################################### # 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 18632 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $Asp18NC007 _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 10 '2D 1H-15N HSQC/HMQC' 3 $Asp18 isotropic 18632 1 11 'Arom32HD (hbCBcgcdHD)' 3 $Asp18 isotropic 18632 1 12 'Arom33HE (hbCBcgcdceHE)' 3 $Asp18 isotropic 18632 1 13 '3D 1H-15N NOESY' 3 $Asp18 isotropic 18632 1 15 '2D 1H-13C HSQC/HMQC' 3 $Asp18 isotropic 18632 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 1 1 MET HA H 1 3.747 0.001 . 1 . . 1662 . . -11 MET HA . 18632 1 2 . 1 1 1 1 MET HG2 H 1 2.403 0.001 . 1 . . 1661 . . -11 MET HG2 . 18632 1 3 . 1 1 1 1 MET HG3 H 1 2.409 0.001 . 1 . . 1281 . . -11 MET HG3 . 18632 1 4 . 1 1 1 1 MET HE1 H 1 2.029 0.001 . 1 . . 1243 . . -11 MET HE1 . 18632 1 5 . 1 1 1 1 MET HE2 H 1 2.029 0.001 . 1 . . 1243 . . -11 MET HE2 . 18632 1 6 . 1 1 1 1 MET HE3 H 1 2.029 0.001 . 1 . . 1243 . . -11 MET HE3 . 18632 1 7 . 1 1 1 1 MET CA C 13 55.847 0.005 . 1 . . 1663 . . -11 MET CA . 18632 1 8 . 1 1 1 1 MET CG C 13 35.145 0.005 . 1 . . 1282 . . -11 MET CG . 18632 1 9 . 1 1 1 1 MET CE C 13 16.826 0.005 . 1 . . 1244 . . -11 MET CE . 18632 1 10 . 1 1 2 2 ARG HA H 1 4.329 0.001 . 1 . . 970 . . -10 ARG HA . 18632 1 11 . 1 1 2 2 ARG HB2 H 1 1.770 0.001 . 2 . . 972 . . -10 ARG HB2 . 18632 1 12 . 1 1 2 2 ARG HB3 H 1 1.843 0.001 . 2 . . 973 . . -10 ARG HB3 . 18632 1 13 . 1 1 2 2 ARG HG2 H 1 1.630 0.001 . 1 . . 975 . . -10 ARG HG2 . 18632 1 14 . 1 1 2 2 ARG HG3 H 1 1.630 0.001 . 1 . . 974 . . -10 ARG HG3 . 18632 1 15 . 1 1 2 2 ARG HD2 H 1 3.153 0.001 . 1 . . 976 . . -10 ARG HD2 . 18632 1 16 . 1 1 2 2 ARG HD3 H 1 3.153 0.001 . 1 . . 971 . . -10 ARG HD3 . 18632 1 17 . 1 1 2 2 ARG CA C 13 56.471 0.005 . 1 . . 969 . . -10 ARG CA . 18632 1 18 . 1 1 2 2 ARG CB C 13 30.855 0.005 . 1 . . 978 . . -10 ARG CB . 18632 1 19 . 1 1 2 2 ARG CG C 13 27.127 0.005 . 1 . . 979 . . -10 ARG CG . 18632 1 20 . 1 1 2 2 ARG CD C 13 43.328 0.005 . 1 . . 977 . . -10 ARG CD . 18632 1 21 . 1 1 7 7 HIS HA H 1 4.558 0.001 . 1 . . 1664 . . -5 HIS HA . 18632 1 22 . 1 1 7 7 HIS HB2 H 1 2.983 0.001 . 1 . . 1667 . . -5 HIS HB2 . 18632 1 23 . 1 1 7 7 HIS HB3 H 1 2.983 0.001 . 1 . . 1668 . . -5 HIS HB3 . 18632 1 24 . 1 1 7 7 HIS HE1 H 1 7.723 0.001 . 1 . . 1168 . . -5 HIS HE1 . 18632 1 25 . 1 1 7 7 HIS CA C 13 56.389 0.005 . 1 . . 1666 . . -5 HIS CA . 18632 1 26 . 1 1 7 7 HIS CE1 C 13 138.507 0.005 . 1 . . 1169 . . -5 HIS CE1 . 18632 1 27 . 1 1 10 10 HIS HB2 H 1 3.116 0.001 . 1 . . 1672 . . -2 HIS HB2 . 18632 1 28 . 1 1 10 10 HIS HB3 H 1 3.116 0.001 . 1 . . 1673 . . -2 HIS HB3 . 18632 1 29 . 1 1 10 10 HIS HE1 H 1 7.793 0.001 . 1 . . 1171 . . -2 HIS HE1 . 18632 1 30 . 1 1 10 10 HIS CB C 13 31.024 0.005 . 1 . . 1695 . . -2 HIS CB . 18632 1 31 . 1 1 10 10 HIS CE1 C 13 138.477 0.005 . 1 . . 1170 . . -2 HIS CE1 . 18632 1 32 . 1 1 11 11 GLY HA2 H 1 3.970 0.001 . 1 . . 1669 . . -1 GLY HA2 . 18632 1 33 . 1 1 11 11 GLY HA3 H 1 3.970 0.001 . 1 . . 1671 . . -1 GLY HA3 . 18632 1 34 . 1 1 11 11 GLY C C 13 174.091 0.005 . 1 . . 1716 . . -1 GLY C . 18632 1 35 . 1 1 11 11 GLY CA C 13 45.212 0.005 . 1 . . 1670 . . -1 GLY CA . 18632 1 36 . 1 1 12 12 SER H H 1 8.255 0.006 . 1 . . 1402 . . 0 SER H . 18632 1 37 . 1 1 12 12 SER HA H 1 4.502 0.001 . 1 . . 315 . . 0 SER HA . 18632 1 38 . 1 1 12 12 SER HB2 H 1 3.863 0.001 . 1 . . 317 . . 0 SER HB2 . 18632 1 39 . 1 1 12 12 SER HB3 H 1 3.863 0.001 . 1 . . 316 . . 0 SER HB3 . 18632 1 40 . 1 1 12 12 SER C C 13 174.432 0.005 . 1 . . 1715 . . 0 SER C . 18632 1 41 . 1 1 12 12 SER CA C 13 58.569 0.005 . 1 . . 1303 . . 0 SER CA . 18632 1 42 . 1 1 12 12 SER CB C 13 64.085 0.005 . 1 . . 1306 . . 0 SER CB . 18632 1 43 . 1 1 12 12 SER N N 15 115.957 0.029 . 1 . . 1403 . . 0 SER N . 18632 1 44 . 1 1 13 13 LYS H H 1 8.552 0.002 . 1 . . 190 . . 1 LYS H . 18632 1 45 . 1 1 13 13 LYS HA H 1 4.563 0.001 . 1 . . 318 . . 1 LYS HA . 18632 1 46 . 1 1 13 13 LYS HB2 H 1 1.742 0.001 . 2 . . 319 . . 1 LYS HB2 . 18632 1 47 . 1 1 13 13 LYS HB3 H 1 1.902 0.001 . 2 . . 320 . . 1 LYS HB3 . 18632 1 48 . 1 1 13 13 LYS HG2 H 1 1.523 0.001 . 2 . . 663 . . 1 LYS HG2 . 18632 1 49 . 1 1 13 13 LYS HG3 H 1 1.434 0.001 . 2 . . 662 . . 1 LYS HG3 . 18632 1 50 . 1 1 13 13 LYS HD2 H 1 1.640 0.001 . 2 . . 664 . . 1 LYS HD2 . 18632 1 51 . 1 1 13 13 LYS HD3 H 1 1.721 0.001 . 2 . . 665 . . 1 LYS HD3 . 18632 1 52 . 1 1 13 13 LYS HE2 H 1 2.914 0.001 . 2 . . 1180 . . 1 LYS HE2 . 18632 1 53 . 1 1 13 13 LYS HE3 H 1 2.976 0.001 . 2 . . 666 . . 1 LYS HE3 . 18632 1 54 . 1 1 13 13 LYS C C 13 175.388 0.005 . 1 . . 1717 . . 1 LYS C . 18632 1 55 . 1 1 13 13 LYS CA C 13 55.829 0.005 . 1 . . 1305 . . 1 LYS CA . 18632 1 56 . 1 1 13 13 LYS CB C 13 34.291 0.005 . 1 . . 1304 . . 1 LYS CB . 18632 1 57 . 1 1 13 13 LYS CG C 13 24.966 0.005 . 1 . . 667 . . 1 LYS CG . 18632 1 58 . 1 1 13 13 LYS CD C 13 29.613 0.005 . 1 . . 1100 . . 1 LYS CD . 18632 1 59 . 1 1 13 13 LYS CE C 13 42.110 0.005 . 1 . . 1101 . . 1 LYS CE . 18632 1 60 . 1 1 13 13 LYS N N 15 122.745 0.043 . 1 . . 191 . . 1 LYS N . 18632 1 61 . 1 1 14 14 THR H H 1 7.948 0.001 . 1 . . 210 . . 2 THR H . 18632 1 62 . 1 1 14 14 THR HA H 1 4.632 0.001 . 1 . . 321 . . 2 THR HA . 18632 1 63 . 1 1 14 14 THR HB H 1 3.860 0.001 . 1 . . 322 . . 2 THR HB . 18632 1 64 . 1 1 14 14 THR HG21 H 1 1.177 0.001 . 1 . . 717 . . 2 THR HG21 . 18632 1 65 . 1 1 14 14 THR HG22 H 1 1.177 0.001 . 1 . . 717 . . 2 THR HG22 . 18632 1 66 . 1 1 14 14 THR HG23 H 1 1.177 0.001 . 1 . . 717 . . 2 THR HG23 . 18632 1 67 . 1 1 14 14 THR C C 13 173.939 0.005 . 1 . . 1718 . . 2 THR C . 18632 1 68 . 1 1 14 14 THR CA C 13 60.976 0.005 . 1 . . 1307 . . 2 THR CA . 18632 1 69 . 1 1 14 14 THR CB C 13 70.806 0.005 . 1 . . 1308 . . 2 THR CB . 18632 1 70 . 1 1 14 14 THR CG2 C 13 22.322 0.005 . 1 . . 718 . . 2 THR CG2 . 18632 1 71 . 1 1 14 14 THR N N 15 116.520 0.007 . 1 . . 211 . . 2 THR N . 18632 1 72 . 1 1 15 15 LEU H H 1 8.159 0.001 . 1 . . 169 . . 3 LEU H . 18632 1 73 . 1 1 15 15 LEU HA H 1 4.184 0.001 . 1 . . 865 . . 3 LEU HA . 18632 1 74 . 1 1 15 15 LEU HB2 H 1 0.283 0.001 . 2 . . 867 . . 3 LEU HB2 . 18632 1 75 . 1 1 15 15 LEU HB3 H 1 1.255 0.001 . 2 . . 866 . . 3 LEU HB3 . 18632 1 76 . 1 1 15 15 LEU HG H 1 1.405 0.001 . 1 . . 868 . . 3 LEU HG . 18632 1 77 . 1 1 15 15 LEU HD11 H 1 0.431 0.001 . 2 . . 869 . . 3 LEU HD11 . 18632 1 78 . 1 1 15 15 LEU HD12 H 1 0.431 0.001 . 2 . . 869 . . 3 LEU HD12 . 18632 1 79 . 1 1 15 15 LEU HD13 H 1 0.431 0.001 . 2 . . 869 . . 3 LEU HD13 . 18632 1 80 . 1 1 15 15 LEU HD21 H 1 0.217 0.001 . 2 . . 870 . . 3 LEU HD21 . 18632 1 81 . 1 1 15 15 LEU HD22 H 1 0.217 0.001 . 2 . . 870 . . 3 LEU HD22 . 18632 1 82 . 1 1 15 15 LEU HD23 H 1 0.217 0.001 . 2 . . 870 . . 3 LEU HD23 . 18632 1 83 . 1 1 15 15 LEU C C 13 173.826 0.005 . 1 . . 1721 . . 3 LEU C . 18632 1 84 . 1 1 15 15 LEU CA C 13 52.056 0.005 . 1 . . 1310 . . 3 LEU CA . 18632 1 85 . 1 1 15 15 LEU CB C 13 43.565 0.005 . 1 . . 1309 . . 3 LEU CB . 18632 1 86 . 