PHE CB C 13 38.213 . . 1 . . 227 . A 26 PHE CB . 30834 1 235 . 1 . 1 26 26 PHE N N 15 116.255 . . 1 . . 21 . A 26 PHE N . 30834 1 236 . 1 . 1 27 27 ARG H H 1 7.853 0.001 . 1 . . 88 . A 27 ARG H . 30834 1 237 . 1 . 1 27 27 ARG HA H 1 4.050 0.007 . 1 . . 90 . A 27 ARG HA . 30834 1 238 . 1 . 1 27 27 ARG HB2 H 1 2.015 0.009 . 1 . . 92 . A 27 ARG HB2 . 30834 1 239 . 1 . 1 27 27 ARG HG2 H 1 1.832 0.013 . 2 . . 329 . A 27 ARG HG2 . 30834 1 240 . 1 . 1 27 27 ARG HG3 H 1 1.647 0.006 . 2 . . 188 . A 27 ARG HG3 . 30834 1 241 . 1 . 1 27 27 ARG HD2 H 1 3.212 0.022 . 1 . . 91 . A 27 ARG HD2 . 30834 1 242 . 1 . 1 27 27 ARG CA C 13 58.734 . . 1 . . 187 . A 27 ARG CA . 30834 1 243 . 1 . 1 27 27 ARG CB C 13 30.283 . . 1 . . 251 . A 27 ARG CB . 30834 1 244 . 1 . 1 27 27 ARG N N 15 118.499 0.0 . 1 . . 89 . A 27 ARG N . 30834 1 245 . 1 . 1 28 28 VAL H H 1 7.826 0.002 . 1 . . 51 . A 28 VAL H . 30834 1 246 . 1 . 1 28 28 VAL HA H 1 3.700 0.01 . 1 . . 53 . A 28 VAL HA . 30834 1 247 . 1 . 1 28 28 VAL HB H 1 2.263 0.007 . 1 . . 54 . A 28 VAL HB . 30834 1 248 . 1 . 1 28 28 VAL HG11 H 1 0.925 0.013 . 2 . . 55 . A 28 VAL HG11 . 30834 1 249 . 1 . 1 28 28 VAL HG12 H 1 0.925 0.013 . 2 . . 55 . A 28 VAL HG12 . 30834 1 250 . 1 . 1 28 28 VAL HG13 H 1 0.925 0.013 . 2 . . 55 . A 28 VAL HG13 . 30834 1 251 . 1 . 1 28 28 VAL HG21 H 1 1.068 0.01 . 2 . . 56 . A 28 VAL HG21 . 30834 1 252 . 1 . 1 28 28 VAL HG22 H 1 1.068 0.01 . 2 . . 56 . A 28 VAL HG22 . 30834 1 253 . 1 . 1 28 28 VAL HG23 H 1 1.068 0.01 . 2 . . 56 . A 28 VAL HG23 . 30834 1 254 . 1 . 1 28 28 VAL CA C 13 65.579 . . 1 . . 171 . A 28 VAL CA . 30834 1 255 . 1 . 1 28 28 VAL CB C 13 31.547 . . 1 . . 236 . A 28 VAL CB . 30834 1 256 . 1 . 1 28 28 VAL N N 15 117.853 0.0 . 1 . . 52 . A 28 VAL N . 30834 1 257 . 1 . 1 29 29 ILE H H 1 7.912 0.004 . 1 . . 60 . A 29 ILE H . 30834 1 258 . 1 . 1 29 29 ILE HA H 1 3.666 0.007 . 1 . . 62 . A 29 ILE HA . 30834 1 259 . 1 . 1 29 29 ILE HB H 1 1.920 0.008 . 1 . . 63 . A 29 ILE HB . 30834 1 260 . 1 . 1 29 29 ILE HG12 H 1 1.678 0.011 . 2 . . 64 . A 29 ILE HG12 . 30834 1 261 . 1 . 1 29 29 ILE HG13 H 1 1.155 0.005 . 2 . . 65 . A 29 ILE HG13 . 30834 1 262 . 1 . 1 29 29 ILE HG21 H 1 0.892 0.009 . 1 . . 66 . A 29 ILE HG21 . 30834 1 263 . 1 . 