1 1 15 15 LEU CG C 13 25.714 0.005 . 1 . . 871 . . 3 LEU CG . 18632 1 87 . 1 1 15 15 LEU CD1 C 13 25.949 0.005 . 2 . . 873 . . 3 LEU CD1 . 18632 1 88 . 1 1 15 15 LEU CD2 C 13 25.524 0.005 . 2 . . 872 . . 3 LEU CD2 . 18632 1 89 . 1 1 15 15 LEU N N 15 127.961 0.02 . 1 . . 170 . . 3 LEU N . 18632 1 90 . 1 1 16 16 PRO HA H 1 4.407 0.001 . 1 . . 323 . . 4 PRO HA . 18632 1 91 . 1 1 16 16 PRO HB2 H 1 2.611 0.001 . 2 . . 325 . . 4 PRO HB2 . 18632 1 92 . 1 1 16 16 PRO HB3 H 1 1.955 0.001 . 2 . . 324 . . 4 PRO HB3 . 18632 1 93 . 1 1 16 16 PRO HG2 H 1 2.423 0.001 . 2 . . 913 . . 4 PRO HG2 . 18632 1 94 . 1 1 16 16 PRO HG3 H 1 2.180 0.001 . 2 . . 912 . . 4 PRO HG3 . 18632 1 95 . 1 1 16 16 PRO HD2 H 1 4.386 0.001 . 2 . . 917 . . 4 PRO HD2 . 18632 1 96 . 1 1 16 16 PRO HD3 H 1 3.576 0.001 . 2 . . 915 . . 4 PRO HD3 . 18632 1 97 . 1 1 16 16 PRO C C 13 176.428 0.005 . 1 . . 1719 . . 4 PRO C . 18632 1 98 . 1 1 16 16 PRO CA C 13 63.533 0.005 . 1 . . 1311 . . 4 PRO CA . 18632 1 99 . 1 1 16 16 PRO CB C 13 32.891 0.005 . 1 . . 1314 . . 4 PRO CB . 18632 1 100 . 1 1 16 16 PRO CG C 13 27.938 0.005 . 1 . . 914 . . 4 PRO CG . 18632 1 101 . 1 1 16 16 PRO CD C 13 51.810 0.005 . 1 . . 916 . . 4 PRO CD . 18632 1 102 . 1 1 17 17 ASP H H 1 8.468 0.001 . 1 . . 104 . . 5 ASP H . 18632 1 103 . 1 1 17 17 ASP HA H 1 4.209 0.001 . 1 . . 326 . . 5 ASP HA . 18632 1 104 . 1 1 17 17 ASP HB2 H 1 2.692 0.001 . 1 . . 328 . . 5 ASP HB2 . 18632 1 105 . 1 1 17 17 ASP HB3 H 1 2.692 0.001 . 1 . . 327 . . 5 ASP HB3 . 18632 1 106 . 1 1 17 17 ASP C C 13 178.335 0.005 . 1 . . 1720 . . 5 ASP C . 18632 1 107 . 1 1 17 17 ASP CA C 13 57.224 0.005 . 1 . . 1313 . . 5 ASP CA . 18632 1 108 . 1 1 17 17 ASP CB C 13 40.749 0.005 . 1 . . 1312 . . 5 ASP CB . 18632 1 109 . 1 1 17 17 ASP N N 15 122.208 0.023 . 1 . . 105 . . 5 ASP N . 18632 1 110 . 1 1 18 18 LYS H H 1 8.029 0.002 . 1 . . 94 . . 6 LYS H . 18632 1 111 . 1 1 18 18 LYS HA H 1 4.216 0.001 . 1 . . 329 . . 6 LYS HA . 18632 1 112 . 1 1 18 18 LYS HB2 H 1 1.684 0.001 . 1 . . 331 . . 6 LYS HB2 . 18632 1 113 . 1 1 18 18 LYS HB3 H 1 1.684 0.001 . 1 . . 330 . . 6 LYS HB3 . 18632 1 114 . 1 1 18 18 LYS HG2 H 1 0.051 0.001 . 2 . . 669 . . 6 LYS HG2 . 18632 1 115 . 1 1 18 18 LYS HG3 H 1 0.936 0.001 . 2 . . 670 . . 6 LYS HG3 . 18632 1 116 . 1 1 18 18 LYS HD2 H 1 1.398 0.001 . 2 . . 671 . . 6 LYS HD2 . 18632 1 117 . 1 1 18 18 LYS HD3 H 1 1.457 0.001 . 2 . . 672 . . 6 LYS HD3 . 18632 1 118 . 1 1 18 18 LYS HE2 H 1 2.858 0.001 . 1 . . 675 . . 6 LYS HE2 . 18632 1 119 . 1 1 18 18 LYS HE3 H 1 2.858 0.001 . 1 . . 676 . . 6 LYS HE3 . 18632 1 120 . 1 1 18 18 LYS C C 13 176.052 0.005 . 1 . . 1697 . . 6 LYS C . 18632 1 121 . 1 1 18 18 LYS CA C 13 57.459 0.005 . 1 . . 1316 . . 6 LYS CA . 18632 1 122 . 1 1 18 18 LYS CB C 13 31.219 0.005 . 1 . . 1315 . . 6 LYS CB . 18632 1 123 . 1 1 18 18 LYS CG C 13 23.087 0.005 . 1 . . 677 . . 6 LYS CG . 18632 1 124 . 1 1 18 18 LYS CD C 13 29.921 0.005 . 1 . . 673 . . 6 LYS CD . 18632 1 125 . 1 1 18 18 LYS CE C 13 41.867 0.005 . 1 . . 674 . . 6 LYS CE . 18632 1 126 . 1 1 18 18 LYS N N 15 115.743 0.01 . 1 . . 95 . . 6 LYS N . 18632 1 127 . 1 1 19 19 PHE H H 1 7.745 0.001 . 1 . . 192 . . 7 PHE H . 18632 1 128 . 1 1 19 19 PHE HA H 1 4.184 0.001 . 1 . . 334 . . 7 PHE HA . 18632 1 129 . 1 1 19 19 PHE HB2 H 1 2.241 0.001 . 2 . . 332 . . 7 PHE HB2 . 18632 1 130 . 1 1 19 19 PHE HB3 H 1 2.680 0.001 . 2 . . 333 . . 7 PHE HB3 . 18632 1 131 . 1 1 19 19 PHE HD1 H 1 6.757 0.001 . 3 . . 988 . . 7 PHE HD1 . 18632 1 132 . 1 1 19 19 PHE HD2 H 1 6.757 0.001 . 3 . . 988 . . 7 PHE HD2 . 18632 1 133 . 1 1 19 19 PHE C C 13 172.661 0.005 . 1 . . 1722 . . 7 PHE C . 18632 1 134 . 1 1 19 19 PHE CA C 13 59.754 0.005 . 1 . . 1318 . . 7 PHE CA . 18632 1 135 . 1 1 19 19 PHE CB C 13 39.607 0.005 . 1 . . 1317 . . 7 PHE CB . 18632 1 136 . 1 1 19 19 PHE CD1 C 13 130.956 0.005 . 3 . . 1032 . . 7 PHE CD1 . 18632 1 137 . 1 1 19 19 PHE CD2 C 13 130.956 0.005 . 3 . . 1032 . . 7 PHE CD2 . 18632 1 138 . 1 1 19 19 PHE N N 15 117.906 0.006 . 1 . . 193 . . 7 PHE N . 18632 1 139 . 1 1 20 20 LEU H H 1 7.263 0.001 . 1 . . 78 . . 8 LEU H . 18632 1 140 . 1 1 20 20 LEU HA H 1 4.396 0.001 . 1 . . 335 . . 8 LEU HA . 18632 1 141 . 1 1 20 20 LEU HB2 H 1 2.045 0.001 . 2 . . 337 . . 8 LEU HB2 . 18632 1 142 . 1 1 20 20 LEU HB3 H 1 1.361 0.001 . 2 . . 336 . . 8 LEU HB3 . 18632 1 143 . 1 1 20 20 LEU HG H 1 1.649 0.001 . 1 . . 668 . . 8 LEU HG . 18632 1 144 . 1 1 20 20 LEU HD11 H 1 0.694 0.001 . 2 . . 720 . . 8 LEU HD11 . 18632 1 145 . 1 1 20 20 LEU HD12 H 1 0.694 0.001 . 2 . . 720 . . 8 LEU HD12 . 18632 1 146 . 1 1 20 20 LEU HD13 H 1 0.694 0.001 . 2 . . 720 . . 8 LEU HD13 . 18632 1 147 . 1 1 20 20 LEU HD21 H 1 1.039 0.001 . 2 . . 719 . . 8 LEU HD21 . 18632 1 148 . 1 1 20 20 LEU HD22 H 1 1.039 0.001 . 2 . . 719 . . 8 LEU HD22 . 18632 1 149 . 1 1 20 20 LEU HD23 H 1 1.039 0.001 . 2 . . 719 . . 8 LEU HD23 . 18632 1 150 . 1 1 20 20 LEU C C 13 177.121 0.005 . 1 . . 1723 . . 8 LEU C . 18632 1 151 . 1 1 20 20 LEU CA C 13 54.384 0.005 . 1 . . 1320 . . 8 LEU CA . 18632 1 152 . 1 1 20 20 LEU CB C 13 41.986 0.005 . 1 . . 1319 . . 8 LEU CB . 18632 1 153 . 1 1 20 20 LEU CG C 13 26.537 0.005 . 1 . . 721 . . 8 LEU CG . 18632 1 154 . 1 1 20 20 LEU CD1 C 13 23.594 0.005 . 2 . . 722 . . 8 LEU CD1 . 18632 1 155 . 1 1 20 20 LEU CD2 C 13 26.257 0.005 . 2 . . 723 . . 8 LEU CD2 . 18632 1 156 . 1 1 20 20 LEU N N 15 114.037 0.022 . 1 . . 79 . . 8 LEU N . 18632 1 157 . 1 1 21 21 GLY H H 1 8.753 0.001 . 1 . . 130 . . 9 GLY H . 18632 1 158 . 1 1 21 21 GLY HA2 H 1 3.705 0.001 . 2 . . 338 . . 9 GLY HA2 . 18632 1 159 . 1 1 21 21 GLY HA3 H 1 4.036 0.001 . 2 . . 339 . . 9 GLY HA3 . 18632 1 160 . 1 1 21 21 GLY C C 13 171.206 0.005 . 1 . . 1724 . . 9 GLY C . 18632 1 161 . 1 1 21 21 GLY CA C 13 44.459 0.005 . 1 . . 1321 . . 9 GLY CA . 18632 1 162 . 1 1 21 21 GLY N N 15 109.148 0.015 . 1 . . 1620 . . 9 GLY N . 18632 1 163 . 1 1 22 22 THR H H 1 8.309 0.004 . 1 . . 141 . . 10 THR H . 18632 1 164 . 1 1 22 22 THR HA H 1 4.939 0.001 . 1 . . 340 . . 10 THR HA . 18632 1 165 . 1 1 22 22 THR HB H 1 3.763 0.001 . 1 . . 341 . . 10 THR HB . 18632 1 166 . 1 1 22 22 THR HG21 H 1 1.001 0.001 . 1 . . 678 . . 10 THR HG21 . 18632 1 167 . 1 1 22 22 THR HG22 H 1 1.001 0.001 . 1 . . 678 . . 10 THR HG22 . 18632 1 168 . 1 1 22 22 THR HG23 H 1 1.001 0.001 . 1 . . 678 . . 10 THR HG23 . 18632 1 169 . 1 1 22 22 THR C C 13 172.936 0.005 . 1 . . 1725 . . 10 THR C . 18632 1 170 . 1 1 22 22 THR CA C 13 61.843 0.005 . 1 . . 1323 . . 10 THR CA . 18632 1 171 . 1 1 22 22 THR CB C 13 70.556 0.005 . 1 . . 1322 . . 10 THR CB . 18632 1 172 . 1 1 22 22 THR CG2 C 13 22.379 0.005 . 1 . . 679 . . 10 THR CG2 . 18632 1 173 . 1 1 22 22 THR N N 15 117.563 0.014 . 1 . . 142 . . 10 THR N . 18632 1 174 . 1 1 23 23 PHE H H 1 9.702 0.002 . 1 . . 92 . . 11 PHE H . 18632 1 175 . 1 1 23 23 PHE HA H 1 5.285 0.001 . 1 . . 342 . . 11 PHE HA . 18632 1 176 . 1 1 23 23 PHE HB2 H 1 2.752 0.001 . 2 . . 344 . . 11 PHE HB2 . 18632 1 177 . 