1 29 29 ILE HG22 H 1 0.892 0.009 . 1 . . 66 . A 29 ILE HG22 . 30834 1 264 . 1 . 1 29 29 ILE HG23 H 1 0.892 0.009 . 1 . . 66 . A 29 ILE HG23 . 30834 1 265 . 1 . 1 29 29 ILE HD11 H 1 0.762 0.005 . 1 . . 299 . A 29 ILE HD11 . 30834 1 266 . 1 . 1 29 29 ILE HD12 H 1 0.762 0.005 . 1 . . 299 . A 29 ILE HD12 . 30834 1 267 . 1 . 1 29 29 ILE HD13 H 1 0.762 0.005 . 1 . . 299 . A 29 ILE HD13 . 30834 1 268 . 1 . 1 29 29 ILE CA C 13 64.091 . . 1 . . 172 . A 29 ILE CA . 30834 1 269 . 1 . 1 29 29 ILE CB C 13 37.644 . . 1 . . 232 . A 29 ILE CB . 30834 1 270 . 1 . 1 29 29 ILE N N 15 118.437 . . 1 . . 61 . A 29 ILE N . 30834 1 271 . 1 . 1 30 30 ARG H H 1 7.796 0.011 . 1 . . 81 . A 30 ARG H . 30834 1 272 . 1 . 1 30 30 ARG HA H 1 4.003 0.008 . 1 . . 83 . A 30 ARG HA . 30834 1 273 . 1 . 1 30 30 ARG HB2 H 1 1.657 . . 2 . . 86 . A 30 ARG HB2 . 30834 1 274 . 1 . 1 30 30 ARG HB3 H 1 1.900 0.021 . 2 . . 85 . A 30 ARG HB3 . 30834 1 275 . 1 . 1 30 30 ARG HG3 H 1 0.873 . . 1 . . 87 . A 30 ARG HG3 . 30834 1 276 . 1 . 1 30 30 ARG HD3 H 1 3.163 0.009 . 1 . . 84 . A 30 ARG HD3 . 30834 1 277 . 1 . 1 30 30 ARG CA C 13 59.026 . . 1 . . 190 . A 30 ARG CA . 30834 1 278 . 1 . 1 30 30 ARG CB C 13 29.766 . . 1 . . 252 . A 30 ARG CB . 30834 1 279 . 1 . 1 30 30 ARG N N 15 118.176 . . 1 . . 82 . A 30 ARG N . 30834 1 280 . 1 . 1 31 31 LEU H H 1 7.885 0.003 . 1 . . 94 . A 31 LEU H . 30834 1 281 . 1 . 1 31 31 LEU HA H 1 4.128 0.028 . 1 . . 96 . A 31 LEU HA . 30834 1 282 . 1 . 1 31 31 LEU HB2 H 1 1.588 0.013 . 2 . . 99 . A 31 LEU HB2 . 30834 1 283 . 1 . 1 31 31 LEU HB3 H 1 1.872 0.02 . 2 . . 98 . A 31 LEU HB3 . 30834 1 284 . 1 . 1 31 31 LEU HG H 1 1.866 0.006 . 1 . . 97 . A 31 LEU HG . 30834 1 285 . 1 . 1 31 31 LEU HD11 H 1 0.877 . . 1 . . 100 . A 31 LEU HD11 . 30834 1 286 . 1 . 1 31 31 LEU HD12 H 1 0.877 . . 1 . . 100 . A 31 LEU HD12 . 30834 1 287 . 1 . 1 31 31 LEU HD13 H 1 0.877 . . 1 . . 100 . A 31 LEU HD13 . 30834 1 288 . 1 . 1 31 31 LEU CA C 13 57.760 . . 1 . . 199 . A 31 LEU CA . 30834 1 289 . 1 . 1 31 31 LEU CB C 13 42.171 . . 1 . . 224 . A 31 LEU CB . 30834 1 290 . 1 . 1 31 31 LEU N N 15 119.364 0.01 . 1 . . 95 . A 31 LEU N . 30834 1 291 . 1 . 1 32 32 ALA H H 1 7.990 0.008 . 1 . . 143 . A 32 ALA H . 30834 1 292 . 1 . 1 32 32 ALA HA H 1 4.084 0.004 . 