1 1 23 23 PHE HB3 H 1 2.982 0.001 . 2 . . 343 . . 11 PHE HB3 . 18632 1 178 . 1 1 23 23 PHE HD1 H 1 7.111 0.001 . 3 . . 1166 . . 11 PHE HD1 . 18632 1 179 . 1 1 23 23 PHE HD2 H 1 7.111 0.001 . 3 . . 1166 . . 11 PHE HD2 . 18632 1 180 . 1 1 23 23 PHE C C 13 174.168 0.005 . 1 . . 1726 . . 11 PHE C . 18632 1 181 . 1 1 23 23 PHE CA C 13 55.636 0.005 . 1 . . 1324 . . 11 PHE CA . 18632 1 182 . 1 1 23 23 PHE CB C 13 42.650 0.005 . 1 . . 1325 . . 11 PHE CB . 18632 1 183 . 1 1 23 23 PHE CD1 C 13 133.219 0.005 . 3 . . 1167 . . 11 PHE CD1 . 18632 1 184 . 1 1 23 23 PHE CD2 C 13 133.219 0.005 . 3 . . 1167 . . 11 PHE CD2 . 18632 1 185 . 1 1 23 23 PHE N N 15 124.040 0.022 . 1 . . 93 . . 11 PHE N . 18632 1 186 . 1 1 24 24 LYS H H 1 9.130 0.003 . 1 . . 246 . . 12 LYS H . 18632 1 187 . 1 1 24 24 LYS HA H 1 5.295 0.001 . 1 . . 345 . . 12 LYS HA . 18632 1 188 . 1 1 24 24 LYS HB2 H 1 2.013 0.001 . 2 . . 346 . . 12 LYS HB2 . 18632 1 189 . 1 1 24 24 LYS HB3 H 1 1.617 0.001 . 2 . . 880 . . 12 LYS HB3 . 18632 1 190 . 1 1 24 24 LYS HG2 H 1 1.446 0.001 . 2 . . 918 . . 12 LYS HG2 . 18632 1 191 . 1 1 24 24 LYS HG3 H 1 1.538 0.001 . 2 . . 919 . . 12 LYS HG3 . 18632 1 192 . 1 1 24 24 LYS HD2 H 1 1.658 0.001 . 1 . . 923 . . 12 LYS HD2 . 18632 1 193 . 1 1 24 24 LYS HD3 H 1 1.658 0.001 . 1 . . 924 . . 12 LYS HD3 . 18632 1 194 . 1 1 24 24 LYS HE2 H 1 2.986 0.001 . 1 . . 921 . . 12 LYS HE2 . 18632 1 195 . 1 1 24 24 LYS HE3 H 1 2.986 0.001 . 1 . . 922 . . 12 LYS HE3 . 18632 1 196 . 1 1 24 24 LYS C C 13 176.165 0.005 . 1 . . 1727 . . 12 LYS C . 18632 1 197 . 1 1 24 24 LYS CA C 13 55.929 0.005 . 1 . . 1327 . . 12 LYS CA . 18632 1 198 . 1 1 24 24 LYS CB C 13 36.507 0.005 . 1 . . 1326 . . 12 LYS CB . 18632 1 199 . 1 1 24 24 LYS CG C 13 24.938 0.005 . 1 . . 920 . . 12 LYS CG . 18632 1 200 . 1 1 24 24 LYS CD C 13 29.609 0.005 . 1 . . 925 . . 12 LYS CD . 18632 1 201 . 1 1 24 24 LYS CE C 13 42.105 0.005 . 1 . . 926 . . 12 LYS CE . 18632 1 202 . 1 1 24 24 LYS N N 15 126.441 0.014 . 1 . . 247 . . 12 LYS N . 18632 1 203 . 1 1 25 25 LEU H H 1 9.371 0.001 . 1 . . 129 . . 13 LEU H . 18632 1 204 . 1 1 25 25 LEU HA H 1 3.767 0.012 . 1 . . 347 . . 13 LEU HA . 18632 1 205 . 1 1 25 25 LEU HB2 H 1 1.576 0.001 . 2 . . 348 . . 13 LEU HB2 . 18632 1 206 . 1 1 25 25 LEU HB3 H 1 2.081 0.001 . 2 . . 690 . . 13 LEU HB3 . 18632 1 207 . 1 1 25 25 LEU HG H 1 1.237 0.001 . 1 . . 681 . . 13 LEU HG . 18632 1 208 . 1 1 25 25 LEU HD11 H 1 0.256 0.001 . 2 . . 682 . . 13 LEU HD11 . 18632 1 209 . 1 1 25 25 LEU HD12 H 1 0.256 0.001 . 2 . . 682 . . 13 LEU HD12 . 18632 1 210 . 1 1 25 25 LEU HD13 H 1 0.256 0.001 . 2 . . 682 . . 13 LEU HD13 . 18632 1 211 . 1 1 25 25 LEU HD21 H 1 0.923 0.001 . 2 . . 680 . . 13 LEU HD21 . 18632 1 212 . 1 1 25 25 LEU HD22 H 1 0.923 0.001 . 2 . . 680 . . 13 LEU HD22 . 18632 1 213 . 1 1 25 25 LEU HD23 H 1 0.923 0.001 . 2 . . 680 . . 13 LEU HD23 . 18632 1 214 . 1 1 25 25 LEU C C 13 175.665 0.005 . 1 . . 1728 . . 13 LEU C . 18632 1 215 . 1 1 25 25 LEU CA C 13 57.596 0.005 . 1 . . 1328 . . 13 LEU CA . 18632 1 216 . 1 1 25 25 LEU CB C 13 43.029 0.005 . 1 . . 1329 . . 13 LEU CB . 18632 1 217 . 1 1 25 25 LEU CG C 13 26.519 0.005 . 1 . . 691 . . 13 LEU CG . 18632 1 218 . 1 1 25 25 LEU CD1 C 13 21.433 0.005 . 2 . . 684 . . 13 LEU CD1 . 18632 1 219 . 1 1 25 25 LEU CD2 C 13 26.800 0.005 . 2 . . 683 . . 13 LEU CD2 . 18632 1 220 . 1 1 25 25 LEU N N 15 131.406 0.011 . 1 . . 1633 . . 13 LEU N . 18632 1 221 . 1 1 26 26 GLU H H 1 9.458 0.001 . 1 . . 1330 . . 14 GLU H . 18632 1 222 . 1 1 26 26 GLU HA H 1 4.654 0.001 . 1 . . 349 . . 14 GLU HA . 18632 1 223 . 1 1 26 26 GLU HB2 H 1 2.254 0.001 . 2 . . 351 . . 14 GLU HB2 . 18632 1 224 . 1 1 26 26 GLU HB3 H 1 2.062 0.001 . 2 . . 350 . . 14 GLU HB3 . 18632 1 225 . 1 1 26 26 GLU HG2 H 1 2.492 0.001 . 2 . . 685 . . 14 GLU HG2 . 18632 1 226 . 1 1 26 26 GLU HG3 H 1 2.135 0.001 . 2 . . 687 . . 14 GLU HG3 . 18632 1 227 . 1 1 26 26 GLU C C 13 175.037 0.005 . 1 . . 1729 . . 14 GLU C . 18632 1 228 . 1 1 26 26 GLU CA C 13 57.227 0.005 . 1 . . 1333 . . 14 GLU CA . 18632 1 229 . 1 1 26 26 GLU CB C 13 34.565 0.005 . 1 . . 1332 . . 14 GLU CB . 18632 1 230 . 1 1 26 26 GLU CG C 13 37.601 0.005 . 1 . . 686 . . 14 GLU CG . 18632 1 231 . 1 1 26 26 GLU N N 15 126.454 0.01 . 1 . . 1331 . . 14 GLU N . 18632 1 232 . 1 1 27 27 ARG H H 1 7.651 0.001 . 1 . . 43 . . 15 ARG H . 18632 1 233 . 1 1 27 27 ARG HA H 1 4.835 0.001 . 1 . . 352 . . 15 ARG HA . 18632 1 234 . 1 1 27 27 ARG HB2 H 1 1.896 0.001 . 2 . . 353 . . 15 ARG HB2 . 18632 1 235 . 1 1 27 27 ARG HB3 H 1 1.962 0.001 . 2 . . 354 . . 15 ARG HB3 . 18632 1 236 . 1 1 27 27 ARG HG2 H 1 1.142 0.001 . 2 . . 694 . . 15 ARG HG2 . 18632 1 237 . 1 1 27 27 ARG HG3 H 1 1.318 0.001 . 2 . . 695 . . 15 ARG HG3 . 18632 1 238 . 1 1 27 27 ARG HD2 H 1 2.929 0.001 . 1 . . 692 . . 15 ARG HD2 . 18632 1 239 . 1 1 27 27 ARG HD3 H 1 2.929 0.001 . 1 . . 693 . . 15 ARG HD3 . 18632 1 240 . 1 1 27 27 ARG C C 13 172.559 0.005 . 1 . . 1730 . . 15 ARG C . 18632 1 241 . 1 1 27 27 ARG CA C 13 54.921 0.005 . 1 . . 1334 . . 15 ARG CA . 18632 1 242 . 1 1 27 27 ARG CB C 13 31.996 0.005 . 1 . . 1335 . . 15 ARG CB . 18632 1 243 . 1 1 27 27 ARG CG C 13 26.313 0.005 . 1 . . 696 . . 15 ARG CG . 18632 1 244 . 1 1 27 27 ARG CD C 13 42.726 0.005 . 1 . . 1074 . . 15 ARG CD . 18632 1 245 . 1 1 27 27 ARG N N 15 112.107 0.019 . 1 . . 44 . . 15 ARG N . 18632 1 246 . 1 1 28 28 ASP H H 1 8.521 0.002 . 1 . . 1337 . . 16 ASP H . 18632 1 247 . 1 1 28 28 ASP HA H 1 5.146 0.001 . 1 . . 355 . . 16 ASP HA . 18632 1 248 . 1 1 28 28 ASP HB2 H 1 2.719 0.001 . 1 . . 357 . . 16 ASP HB2 . 18632 1 249 . 1 1 28 28 ASP HB3 H 1 2.719 0.001 . 1 . . 356 . . 16 ASP HB3 . 18632 1 250 . 1 1 28 28 ASP C C 13 174.282 0.005 . 1 . . 1731 . . 16 ASP C . 18632 1 251 . 1 1 28 28 ASP CA C 13 53.157 0.005 . 1 . . 1338 . . 16 ASP CA . 18632 1 252 . 1 1 28 28 ASP CB C 13 45.569 0.005 . 1 . . 1339 . . 16 ASP CB . 18632 1 253 . 1 1 28 28 ASP N N 15 116.271 0.023 . 1 . . 1336 . . 16 ASP N . 18632 1 254 . 1 1 29 29 GLU H H 1 8.647 0.002 . 1 . . 51 . . 17 GLU H . 18632 1 255 . 1 1 29 29 GLU HA H 1 4.817 0.001 . 1 . . 1654 . . 17 GLU HA . 18632 1 256 . 1 1 29 29 GLU HB2 H 1 2.084 0.001 . 1 . . 1651 . . 17 GLU HB2 . 18632 1 257 . 1 1 29 29 GLU HB3 H 1 2.084 0.001 . 1 . . 1650 . . 17 GLU HB3 . 18632 1 258 . 1 1 29 29 GLU HG2 H 1 2.188 0.001 . 2 . . 1652 . . 17 GLU HG2 . 18632 1 259 . 1 1 29 29 GLU HG3 H 1 2.389 0.001 . 2 . . 907 . . 17 GLU HG3 . 18632 1 260 . 1 1 29 29 GLU C C 13 176.994 0.005 . 1 . . 1732 . . 17 GLU C . 18632 1 261 . 1 1 29 29 GLU CA C 13 55.724 0.005 . 1 . . 1342 . . 17 GLU CA . 18632 1 262 . 1 1 29 29 GLU CB C 13 33.108 0.005 . 1 . . 1341 . . 17 GLU CB . 18632 1 263 . 1 1 29 29 GLU CG C 13 36.617 0.005 . 1 . . 908 . . 17 GLU CG . 18632 1 264 . 1 1 29 29 GLU N N 15 115.737 0.007 . 1 . . 1340 . . 17 GLU N . 18632 1 265 . 1 1 30 30 ASN HA H 1 4.829 0.001 . 1 . . 909 . . 18 ASN HA . 18632 1 266 . 1 1 30 30 ASN HB2 H 1 3.932 0.001 . 2 . . 911 . . 18 ASN HB2 . 18632 1 267 . 1 1 30 30 ASN HB3 H 1 2.717 0.002 . 2 . . 910 . . 18 ASN HB3 . 18632 1 268 . 1 1 30 30 ASN HD21 H 1 8.057 0.004 . 1 . . 1058 . . 18 ASN HD21 . 18632 1 269 . 1 1 30 30 ASN HD22 H 1 7.004 0.002 . 1 . . 3 . . 18 ASN HD22 . 18632 1 270 . 1 1 30 30 ASN C C 13 175.817 0.005 . 1 . . 1734 . . 18 ASN C . 18632 1 271 . 1 1 30 30 ASN CA C 13 54.434 0.005 . 1 . . 1549 . . 18 ASN CA . 18632 1 272 . 1 1 30 30 ASN CB C 13 40.439 0.005 . 1 . . 1550 . . 18 ASN CB . 18632 1 273 . 1 1 30 30 ASN ND2 N 15 111.697 0.033 . 1 . . 4 . . 18 ASN ND2 . 18632 1 274 . 1 1 31 31 PHE H H 1 8.814 0.001 . 1 . . 244 . . 19 PHE H . 18632 1 275 . 1 1 31 31 PHE HA H 1 4.818 0.001 . 1 . . 358 . . 19 PHE HA . 18632 1 276 . 1 1 31 31 PHE HB2 H 1 2.881 0.001 . 2 . . 359 . . 19 PHE HB2 . 18632 1 277 . 1 1 31 31 PHE HB3 H 1 2.854 0.001 . 2 . . 1658 . . 19 PHE HB3 . 18632 1 278 . 1 1 31 31 PHE HD1 H 1 7.414 0.001 . 3 . . 1030 . . 19 PHE HD1 . 18632 1 279 . 1 1 31 31 PHE HD2 H 1 7.414 0.001 . 3 . . 1030 . . 19 PHE HD2 . 18632 1 280 . 1 1 31 31 PHE HE1 H 1 6.943 0.003 . 3 . . 1158 . . 19 PHE HE1 . 18632 1 281 . 1 1 31 31 PHE HE2 H 1 6.943 0.003 . 3 . . 1158 . . 19 PHE HE2 . 18632 1 282 . 1 1 31 31 PHE HZ H 1 6.727 0.003 . 1 . . 1157 . . 19 PHE HZ . 18632 1 283 . 1 1 31 31 PHE C C 13 177.881 0.005 . 1 . . 1733 . . 19 PHE C . 18632 1 284 . 1 1 31 31 PHE CB C 13 39.961 0.005 . 1 . . 1551 . . 19 PHE CB . 18632 1 285 . 1 1 31 31 PHE CD1 C 13 131.307 0.005 . 3 . . 1031 . . 19 PHE CD1 . 18632 1 286 . 1 1 31 31 PHE CD2 C 13 131.307 0.005 . 3 . . 1031 . . 19 PHE CD2 . 18632 1 287 . 1 1 31 31 PHE CE1 C 13 130.799 0.005 . 3 . . 1159 . . 19 PHE CE1 . 18632 1 288 . 1 1 31 31 PHE CE2 C 13 130.799 0.005 . 3 . . 1159 . . 19 PHE CE2 . 18632 1 289 . 1 1 31 31 PHE CZ C 13 127.868 0.005 . 1 . . 1156 . . 19 PHE CZ . 18632 1 290 . 1 1 31 31 PHE N N 15 120.872 0.013 . 1 . . 245 . . 19 PHE N . 18632 1 291 . 1 1 32 32 ASP H H 1 8.770 0.001 . 1 . . 1608 . . 20 ASP H . 18632 1 292 . 1 1 32 32 ASP HA H 1 4.034 0.001 . 1 . . 360 . . 20 ASP HA . 18632 1 293 . 1 1 32 32 ASP HB2 H 1 2.603 0.001 . 1 . . 361 . . 20 ASP HB2 . 18632 1 294 . 1 1 32 32 ASP HB3 H 1 2.603 0.001 . 1 . . 362 . . 20 ASP HB3 . 18632 1 295 . 1 1 32 32 ASP C C 13 177.874 0.005 . 1 . . 292 . . 20 ASP C . 18632 1 296 . 1 1 32 32 ASP CA C 13 58.598 0.005 . 1 . . 1703 . . 20 ASP CA . 18632 1 297 . 1 1 32 32 ASP CB C 13 42.478 0.005 . 1 . . 1704 . . 20 ASP CB . 18632 1 298 . 1 1 32 32 ASP N N 15 118.291 0.009 . 1 . . 1609 . . 20 ASP N . 18632 1 299 . 1 1 33 33 GLU H H 1 8.351 0.002 . 1 . . 1616 . . 21 GLU H . 18632 1 300 . 1 1 33 33 GLU HA H 1 3.804 0.001 . 1 . . 363 . . 21 GLU HA . 18632 1 301 . 1 1 33 33 GLU HB2 H 1 2.027 0.001 . 2 . . 365 . . 21 GLU HB2 . 18632 1 302 . 1 1 33 33 GLU HB3 H 1 1.945 0.001 . 2 . . 364 . . 21 GLU HB3 . 18632 1 303 . 1 1 33 33 GLU HG2 H 1 2.508 0.001 . 2 . . 698 . . 21 GLU HG2 . 18632 1 304 . 1 1 33 33 GLU HG3 H 1 2.405 0.001 . 2 . . 697 . . 21 GLU HG3 . 18632 1 305 . 1 1 33 33 GLU C C 13 180.219 0.005 . 1 . . 1701 . . 21 GLU C . 18632 1 306 . 1 1 33 33 GLU CA C 13 60.013 0.005 . 1 . . 1344 . . 21 GLU CA . 18632 1 307 . 1 1 33 33 GLU CB C 13 28.228 0.005 . 1 . . 1343 . . 21 GLU CB . 18632 1 308 . 1 1 33 33 GLU CG C 13 37.249 0.005 . 1 . . 699 . . 21 GLU CG . 18632 1 309 . 1 1 33 33 GLU N N 15 116.335 0.007 . 1 . . 110 . . 21 GLU N . 18632 1 310 . 1 1 34 34 TYR H H 1 7.742 0.001 . 1 . . 23 . . 22 TYR H . 18632 1 311 . 1 1 34 34 TYR HA H 1 3.978 0.001 . 1 . . 369 . . 22 TYR HA . 18632 1 312 . 1 1 34 34 TYR HB2 H 1 3.244 0.001 . 2 . . 700 . . 22 TYR HB2 . 18632 1 313 . 1 1 34 34 TYR HB3 H 1 2.880 0.001 . 2 . . 370 . . 22 TYR HB3 . 18632 1 314 . 1 1 34 34 TYR HD1 H 1 7.420 0.001 . 3 . . 1634 . . 22 TYR HD1 . 18632 1 315 . 1 1 34 34 TYR HD2 H 1 7.420 0.001 . 3 . . 1634 . . 22 TYR HD2 . 18632 1 316 . 1 1 34 34 TYR C C 13 175.792 0.005 . 1 . . 1702 . . 22 TYR C . 18632 1 317 . 1 1 34 34 TYR CA C 13 62.024 0.005 . 1 . . 1346 . . 22 TYR CA . 18632 1 318 . 1 1 34 34 TYR CB C 13 38.956 0.005 . 1 . . 1345 . . 22 TYR CB . 18632 1 319 . 1 1 34 34 TYR CD1 C 13 131.299 0.005 . 3 . . 1635 . . 22 TYR CD1 . 18632 1 320 . 1 1 34 34 TYR CD2 C 13 131.299 0.005 . 3 . . 1635 . . 22 TYR CD2 . 18632 1 321 . 1 1 34 34 TYR N N 15 123.050 0.015 . 1 . . 24 . . 22 TYR N . 18632 1 322 . 1 1 35 35 LEU H H 1 8.414 0.002 . 1 . . 1630 . . 23 LEU H . 18632 1 323 . 1 1 35 35 LEU HA H 1 3.576 0.001 . 1 . . 307 . . 23 LEU HA . 18632 1 324 . 1 1 35 35 LEU HB2 H 1 0.963 0.001 . 2 . . 368 . . 23 LEU HB2 . 18632 1 325 . 1 1 35 35 LEU HB3 H 1 1.849 0.001 . 2 . . 1240 . . 23 LEU HB3 . 18632 1 326 . 1 1 35 35 LEU HG H 1 1.171 0.001 . 1 . . 655 . . 23 LEU HG . 18632 1 327 . 1 1 35 35 LEU HD11 H 1 0.132 0.002 . 2 . . 657 . . 23 LEU HD11 . 18632 1 328 . 1 1 35 35 LEU HD12 H 1 0.132 0.002 . 2 . . 657 . . 23 LEU HD12 . 18632 1 329 . 1 1 35 35 LEU HD13 H 1 0.132 0.002 . 2 . . 657 . . 23 LEU HD13 . 18632 1 330 . 1 1 35 35 LEU HD21 H 1 0.441 0.001 . 2 . . 653 . . 23 LEU HD21 . 18632 1 331 . 1 1 35 35 LEU HD22 H 1 0.441 0.001 . 2 . . 653 . . 23 LEU HD22 . 18632 1 332 . 1 1 35 35 LEU HD23 H 1 0.441 0.001 . 2 . . 653 . . 23 LEU HD23 . 18632 1 333 . 1 1 35 35 LEU C C 13 179.531 0.005 . 1 . . 1735 . . 23 LEU C . 18632 1 334 . 1 1 35 35 LEU CA C 13 57.492 0.005 . 1 . . 1348 . . 23 LEU CA . 18632 1 335 . 1 1 35 35 LEU CB C 13 42.057 0.005 . 1 . . 1347 . . 23 LEU CB . 18632 1 336 . 1 1 35 35 LEU CG C 13 26.213 0.005 . 1 . . 654 . . 23 LEU CG . 18632 1 337 . 1 1 35 35 LEU CD1 C 13 26.235 0.005 . 2 . . 656 . . 23 LEU CD1 . 18632 1 338 . 1 1 35 35 LEU CD2 C 13 22.287 0.005 . 2 . . 652 . . 23 LEU CD2 . 18632 1 339 . 1 1 35 35 LEU N N 15 119.822 0.032 . 1 . . 1631 . . 23 LEU N . 18632 1 340 . 1 1 36 36 LYS H H 1 8.346 0.002 . 1 . . 1544 . . 24 LYS H . 18632 1 341 . 1 1 36 36 LYS HA H 1 3.978 0.001 . 1 . . 304 . . 24 LYS HA . 18632 1 342 . 1 1 36 36 LYS HB2 H 1 1.758 0.001 . 2 . . 306 . . 24 LYS HB2 . 18632 1 343 . 1 1 36 36 LYS HB3 H 1 1.872 0.001 . 2 . . 305 . . 24 LYS HB3 . 18632 1 344 . 1 1 36 36 LYS HG2 H 1 1.235 0.001 . 2 . . 703 . . 24 LYS HG2 . 18632 1 345 . 1 1 36 36 LYS HG3 H 1 1.503 0.001 . 2 . . 704 . . 24 LYS HG3 . 18632 1 346 . 1 1 36 36 LYS HD2 H 1 1.622 0.001 . 1 . . 705 . . 24 LYS HD2 . 18632 1 347 . 1 1 36 36 LYS HD3 H 1 1.622 0.001 . 1 . . 706 . . 24 LYS HD3 . 18632 1 348 . 1 1 36 36 LYS HE2 H 1 2.885 0.001 . 1 . . 701 . . 24 LYS HE2 . 18632 1 349 . 1 1 36 36 LYS HE3 H 1 2.885 0.001 . 1 . . 702 . . 24 LYS HE3 . 18632 1 350 . 1 1 36 36 LYS C C 13 180.836 0.005 . 1 . . 264 . . 24 LYS C . 18632 1 351 . 1 1 36 36 LYS CA C 13 59.900 0.005 . 1 . . 1546 . . 24 LYS CA . 18632 1 352 . 1 1 36 36 LYS CB C 13 32.723 0.005 . 1 . . 1543 . . 24 LYS CB . 18632 1 353 . 1 1 36 36 LYS CG C 13 25.459 0.005 . 1 . . 709 . . 24 LYS CG . 18632 1 354 . 1 1 36 36 LYS CD C 13 29.964 0.005 . 1 . . 708 . . 24 LYS CD . 18632 1 355 . 1 1 36 36 LYS CE C 13 41.822 0.005 . 1 . . 707 . . 24 LYS CE . 18632 1 356 . 1 1 36 36 LYS N N 15 118.988 0.041 . 1 . . 1545 . . 