1 . . 145 . A 32 ALA HA . 30834 1 293 . 1 . 1 32 32 ALA HB1 H 1 1.437 0.009 . 1 . . 146 . A 32 ALA HB1 . 30834 1 294 . 1 . 1 32 32 ALA HB2 H 1 1.437 0.009 . 1 . . 146 . A 32 ALA HB2 . 30834 1 295 . 1 . 1 32 32 ALA HB3 H 1 1.437 0.009 . 1 . . 146 . A 32 ALA HB3 . 30834 1 296 . 1 . 1 32 32 ALA CA C 13 53.735 . . 1 . . 210 . A 32 ALA CA . 30834 1 297 . 1 . 1 32 32 ALA CB C 13 19.421 . . 1 . . 221 . A 32 ALA CB . 30834 1 298 . 1 . 1 32 32 ALA N N 15 120.015 . . 1 . . 144 . A 32 ALA N . 30834 1 299 . 1 . 1 33 33 ARG H H 1 7.833 0.006 . 1 . . 12 . A 33 ARG H . 30834 1 300 . 1 . 1 33 33 ARG HA H 1 4.143 0.004 . 1 . . 14 . A 33 ARG HA . 30834 1 301 . 1 . 1 33 33 ARG HB2 H 1 1.788 . . 2 . . 17 . A 33 ARG HB2 . 30834 1 302 . 1 . 1 33 33 ARG HB3 H 1 1.909 0.02 . 2 . . 16 . A 33 ARG HB3 . 30834 1 303 . 1 . 1 33 33 ARG HG2 H 1 0.871 . . 2 . . 328 . A 33 ARG HG2 . 30834 1 304 . 1 . 1 33 33 ARG HG3 H 1 1.637 . . 2 . . 18 . A 33 ARG HG3 . 30834 1 305 . 1 . 1 33 33 ARG HD3 H 1 3.152 0.008 . 1 . . 19 . A 33 ARG HD3 . 30834 1 306 . 1 . 1 33 33 ARG CA C 13 57.646 . . 1 . . 211 . A 33 ARG CA . 30834 1 307 . 1 . 1 33 33 ARG CB C 13 30.455 . . 1 . . 253 . A 33 ARG CB . 30834 1 308 . 1 . 1 33 33 ARG N N 15 114.557 . . 1 . . 13 . A 33 ARG N . 30834 1 309 . 1 . 1 34 34 ILE H H 1 7.804 0.004 . 1 . . 44 . A 34 ILE H . 30834 1 310 . 1 . 1 34 34 ILE HA H 1 4.138 0.006 . 1 . . 46 . A 34 ILE HA . 30834 1 311 . 1 . 1 34 34 ILE HB H 1 1.987 0.01 . 1 . . 47 . A 34 ILE HB . 30834 1 312 . 1 . 1 34 34 ILE HG12 H 1 1.276 0.006 . 2 . . 49 . A 34 ILE HG12 . 30834 1 313 . 1 . 1 34 34 ILE HG13 H 1 1.572 0.006 . 2 . . 48 . A 34 ILE HG13 . 30834 1 314 . 1 . 1 34 34 ILE HG21 H 1 0.926 0.011 . 1 . . 50 . A 34 ILE HG21 . 30834 1 315 . 1 . 1 34 34 ILE HG22 H 1 0.926 0.011 . 1 . . 50 . A 34 ILE HG22 . 30834 1 316 . 1 . 1 34 34 ILE HG23 H 1 0.926 0.011 . 1 . . 50 . A 34 ILE HG23 . 30834 1 317 . 1 . 1 34 34 ILE HD11 H 1 0.879 0.009 . 1 . . 314 . A 34 ILE HD11 . 30834 1 318 . 1 . 1 34 34 ILE HD12 H 1 0.879 0.009 . 1 . . 314 . A 34 ILE HD12 . 30834 1 319 . 1 . 1 34 34 ILE HD13 H 1 0.879 0.009 . 1 . . 314 . A 34 ILE HD13 . 30834 1 320 . 1 . 1 34 34 ILE CA C 13 61.963 . . 1 . . 182 . A 34 ILE CA . 30834 1 321 . 1 . 1 34 34 ILE CB C 13 38.319 . . 