24 LYS N . 18632 1 357 . 1 1 37 37 ALA H H 1 7.970 0.001 . 1 . . 221 . . 25 ALA H . 18632 1 358 . 1 1 37 37 ALA HA H 1 4.107 0.001 . 1 . . 366 . . 25 ALA HA . 18632 1 359 . 1 1 37 37 ALA HB1 H 1 1.594 0.001 . 1 . . 367 . . 25 ALA HB1 . 18632 1 360 . 1 1 37 37 ALA HB2 H 1 1.594 0.001 . 1 . . 367 . . 25 ALA HB2 . 18632 1 361 . 1 1 37 37 ALA HB3 H 1 1.594 0.001 . 1 . . 367 . . 25 ALA HB3 . 18632 1 362 . 1 1 37 37 ALA C C 13 179.369 0.005 . 1 . . 1684 . . 25 ALA C . 18632 1 363 . 1 1 37 37 ALA CA C 13 55.105 0.005 . 1 . . 1542 . . 25 ALA CA . 18632 1 364 . 1 1 37 37 ALA CB C 13 17.550 0.005 . 1 . . 1691 . . 25 ALA CB . 18632 1 365 . 1 1 37 37 ALA N N 15 125.420 0.013 . 1 . . 222 . . 25 ALA N . 18632 1 366 . 1 1 38 38 ARG H H 1 8.048 0.001 . 1 . . 1540 . . 26 ARG H . 18632 1 367 . 1 1 38 38 ARG HA H 1 3.581 0.001 . 1 . . 393 . . 26 ARG HA . 18632 1 368 . 1 1 38 38 ARG HB2 H 1 1.521 0.001 . 2 . . 395 . . 26 ARG HB2 . 18632 1 369 . 1 1 38 38 ARG HB3 H 1 1.187 0.001 . 2 . . 394 . . 26 ARG HB3 . 18632 1 370 . 1 1 38 38 ARG HG2 H 1 1.255 0.001 . 2 . . 710 . . 26 ARG HG2 . 18632 1 371 . 1 1 38 38 ARG HG3 H 1 0.877 0.001 . 2 . . 688 . . 26 ARG HG3 . 18632 1 372 . 1 1 38 38 ARG HD2 H 1 1.929 0.001 . 1 . . 712 . . 26 ARG HD2 . 18632 1 373 . 1 1 38 38 ARG HD3 H 1 1.929 0.001 . 1 . . 711 . . 26 ARG HD3 . 18632 1 374 . 1 1 38 38 ARG HE H 1 5.621 0.001 . 1 . . 1267 . . 26 ARG HE . 18632 1 375 . 1 1 38 38 ARG C C 13 176.448 0.005 . 1 . . 1737 . . 26 ARG C . 18632 1 376 . 1 1 38 38 ARG CA C 13 54.494 0.005 . 1 . . 1689 . . 26 ARG CA . 18632 1 377 . 1 1 38 38 ARG CB C 13 31.927 0.005 . 1 . . 1690 . . 26 ARG CB . 18632 1 378 . 1 1 38 38 ARG CG C 13 27.672 0.005 . 1 . . 689 . . 26 ARG CG . 18632 1 379 . 1 1 38 38 ARG CD C 13 42.844 0.005 . 1 . . 713 . . 26 ARG CD . 18632 1 380 . 1 1 38 38 ARG N N 15 118.276 0.02 . 1 . . 1541 . . 26 ARG N . 18632 1 381 . 1 1 38 38 ARG NE N 15 82.144 0.005 . 1 . . 1268 . . 26 ARG NE . 18632 1 382 . 1 1 39 39 GLY H H 1 7.498 0.002 . 1 . . 1687 . . 27 GLY H . 18632 1 383 . 1 1 39 39 GLY HA2 H 1 3.528 0.001 . 2 . . 373 . . 27 GLY HA2 . 18632 1 384 . 1 1 39 39 GLY HA3 H 1 3.984 0.001 . 2 . . 374 . . 27 GLY HA3 . 18632 1 385 . 1 1 39 39 GLY C C 13 174.757 0.005 . 1 . . 1683 . . 27 GLY C . 18632 1 386 . 1 1 39 39 GLY CA C 13 45.056 0.005 . 1 . . 1538 . . 27 GLY CA . 18632 1 387 . 1 1 39 39 GLY N N 15 105.772 0.014 . 1 . . 1688 . . 27 GLY N . 18632 1 388 . 1 1 40 40 TYR H H 1 7.606 0.002 . 1 . . 234 . . 28 TYR H . 18632 1 389 . 1 1 40 40 TYR HA H 1 4.288 0.001 . 1 . . 375 . . 28 TYR HA . 18632 1 390 . 1 1 40 40 TYR HB2 H 1 2.330 0.001 . 2 . . 376 . . 28 TYR HB2 . 18632 1 391 . 1 1 40 40 TYR HB3 H 1 2.674 0.001 . 2 . . 714 . . 28 TYR HB3 . 18632 1 392 . 1 1 40 40 TYR HD1 H 1 6.968 0.002 . 3 . . 984 . . 28 TYR HD1 . 18632 1 393 . 1 1 40 40 TYR HD2 H 1 6.968 0.002 . 3 . . 984 . . 28 TYR HD2 . 18632 1 394 . 1 1 40 40 TYR HE1 H 1 6.486 0.007 . 3 . . 1013 . . 28 TYR HE1 . 18632 1 395 . 1 1 40 40 TYR HE2 H 1 6.486 0.007 . 3 . . 1013 . . 28 TYR HE2 . 18632 1 396 . 1 1 40 40 TYR C C 13 177.349 0.005 . 1 . . 1736 . . 28 TYR C . 18632 1 397 . 1 1 40 40 TYR CA C 13 59.362 0.005 . 1 . . 1539 . . 28 TYR CA . 18632 1 398 . 1 1 40 40 TYR CB C 13 39.157 0.01 . 1 . . 265 . . 28 TYR CB . 18632 1 399 . 1 1 40 40 TYR CD1 C 13 132.655 0.005 . 3 . . 1012 . . 28 TYR CD1 . 18632 1 400 . 1 1 40 40 TYR CD2 C 13 132.655 0.005 . 3 . . 1012 . . 28 TYR CD2 . 18632 1 401 . 1 1 40 40 TYR CE1 C 13 117.378 0.005 . 3 . . 1014 . . 28 TYR CE1 . 18632 1 402 . 1 1 40 40 TYR CE2 C 13 117.378 0.005 . 3 . . 1014 . . 28 TYR CE2 . 18632 1 403 . 1 1 40 40 TYR N N 15 119.494 0.012 . 1 . . 235 . . 28 TYR N . 18632 1 404 . 1 1 41 41 GLY H H 1 9.023 0.002 . 1 . . 1536 . . 29 GLY H . 18632 1 405 . 1 1 41 41 GLY HA2 H 1 4.233 0.001 . 2 . . 882 . . 29 GLY HA2 . 18632 1 406 . 1 1 41 41 GLY HA3 H 1 3.979 0.001 . 2 . . 881 . . 29 GLY HA3 . 18632 1 407 . 1 1 41 41 GLY CA C 13 44.252 0.005 . 1 . . 883 . . 29 GLY CA . 18632 1 408 . 1 1 41 41 GLY N N 15 112.367 0.015 . 1 . . 1537 . . 29 GLY N . 18632 1 409 . 1 1 42 42 TRP HA H 1 3.799 0.001 . 1 . . 377 . . 30 TRP HA . 18632 1 410 . 1 1 42 42 TRP HB2 H 1 3.296 0.001 . 2 . . 378 . . 30 TRP HB2 . 18632 1 411 . 1 1 42 42 TRP HB3 H 1 3.430 0.001 . 2 . . 379 . . 30 TRP HB3 . 18632 1 412 . 1 1 42 42 TRP HD1 H 1 7.222 0.001 . 1 . . 992 . . 30 TRP HD1 . 18632 1 413 . 1 1 42 42 TRP HE1 H 1 10.181 0.002 . 1 . . 70 . . 30 TRP HE1 . 18632 1 414 . 1 1 42 42 TRP HE3 H 1 7.442 0.001 . 1 . . 1250 . . 30 TRP HE3 . 18632 1 415 . 1 1 42 42 TRP HZ2 H 1 7.401 0.001 . 1 . . 991 . . 30 TRP HZ2 . 18632 1 416 . 1 1 42 42 TRP HZ3 H 1 7.104 0.001 . 1 . . 1036 . . 30 TRP HZ3 . 18632 1 417 . 1 1 42 42 TRP HH2 H 1 7.179 0.001 . 1 . . 998 . . 30 TRP HH2 . 18632 1 418 . 1 1 42 42 TRP C C 13 177.915 0.005 . 1 . . 308 . . 30 TRP C . 18632 1 419 . 1 1 42 42 TRP CA C 13 63.351 0.005 . 1 . . 310 . . 30 TRP CA . 18632 1 420 . 1 1 42 42 TRP CB C 13 29.404 0.005 . 1 . . 309 . . 30 TRP CB . 18632 1 421 . 1 1 42 42 TRP CD1 C 13 126.924 0.005 . 1 . . 995 . . 30 TRP CD1 . 18632 1 422 . 1 1 42 42 TRP CE3 C 13 120.492 0.005 . 1 . . 1249 . . 30 TRP CE3 . 18632 1 423 . 1 1 42 42 TRP CZ2 C 13 114.829 0.005 . 1 . . 997 . . 30 TRP CZ2 . 18632 1 424 . 1 1 42 42 TRP CZ3 C 13 121.921 0.005 . 1 . . 1037 . . 30 TRP CZ3 . 18632 1 425 . 1 1 42 42 TRP CH2 C 13 124.685 0.005 . 1 . . 1001 . . 30 TRP CH2 . 18632 1 426 . 1 1 42 42 TRP NE1 N 15 130.171 0.01 . 1 . . 71 . . 30 TRP NE1 . 18632 1 427 . 1 1 43 43 ILE H H 1 8.251 0.001 . 1 . . 178 . . 31 ILE H . 18632 1 428 . 1 1 43 43 ILE HA H 1 3.427 0.001 . 1 . . 380 . . 31 ILE HA . 18632 1 429 . 1 1 43 43 ILE HB H 1 1.810 0.001 . 1 . . 381 . . 31 ILE HB . 18632 1 430 . 1 1 43 43 ILE HG12 H 1 1.544 0.001 . 2 . . 620 . . 31 ILE HG12 . 18632 1 431 . 1 1 43 43 ILE HG13 H 1 1.139 0.001 . 2 . . 621 . . 31 ILE HG13 . 18632 1 432 . 1 1 43 43 ILE HG21 H 1 0.839 0.001 . 1 . . 623 . . 31 ILE HG21 . 18632 1 433 . 1 1 43 43 ILE HG22 H 1 0.839 0.001 . 1 . . 623 . . 31 ILE HG22 . 18632 1 434 . 1 1 43 43 ILE HG23 H 1 0.839 0.001 . 1 . . 623 . . 31 ILE HG23 . 18632 1 435 . 1 1 43 43 ILE HD11 H 1 0.900 0.001 . 1 . . 622 . . 31 ILE HD11 . 18632 1 436 . 1 1 43 43 ILE HD12 H 1 0.900 0.001 . 1 . . 622 . . 31 ILE HD12 . 18632 1 437 . 1 1 43 43 ILE HD13 H 1 0.900 0.001 . 1 . . 622 . . 31 ILE HD13 . 18632 1 438 . 1 1 43 43 ILE C C 13 178.716 0.005 . 1 . . 269 . . 31 ILE C . 18632 1 439 . 1 1 43 43 ILE CA C 13 65.002 0.005 . 1 . . 267 . . 31 ILE CA . 18632 1 440 . 1 1 43 43 ILE CB C 13 37.411 0.005 . 1 . . 268 . . 31 ILE CB . 18632 1 441 . 1 1 43 43 ILE CG1 C 13 28.793 0.005 . 1 . . 626 . . 31 ILE CG1 . 18632 1 442 . 1 1 43 43 ILE CG2 C 13 16.799 0.005 . 1 . . 624 . . 31 ILE CG2 . 18632 1 443 . 1 1 43 43 ILE CD1 C 13 12.617 0.005 . 1 . . 625 . . 31 ILE CD1 . 18632 1 444 . 1 1 43 43 ILE N N 15 117.555 0.012 . 1 . . 179 . . 31 ILE N . 18632 1 445 . 1 1 44 44 MET H H 1 7.789 0.001 . 1 . . 155 . . 32 MET H . 18632 1 446 . 1 1 44 44 MET HA H 1 4.408 0.001 . 