1 . . 230 . A 34 ILE CB . 30834 1 322 . 1 . 1 34 34 ILE N N 15 117.239 . . 1 . . 45 . A 34 ILE N . 30834 1 323 . 1 . 1 35 35 GLY H H 1 8.289 . . 1 . . 153 . A 35 GLY H . 30834 1 324 . 1 . 1 35 35 GLY HA2 H 1 3.899 0.004 . 2 . . 220 . A 35 GLY HA2 . 30834 1 325 . 1 . 1 35 35 GLY HA3 H 1 3.992 0.001 . 2 . . 217 . A 35 GLY HA3 . 30834 1 326 . 1 . 1 35 35 GLY CA C 13 45.940 . . 1 . . 218 . A 35 GLY CA . 30834 1 327 . 1 . 1 36 36 ARG H H 1 7.970 0.005 . 1 . . 260 . A 36 ARG H . 30834 1 328 . 1 . 1 36 36 ARG HA H 1 4.404 0.006 . 1 . . 212 . A 36 ARG HA . 30834 1 329 . 1 . 1 36 36 ARG HB2 H 1 1.892 0.004 . 2 . . 214 . A 36 ARG HB2 . 30834 1 330 . 1 . 1 36 36 ARG HB3 H 1 1.727 0.006 . 2 . . 215 . A 36 ARG HB3 . 30834 1 331 . 1 . 1 36 36 ARG HG3 H 1 1.599 0.004 . 1 . . 216 . A 36 ARG HG3 . 30834 1 332 . 1 . 1 36 36 ARG HD2 H 1 3.172 0.004 . 1 . . 290 . A 36 ARG HD2 . 30834 1 333 . 1 . 1 36 36 ARG CA C 13 55.350 . . 1 . . 213 . A 36 ARG CA . 30834 1 334 . 1 . 1 36 36 ARG CB C 13 31.373 . . 1 . . 250 . A 36 ARG CB . 30834 1 335 . 1 . 1 36 36 ARG N N 15 119.056 . . 1 . . 261 . A 36 ARG N . 30834 1 336 . 1 . 1 37 37 ILE H H 1 7.588 0.003 . 1 . . 124 . A 37 ILE H . 30834 1 337 . 1 . 1 37 37 ILE HA H 1 4.068 0.004 . 1 . . 126 . A 37 ILE HA . 30834 1 338 . 1 . 1 37 37 ILE HB H 1 1.812 0.003 . 1 . . 127 . A 37 ILE HB . 30834 1 339 . 1 . 1 37 37 ILE HG12 H 1 1.125 0.007 . 2 . . 129 . A 37 ILE HG12 . 30834 1 340 . 1 . 1 37 37 ILE HG13 H 1 1.441 0.006 . 2 . . 128 . A 37 ILE HG13 . 30834 1 341 . 1 . 1 37 37 ILE HG21 H 1 0.875 0.001 . 1 . . 305 . A 37 ILE HG21 . 30834 1 342 . 1 . 1 37 37 ILE HG22 H 1 0.875 0.001 . 1 . . 305 . A 37 ILE HG22 . 30834 1 343 . 1 . 1 37 37 ILE HG23 H 1 0.875 0.001 . 1 . . 305 . A 37 ILE HG23 . 30834 1 344 . 1 . 1 37 37 ILE HD11 H 1 0.860 0.004 . 1 . . 130 . A 37 ILE HD11 . 30834 1 345 . 1 . 1 37 37 ILE HD12 H 1 0.860 0.004 . 1 . . 130 . A 37 ILE HD12 . 30834 1 346 . 1 . 1 37 37 ILE HD13 H 1 0.860 0.004 . 1 . . 130 . A 37 ILE HD13 . 30834 1 347 . 1 . 1 37 37 ILE CA C 13 63.173 . . 1 . . 181 . A 37 ILE CA . 30834 1 348 . 1 . 1 37 37 ILE CB C 13 39.701 . . 1 . . 226 . A 37 ILE CB . 30834 1 349 . 1 . 1 37 37 ILE N N 15 123.968 0.0 . 1 . . 125 . A 37 ILE N . 30834 1 stop_ save_