1 . . 382 . . 32 MET HA . 18632 1 447 . 1 1 44 44 MET HB2 H 1 1.898 0.001 . 2 . . 383 . . 32 MET HB2 . 18632 1 448 . 1 1 44 44 MET HB3 H 1 2.148 0.001 . 2 . . 384 . . 32 MET HB3 . 18632 1 449 . 1 1 44 44 MET HG2 H 1 2.756 0.001 . 2 . . 725 . . 32 MET HG2 . 18632 1 450 . 1 1 44 44 MET HG3 H 1 2.604 0.001 . 2 . . 724 . . 32 MET HG3 . 18632 1 451 . 1 1 44 44 MET HE1 H 1 1.999 0.004 . 1 . . 1241 . . 32 MET HE1 . 18632 1 452 . 1 1 44 44 MET HE2 H 1 1.999 0.004 . 1 . . 1241 . . 32 MET HE2 . 18632 1 453 . 1 1 44 44 MET HE3 H 1 1.999 0.004 . 1 . . 1241 . . 32 MET HE3 . 18632 1 454 . 1 1 44 44 MET C C 13 178.637 0.005 . 1 . . 1738 . . 32 MET C . 18632 1 455 . 1 1 44 44 MET CA C 13 56.206 0.005 . 1 . . 1698 . . 32 MET CA . 18632 1 456 . 1 1 44 44 MET CB C 13 31.191 0.005 . 1 . . 1534 . . 32 MET CB . 18632 1 457 . 1 1 44 44 MET CG C 13 32.554 0.005 . 1 . . 726 . . 32 MET CG . 18632 1 458 . 1 1 44 44 MET CE C 13 16.002 0.005 . 1 . . 1242 . . 32 MET CE . 18632 1 459 . 1 1 44 44 MET N N 15 118.292 0.007 . 1 . . 156 . . 32 MET N . 18632 1 460 . 1 1 45 45 ARG H H 1 8.711 0.002 . 1 . . 242 . . 33 ARG H . 18632 1 461 . 1 1 45 45 ARG HA H 1 3.563 0.001 . 1 . . 385 . . 33 ARG HA . 18632 1 462 . 1 1 45 45 ARG HB2 H 1 0.893 0.001 . 2 . . 730 . . 33 ARG HB2 . 18632 1 463 . 1 1 45 45 ARG HB3 H 1 1.953 0.001 . 2 . . 727 . . 33 ARG HB3 . 18632 1 464 . 1 1 45 45 ARG HG2 H 1 1.406 0.001 . 2 . . 729 . . 33 ARG HG2 . 18632 1 465 . 1 1 45 45 ARG HG3 H 1 1.785 0.001 . 2 . . 728 . . 33 ARG HG3 . 18632 1 466 . 1 1 45 45 ARG HD2 H 1 3.194 0.001 . 2 . . 732 . . 33 ARG HD2 . 18632 1 467 . 1 1 45 45 ARG HD3 H 1 2.838 0.001 . 2 . . 731 . . 33 ARG HD3 . 18632 1 468 . 1 1 45 45 ARG C C 13 177.956 0.005 . 1 . . 266 . . 33 ARG C . 18632 1 469 . 1 1 45 45 ARG CA C 13 61.380 0.005 . 1 . . 1535 . . 33 ARG CA . 18632 1 470 . 1 1 45 45 ARG CB C 13 28.894 0.005 . 1 . . 1528 . . 33 ARG CB . 18632 1 471 . 1 1 45 45 ARG CG C 13 29.248 0.005 . 1 . . 1075 . . 33 ARG CG . 18632 1 472 . 1 1 45 45 ARG CD C 13 44.260 0.005 . 1 . . 733 . . 33 ARG CD . 18632 1 473 . 1 1 45 45 ARG N N 15 117.200 0.03 . 1 . . 243 . . 33 ARG N . 18632 1 474 . 1 1 46 46 GLN H H 1 7.432 0.003 . 1 . . 90 . . 34 GLN H . 18632 1 475 . 1 1 46 46 GLN HA H 1 3.661 0.001 . 1 . . 386 . . 34 GLN HA . 18632 1 476 . 1 1 46 46 GLN HB2 H 1 1.853 0.001 . 2 . . 387 . . 34 GLN HB2 . 18632 1 477 . 1 1 46 46 GLN HB3 H 1 1.803 0.001 . 2 . . 1659 . . 34 GLN HB3 . 18632 1 478 . 1 1 46 46 GLN HG2 H 1 1.637 0.001 . 2 . . 715 . . 34 GLN HG2 . 18632 1 479 . 1 1 46 46 GLN HG3 H 1 1.689 0.01 . 2 . . 716 . . 34 GLN HG3 . 18632 1 480 . 1 1 46 46 GLN HE21 H 1 6.732 0.002 . 1 . . 76 . . 34 GLN HE21 . 18632 1 481 . 1 1 46 46 GLN HE22 H 1 6.459 0.006 . 1 . . 223 . . 34 GLN HE22 . 18632 1 482 . 1 1 46 46 GLN C C 13 177.463 0.005 . 1 . . 1739 . . 34 GLN C . 18632 1 483 . 1 1 46 46 GLN CA C 13 58.464 0.005 . 1 . . 1531 . . 34 GLN CA . 18632 1 484 . 1 1 46 46 GLN CB C 13 27.995 0.005 . 1 . . 1532 . . 34 GLN CB . 18632 1 485 . 1 1 46 46 GLN CG C 13 32.756 0.005 . 1 . . 1057 . . 34 GLN CG . 18632 1 486 . 1 1 46 46 GLN N N 15 115.919 0.007 . 1 . . 91 . . 34 GLN N . 18632 1 487 . 1 1 46 46 GLN NE2 N 15 112.159 0.008 . 1 . . 77 . . 34 GLN NE2 . 18632 1 488 . 1 1 47 47 VAL H H 1 7.227 0.002 . 1 . . 1529 . . 35 VAL H . 18632 1 489 . 1 1 47 47 VAL HA H 1 3.419 0.001 . 1 . . 388 . . 35 VAL HA . 18632 1 490 . 1 1 47 47 VAL HB H 1 2.204 0.001 . 1 . . 389 . . 35 VAL HB . 18632 1 491 . 1 1 47 47 VAL HG11 H 1 0.802 0.001 . 2 . . 650 . . 35 VAL HG11 . 18632 1 492 . 1 1 47 47 VAL HG12 H 1 0.802 0.001 . 2 . . 650 . . 35 VAL HG12 . 18632 1 493 . 1 1 47 47 VAL HG13 H 1 0.802 0.001 . 2 . . 650 . . 35 VAL HG13 . 18632 1 494 . 1 1 47 47 VAL HG21 H 1 1.022 0.001 . 2 . . 649 . . 35 VAL HG21 . 18632 1 495 . 1 1 47 47 VAL HG22 H 1 1.022 0.001 . 2 . . 649 . . 35 VAL HG22 . 18632 1 496 . 1 1 47 47 VAL HG23 H 1 1.022 0.001 . 2 . . 649 . . 35 VAL HG23 . 18632 1 497 . 1 1 47 47 VAL C C 13 178.494 0.005 . 1 . . 311 . . 35 VAL C . 18632 1 498 . 1 1 47 47 VAL CA C 13 65.883 0.005 . 1 . . 272 . . 35 VAL CA . 18632 1 499 . 1 1 47 47 VAL CB C 13 32.187 0.005 . 1 . . 1533 . . 35 VAL CB . 18632 1 500 . 1 1 47 47 VAL CG1 C 13 20.843 0.005 . 2 . . 651 . . 35 VAL CG1 . 18632 1 501 . 1 1 47 47 VAL CG2 C 13 22.286 0.005 . 2 . . 648 . . 35 VAL CG2 . 18632 1 502 . 1 1 47 47 VAL N N 15 117.532 0.005 . 1 . . 1530 . . 35 VAL N . 18632 1 503 . 1 1 48 48 ILE H H 1 8.101 0.002 . 1 . . 167 . . 36 ILE H . 18632 1 504 . 1 1 48 48 ILE HA H 1 3.435 0.007 . 1 . . 415 . . 36 ILE HA . 18632 1 505 . 1 1 48 48 ILE HB H 1 1.370 0.001 . 1 . . 416 . . 36 ILE HB . 18632 1 506 . 1 1 48 48 ILE HG12 H 1 1.675 0.001 . 2 . . 905 . . 36 ILE HG12 . 18632 1 507 . 1 1 48 48 ILE HG13 H 1 0.689 0.001 . 2 . . 902 . . 36 ILE HG13 . 18632 1 508 . 1 1 48 48 ILE HG21 H 1 0.817 0.001 . 1 . . 903 . . 36 ILE HG21 . 18632 1 509 . 1 1 48 48 ILE HG22 H 1 0.817 0.001 . 1 . . 903 . . 36 ILE HG22 . 18632 1 510 . 1 1 48 48 ILE HG23 H 1 0.817 0.001 . 1 . . 903 . . 36 ILE HG23 . 18632 1 511 . 1 1 48 48 ILE HD11 H 1 -0.036 0.002 . 1 . . 900 . . 36 ILE HD11 . 18632 1 512 . 1 1 48 48 ILE HD12 H 1 -0.036 0.002 . 1 . . 900 . . 36 ILE HD12 . 18632 1 513 . 1 1 48 48 ILE HD13 H 1 -0.036 0.002 . 1 . . 900 . . 36 ILE HD13 . 18632 1 514 . 1 1 48 48 ILE C C 13 178.310 0.005 . 1 . . 291 . . 36 ILE C . 18632 1 515 . 1 1 48 48 ILE CA C 13 65.498 0.005 . 1 . . 278 . . 36 ILE CA . 18632 1 516 . 1 1 48 48 ILE CB C 13 38.482 0.005 . 1 . . 277 . . 36 ILE CB . 18632 1 517 . 1 1 48 48 ILE CG1 C 13 29.842 0.005 . 1 . . 906 . . 36 ILE CG1 . 18632 1 518 . 1 1 48 48 ILE CG2 C 13 18.896 0.005 . 1 . . 904 . . 36 ILE CG2 . 18632 1 519 . 1 1 48 48 ILE CD1 C 13 14.210 0.005 . 1 . . 901 . . 36 ILE CD1 . 18632 1 520 . 1 1 48 48 ILE N N 15 117.523 0.013 . 1 . . 168 . . 36 ILE N . 18632 1 521 . 1 1 49 49 LYS H H 1 8.338 0.003 . 1 . . 137 . . 37 LYS H . 18632 1 522 . 1 1 49 49 LYS HA H 1 4.049 0.001 . 1 . . 390 . . 37 LYS HA . 18632 1 523 . 1 1 49 49 LYS HB2 H 1 1.895 0.001 . 2 . . 392 . . 37 LYS HB2 . 18632 1 524 . 1 1 49 49 LYS HB3 H 1 1.726 0.001 . 2 . . 391 . . 37 LYS HB3 . 18632 1 525 . 1 1 49 49 LYS HG2 H 1 1.493 0.001 . 2 . . 1092 . . 37 LYS HG2 . 18632 1 526 . 1 1 49 49 LYS HG3 H 1 1.615 0.001 . 2 . . 1087 . . 37 LYS HG3 . 18632 1 527 . 1 1 49 49 LYS HD2 H 1 1.731 0.001 . 2 . . 1089 . . 37 LYS HD2 . 18632 1 528 . 1 1 49 49 LYS HD3 H 1 1.488 0.001 . 2 . . 1090 . . 37 LYS HD3 . 18632 1 529 . 1 1 49 49 LYS HE2 H 1 2.867 0.001 . 2 . . 1091 . . 37 LYS HE2 . 18632 1 530 . 1 1 49 49 LYS HE3 H 1 2.710 0.001 . 2 . . 1088 . . 37 LYS HE3 . 18632 1 531 . 1 1 49 49 LYS C C 13 177.722 0.005 . 1 . . 312 . . 37 LYS C . 18632 1 532 . 1 1 49 49 LYS CA C 13 59.850 0.005 . 1 . . 274 . . 37 LYS CA . 18632 1 533 . 1 1 49 49 LYS CB C 13 32.076 0.005 . 1 . . 301 . . 37 LYS CB . 18632 1 534 . 1 1 49 49 LYS CG C 13 25.624 0.005 . 1 . . 1084 . . 37 LYS CG . 18632 1 535 . 1 1 49 49 LYS CD C 13 29.288 0.005 . 1 . . 1085 . . 37 LYS CD . 18632 1 536 . 1 1 49 49 LYS CE C 13 41.516 0.005 . 1 . . 1086 . . 37 LYS CE . 18632 1 537 . 1 1 49 49 LYS N N 15 117.466 0.021 . 1 . . 138 . . 37 LYS N . 18632 1 538 . 1 1 50 50 LEU H H 1 7.318 0.001 . 1 . . 145 . . 38 LEU H . 18632 1 539 . 1 1 50 50 LEU HA H 1 4.266 0.001 . 1 . . 396 . . 38 LEU HA . 18632 1 540 . 1 1 50 50 LEU HB2 H 1 1.756 0.001 . 2 . . 397 . . 38 LEU HB2 . 18632 1 541 . 1 1 50 50 LEU HB3 H 1 1.568 0.001 . 2 . . 398 . . 38 LEU HB3 . 18632 1 542 . 1 1 50 50 LEU HG H 1 1.754 0.001 . 1 . . 736 . . 38 LEU HG . 18632 1 543 . 1 1 50 50 LEU HD11 H 1 0.830 0.001 . 2 . . 734 . . 38 LEU HD11 . 18632 1 544 . 1 1 50 50 LEU HD12 H 1 0.830 0.001 . 2 . . 734 . . 38 LEU HD12 . 18632 1 545 . 1 1 50 50 LEU HD13 H 1 0.830 0.001 . 2 . . 734 . . 38 LEU HD13 . 18632 1 546 . 1 1 50 50 LEU HD21 H 1 0.847 0.001 . 2 . . 735 . . 38 LEU HD21 . 18632 1 547 . 1 1 50 50 LEU HD22 H 1 0.847 0.001 . 2 . . 735 . . 38 LEU HD22 . 18632 1 548 . 1 1 50 50 LEU HD23 H 1 0.847 0.001 . 2 . . 735 . . 38 LEU HD23 . 18632 1 549 . 1 1 50 50 LEU C C 13 177.383 0.005 . 1 . . 1740 . . 38 LEU C . 18632 1 550 . 1 1 50 50 LEU CA C 13 55.013 0.005 . 1 . . 300 . . 38 LEU CA . 18632 1 551 . 1 1 50 50 LEU CB C 13 42.037 0.005 . 1 . . 1527 . . 38 LEU CB . 18632 1 552 . 1 1 50 50 LEU CG C 13 27.288 0.005 . 1 . . 737 . . 38 LEU CG . 18632 1 553 . 1 1 50 50 LEU CD1 C 13 24.869 0.005 . 2 . . 738 . . 38 LEU CD1 . 18632 1 554 . 1 1 50 50 LEU CD2 C 13 22.710 0.005 . 2 . . 739 . . 38 LEU CD2 . 18632 1 555 . 1 1 50 50 LEU N N 15 116.104 0.013 . 1 . . 146 . . 38 LEU N . 18632 1 556 . 1 1 51 51 ALA H H 1 7.017 0.001 . 1 . . 232 . . 39 ALA H . 18632 1 557 . 1 1 51 51 ALA HA H 1 4.090 0.001 . 1 . . 399 . . 39 ALA HA . 18632 1 558 . 1 1 51 51 ALA HB1 H 1 1.402 0.001 . 1 . . 400 . . 39 ALA HB1 . 18632 1 559 . 1 1 51 51 ALA HB2 H 1 1.402 0.001 . 1 . . 400 . . 39 ALA HB2 . 18632 1 560 . 1 1 51 51 ALA HB3 H 1 1.402 0.001 . 1 . . 400 . . 39 ALA HB3 . 18632 1 561 . 1 1 51 51 ALA C C 13 178.566 0.005 . 1 . . 1696 . . 39 ALA C . 18632 1 562 . 1 1 51 51 ALA CA C 13 52.893 0.005 . 1 . . 1526 . . 39 ALA CA . 18632 1 563 . 1 1 51 51 ALA CB C 13 18.095 0.005 . 1 . . 1525 . . 39 ALA CB . 18632 1 564 . 1 1 51 51 ALA N N 15 122.422 0.018 . 1 . . 233 . . 39 ALA N . 18632 1 565 . 1 1 52 52 GLY H H 1 8.352 0.002 . 1 . . 98 . . 40 GLY H . 18632 1 566 . 1 1 52 52 GLY HA2 H 1 4.257 0.001 . 2 . . 402 . . 40 GLY HA2 . 18632 1 567 . 1 1 52 52 GLY HA3 H 1 3.667 0.001 . 2 . . 401 . . 40 GLY HA3 . 18632 1 568 . 1 1 52 52 GLY C C 13 173.582 0.005 . 1 . . 313 . . 40 GLY C . 18632 1 569 . 1 1 52 52 GLY CA C 13 45.156 0.005 . 1 . . 302 . . 40 GLY CA . 18632 1 570 . 1 1 52 52 GLY N N 15 112.009 0.024 . 1 . . 99 . . 40 GLY N . 18632 1 571 . 1 1 53 53 VAL H H 1 7.128 0.001 . 1 . . 80 . . 41 VAL H . 18632 1 572 . 1 1 53 53 VAL HA H 1 4.836 0.001 . 1 . . 1637 . . 41 VAL HA . 18632 1 573 . 1 1 53 53 VAL HB H 1 2.178 0.001 . 1 . . 403 . . 41 VAL HB . 18632 1 574 . 1 1 53 53 VAL HG11 H 1 0.959 0.001 . 2 . . 740 . . 41 VAL HG11 . 18632 1 575 . 1 1 53 53 VAL HG12 H 1 0.959 0.001 . 2 . . 740 . . 41 VAL HG12 . 18632 1 576 . 1 1 53 53 VAL HG13 H 1 0.959 0.001 . 2 . . 740 . . 41 VAL HG13 . 18632 1 577 . 1 1 53 53 VAL HG21 H 1 1.068 0.001 . 2 . . 741 . . 41 VAL HG21 . 18632 1 578 . 1 1 53 53 VAL HG22 H 1 1.068 0.001 . 2 . . 741 . . 41 VAL HG22 . 18632 1 579 . 1 1 53 53 VAL HG23 H 1 1.068 0.001 . 2 . . 741 . . 41 VAL HG23 . 18632 1 580 . 1 1 53 53 VAL C C 13 174.441 0.005 . 1 . . 260 . . 41 VAL C . 18632 1 581 . 1 1 53 53 VAL CA C 13 62.355 0.005 . 1 . . 286 . . 41 VAL CA . 18632 1 582 . 1 1 53 53 VAL CB C 13 37.001 0.005 . 1 . . 259 . . 41 VAL CB . 18632 1 583 . 1 1 53 53 VAL CG1 C 13 21.827 0.005 . 2 . . 743 . . 41 VAL CG1 . 18632 1 584 . 1 1 53 53 VAL CG2 C 13 21.657 0.005 . 2 . . 742 . . 41 VAL CG2 . 18632 1 585 . 1 1 53 53 VAL N N 15 118.673 0.007 . 1 . . 81 . . 41 VAL N . 18632 1 586 . 1 1 54 54 THR H H 1 9.405 0.002 . 1 . . 182 . . 42 THR H . 18632 1 587 . 1 1 54 54 THR HA H 1 5.275 0.001 . 1 . . 404 . . 42 THR HA . 18632 1 588 . 1 1 54 54 THR HB H 1 4.097 0.001 . 1 . . 405 . . 42 THR HB . 18632 1 589 . 1 1 54 54 THR HG21 H 1 1.069 0.001 . 1 . . 744 . . 42 THR HG21 . 18632 1 590 . 1 1 54 54 THR HG22 H 1 1.069 0.001 . 1 . . 744 . . 42 THR HG22 . 18632 1 591 . 1 1 54 54 THR HG23 H 1 1.069 0.001 . 1 . . 744 . . 42 THR HG23 . 18632 1 592 . 1 1 54 54 THR C C 13 172.636 0.005 . 1 . . 1742 . . 42 THR C . 18632 1 593 . 1 1 54 54 THR CA C 13 62.030 0.005 . 1 . . 1523 . . 42 THR CA . 18632 1 594 . 1 1 54 54 THR CB C 13 71.595 0.005 . 1 . . 1524 . . 42 THR CB . 18632 1 595 . 1 1 54 54 THR CG2 C 13 22.240 0.005 . 1 . . 745 . . 42 THR CG2 . 18632 1 596 . 1 1 54 54 THR N N 15 126.039 0.01 . 1 . . 183 . . 42 THR N . 18632 1 597 . 1 1 55 55 LYS H H 1 9.506 0.004 . 1 . . 108 . . 43 LYS H . 18632 1 598 . 1 1 55 55 LYS HA H 1 5.420 0.001 . 1 . . 406 . . 43 LYS HA . 18632 1 599 . 1 1 55 55 LYS HB2 H 1 1.388 0.001 . 1 . . 407 . . 43 LYS HB2 . 18632 1 600 . 1 1 55 55 LYS HB3 H 1 1.388 0.001 . 1 . . 408 . . 43 LYS HB3 . 18632 1 601 . 1 1 55 55 LYS HG2 H 1 1.872 0.001 . 2 . . 929 . . 43 LYS HG2 . 18632 1 602 . 1 1 55 55 LYS HG3 H 1 0.903 0.001 . 2 . . 928 . . 43 LYS HG3 . 18632 1 603 . 1 1 55 55 LYS HD2 H 1 0.604 0.001 . 2 . . 934 . . 43 LYS HD2 . 18632 1 604 . 1 1 55 55 LYS HD3 H 1 1.389 0.001 . 2 . . 938 . . 43 LYS HD3 . 18632 1 605 . 1 1 55 55 LYS HE2 H 1 2.588 0.001 . 2 . . 937 . . 43 LYS HE2 . 18632 1 606 . 1 1 55 55 LYS HE3 H 1 3.282 0.001 . 2 . . 935 . . 43 LYS HE3 . 18632 1 607 . 1 1 55 55 LYS C C 13 175.994 0.005 . 1 . . 1741 . . 43 LYS C . 18632 1 608 . 1 1 55 55 LYS CA C 13 54.482 0.005 . 1 . . 1375 . . 43 LYS CA . 18632 1 609 . 1 1 55 55 LYS CB C 13 36.897 0.005 . 1 . . 1374 . . 43 LYS CB . 18632 1 610 . 1 1 55 55 LYS CG C 13 26.544 0.005 . 1 . . 927 . . 43 LYS CG . 18632 1 611 . 1 1 55 55 LYS CD C 13 30.052 0.005 . 1 . . 936 . . 43 LYS CD . 18632 1 612 . 1 1 55 55 LYS CE C 13 43.552 0.005 . 1 . . 939 . . 43 LYS CE . 18632 1 613 . 1 1 55 55 LYS N N 15 125.454 0.007 . 1 . . 109 . . 43 LYS N . 18632 1 614 . 1 1 56 56 LYS H H 1 8.822 0.002 . 1 . . 1372 . . 44 LYS H . 18632 1 615 . 1 1 56 56 LYS HA H 1 5.655 0.001 . 1 . . 409 . . 44 LYS HA . 18632 1 616 . 1 1 56 56 LYS HB2 H 1 1.461 0.001 . 2 . . 411 . . 44 LYS HB2 . 18632 1 617 . 1 1 56 56 LYS HB3 H 1 1.659 0.001 . 2 . . 410 . . 44 LYS HB3 . 18632 1 618 . 1 1 56 56 LYS HG2 H 1 1.544 0.001 . 2 . . 1096 . . 44 LYS HG2 . 18632 1 619 . 1 1 56 56 LYS HG3 H 1 1.198 0.001 . 2 . . 1097 . . 44 LYS HG3 . 18632 1 620 . 1 1 56 56 LYS HD3 H 1 1.490 0.001 . 1 . . 1098 . . 44 LYS HD3 . 18632 1 621 . 1 1 56 56 LYS HE3 H 1 2.731 0.001 . 1 . . 1099 . . 44 LYS HE3 . 18632 1 622 . 1 1 56 56 LYS C C 13 175.030 0.005 . 1 . . 1589 . . 44 LYS C . 18632 1 623 . 1 1 56 56 LYS CA C 13 54.929 0.005 . 1 . . 1371 . . 44 LYS CA . 18632 1 624 . 1 1 56 56 LYS CB C 13 36.657 0.005 . 1 . . 1370 . . 44 LYS CB . 18632 1 625 . 1 1 56 56 LYS CG C 13 25.715 0.005 . 1 . . 1093 . . 44 LYS CG . 18632 1 626 . 1 1 56 56 LYS CD C 13 29.883 0.005 . 1 . . 1094 . . 44 LYS CD . 18632 1 627 . 1 1 56 56 LYS CE C 13 41.923 0.005 . 1 . . 1095 . . 44 LYS CE . 18632 1 628 . 1 1 56 56 LYS N N 15 119.926 0.015 . 1 . . 1373 . . 44 LYS N . 18632 1 629 . 1 1 57 57 PHE H H 1 8.933 0.002 . 1 . . 66 . . 45 PHE H . 18632 1 630 . 1 1 57 57 PHE HA H 1 5.299 0.001 . 1 . . 417 . . 45 PHE HA . 18632 1 631 . 1 1 57 57 PHE HB2 H 1 2.642 0.001 . 2 . . 418 . . 45 PHE HB2 . 18632 1 632 . 1 1 57 57 PHE HB3 H 1 3.827 0.001 . 2 . . 1660 . . 45 PHE HB3 . 18632 1 633 . 1 1 57 57 PHE HD1 H 1 7.010 0.004 . 3 . . 1053 . . 45 PHE HD1 . 18632 1 634 . 1 1 57 57 PHE HD2 H 1 7.010 0.004 . 3 . . 1053 . . 45 PHE HD2 . 18632 1 635 . 1 1 57 57 PHE HE1 H 1 6.565 0.001 . 3 . . 1217 . . 45 PHE HE1 . 18632 1 636 . 1 1 57 57 PHE HE2 H 1 6.565 0.001 . 3 . . 1217 . . 45 PHE HE2 . 18632 1 637 . 1 1 57 57 PHE HZ H 1 6.252 0.001 . 1 . . 1038 . . 45 PHE HZ . 18632 1 638 . 1 1 57 57 PHE C C 13 176.036 0.005 . 1 . . 1588 . . 45 PHE C . 18632 1 639 . 1 1 57 57 PHE CA C 13 57.353 0.005 . 1 . . 1369 . . 45 PHE CA . 18632 1 640 . 1 1 57 57 PHE CB C 13 43.715 0.005 . 1 . . 1368 . . 45 PHE CB . 18632 1 641 . 1 1 57 57 PHE CD1 C 13 131.064 0.005 . 3 . . 1054 . . 45 PHE CD1 . 18632 1 642 . 1 1 57 57 PHE CD2 C 13 131.064 0.005 . 3 . . 1054 . . 45 PHE CD2 . 18632 1 643 . 1 1 57 57 PHE CE1 C 13 130.900 0.005 . 3 . . 1218 . . 45 PHE CE1 . 18632 1 644 . 1 1 57 57 PHE CE2 C 13 130.900 0.005 . 3 . . 1218 . . 45 PHE CE2 . 18632 1 645 . 1 1 57 57 PHE CZ C 13 128.893 0.005 . 1 . . 1039 . . 45 PHE CZ . 18632 1 646 . 1 1 57 57 PHE N N 15 119.890 0.009 . 1 . . 67 . . 45 PHE N . 18632 1 647 . 1 1 58 58 ARG H H 1 8.728 0.004 . 1 . . 1366 . . 46 ARG H . 18632 1 648 . 1 1 58 58 ARG HA H 1 5.023 0.001 . 1 . . 412 . . 46 ARG HA . 18632 1 649 . 1 1 58 58 ARG HB2 H 1 2.017 0.001 . 2 . . 414 . . 46 ARG HB2 . 18632 1 650 . 1 1 58 58 ARG HB3 H 1 1.778 0.001 . 2 . . 413 . . 46 ARG HB3 . 18632 1 651 . 1 1 58 58 ARG HG2 H 1 1.429 0.001 . 1 . . 659 . . 46 ARG HG2 . 18632 1 652 . 1 1 58 58 ARG HG3 H 1 1.429 0.001 . 1 . . 1076 . . 46 ARG HG3 . 18632 1 653 . 1 1 58 58 ARG HD2 H 1 3.239 0.001 . 1 . . 1077 . . 46 ARG HD2 . 18632 1 654 . 1 1 58 58 ARG HD3 H 1 3.239 0.001 . 1 . . 658 . . 46 ARG HD3 . 18632 1 655 . 1 1 58 58 ARG C C 13 175.735 0.005 . 1 . . 1587 . . 46 ARG C . 18632 1 656 . 1 1 58 58 ARG CA C 13 54.619 0.005 . 1 . . 1365 . . 46 ARG CA . 18632 1 657 . 1 1 58 58 ARG CB C 13 33.577 0.005 . 1 . . 1302 . . 46 ARG CB . 18632 1 658 . 1 1 58 58 ARG CG C 13 26.550 0.005 . 1 . . 660 . . 46 ARG CG . 18632 1 659 . 1 1 58 58 ARG CD C 13 43.101 0.005 . 1 . . 661 . . 46 ARG CD . 18632 1 660 . 1 1 58 58 ARG N N 15 117.305 0.008 . 1 . . 1367 . . 46 ARG N . 18632 1 661 . 1 1 59 59 ASN H H 1 8.629 0.001 . 1 . . 133 . . 47 ASN H . 18632 1 662 . 1 1 59 59 ASN HA H 1 4.384 0.006 . 1 . . 419 . . 47 ASN HA . 18632 1 663 . 1 1 59 59 ASN HB2 H 1 2.374 0.002 . 2 . . 420 . . 47 ASN HB2 . 18632 1 664 . 1 1 59 59 ASN HB3 H 1 2.762 0.001 . 2 . . 421 . . 47 ASN HB3 . 18632 1 665 . 1 1 59 59 ASN HD21 H 1 7.774 0.002 . 1 . . 12 . . 47 ASN HD21 . 18632 1 666 . 1 1 59 59 ASN HD22 H 1 7.093 0.003 . 1 . . 10 . . 47 ASN HD22 . 18632 1 667 . 1 1 59 59 ASN C C 13 175.575 0.005 . 1 . . 1586 . . 47 ASN C . 18632 1 668 . 1 1 59 59 ASN CA C 13 55.660 0.005 . 1 . . 1364 . . 47 ASN CA . 18632 1 669 . 1 1 59 59 ASN CB C 13 38.863 0.005 . 1 . . 1301 . . 47 ASN CB . 18632 1 670 . 1 1 59 59 ASN N N 15 119.781 0.041 . 1 . . 134 . . 47 ASN N . 18632 1 671 . 1 1 59 59 ASN ND2 N 15 113.040 0.04 . 1 . . 256 . . 47 ASN ND2 . 18632 1 672 . 1 1 60 60 ALA H H 1 8.215 0.002 . 1 . . 206 . . 48 ALA H . 18632 1 673 . 1 1 60 60 ALA HA H 1 3.762 0.001 . 1 . . 422 . . 48 ALA HA . 18632 1 674 . 1 1 60 60 ALA HB1 H 1 1.028 0.001 . 1 . . 423 . . 48 ALA HB1 . 18632 1 675 . 1 1 60 60 ALA HB2 H 1 1.028 0.001 . 1 . . 423 . . 48 ALA HB2 . 18632 1 676 . 1 1 60 60 ALA HB3 H 1 1.028 0.001 . 1 . . 423 . . 48 ALA HB3 . 18632 1 677 . 1 1 60 60 ALA C C 13 179.823 0.005 . 1 . . 1585 . . 48 ALA C . 18632 1 678 . 1 1 60 60 ALA CA C 13 52.987 0.005 . 1 . . 1362 . . 48 ALA CA . 18632 1 679 . 1 1 60 60 ALA CB C 13 17.914 0.005 . 1 . . 1363 . . 48 ALA CB . 18632 1 680 . 1 1 60 60 ALA N N 15 125.942 0.032 . 1 . . 207 . . 48 ALA N . 18632 1 681 . 1 1 61 61 ALA H H 1 9.831 0.001 . 1 . . 30 . . 49 ALA H . 18632 1 682 . 1 1 61 61 ALA HA H 1 3.995 0.001 . 1 . . 424 . . 49 ALA HA . 18632 1 683 . 1 1 61 61 ALA HB1 H 1 1.382 0.001 . 1 . . 425 . . 49 ALA HB1 . 18632 1 684 . 1 1 61 61 ALA HB2 H 1 1.382 0.001 . 1 . . 425 . . 49 ALA HB2 . 18632 1 685 . 1 1 61 61 ALA HB3 H 1 1.382 0.001 . 1 . . 425 . . 49 ALA HB3 . 18632 1 686 . 1 1 61 61 ALA C C 13 179.117 0.005 . 1 . . 1743 . . 49 ALA C . 18632 1 687 . 1 1 61 61 ALA CA C 13 54.488 0.005 . 1 . . 1360 . . 49 ALA CA . 18632 1 688 . 1 1 61 61 ALA CB C 13 17.961 0.005 . 1 . . 1361 . . 49 ALA CB . 18632 1 689 . 1 1 61 61 ALA N N 15 131.247 0.005 . 1 . . 1619 . . 49 ALA N . 18632 1 690 . 1 1 62 62 SER H H 1 8.475 0.002 . 1 . . 175 . . 50 SER H . 18632 1 691 . 1 1 62 62 SER HA H 1 4.028 0.001 . 1 . . 426 . . 50 SER HA . 18632 1 692 . 1 1 62 62 SER HB2 H 1 3.927 0.001 . 2 . . 428 . . 50 SER HB2 . 18632 1 693 . 1 1 62 62 SER HB3 H 1 3.815 0.001 . 2 . . 427 . . 50 SER HB3 . 18632 1 694 . 1 1 62 62 SER C C 13 176.423 0.005 . 1 . . 1744 . . 50 SER C . 18632 1 695 . 1 1 62 62 SER CA C 13 59.319 0.005 . 1 . . 1359 . . 50 SER CA . 18632 1 696 . 1 1 62 62 SER CB C 13 63.117 0.005 . 1 . . 1358 . . 50 SER CB . 18632 1 697 . 1 1 62 62 SER N N 15 113.132 0.004 . 1 . . 11 . . 50 SER N . 18632 1 698 . 1 1 63 63 GLY H H 1 7.839 0.001 . 1 . . 31 . . 51 GLY H . 18632 1 699 . 1 1 63 63 GLY HA2 H 1 4.070 0.001 . 2 . . 430 . . 51 GLY HA2 . 18632 1 700 . 1 1 63 63 GLY HA3 H 1 3.641 0.001 . 2 . . 429 . . 51 GLY HA3 . 18632 1 701 . 1 1 63 63 GLY C C 13 174.450 0.005 . 1 . . 1745 . . 51 GLY C . 18632 1 702 . 1 1 63 63 GLY CA C 13 45.095 0.005 . 1 . . 1355 . . 51 GLY CA . 18632 1 703 . 1 1 63 63 GLY N N 15 109.551 0.01 . 1 . . 32 . . 51 GLY N . 18632 1 704 . 1 1 64 64 LYS H H 1 7.392 0.002 . 1 . . 143 . . 52 LYS H . 18632 1 705 . 1 1 64 64 LYS HA H 1 4.186 0.001 . 1 . . 886 . . 52 LYS HA . 18632 1 706 . 1 1 64 64 LYS HB2 H 1 1.091 0.001 . 2 . . 887 . . 52 LYS HB2 . 18632 1 707 . 1 1 64 64 LYS HB3 H 1 1.577 0.001 . 2 . . 888 . . 52 LYS HB3 . 18632 1 708 . 1 1 64 64 LYS HG2 H 1 1.328 0.001 . 1 . . 889 . . 52 LYS HG2 . 18632 1 709 . 1 1 64 64 LYS HG3 H 1 1.328 0.001 . 1 . . 933 . . 52 LYS HG3 . 18632 1 710 . 1 1 64 64 LYS HD2 H 1 1.547 0.001 . 2 . . 1105 . . 52 LYS HD2 . 18632 1 711 . 1 1 64 64 LYS HD3 H 1 1.427 0.001 . 2 . . 1106 . . 52 LYS HD3 . 18632 1 712 . 1 1 64 64 LYS HE2 H 1 2.817 0.001 . 1 . . 1107 . . 52 LYS HE2 . 18632 1 713 . 1 1 64 64 LYS HE3 H 1 2.817 0.001 . 1 . . 1108 . . 52 LYS HE3 . 18632 1 714 . 1 1 64 64 LYS CA C 13 55.090 0.005 . 1 . . 1356 . . 52 LYS CA . 18632 1 715 . 1 1 64 64 LYS CB C 13 32.755 0.005 . 1 . . 1357 . . 52 LYS CB . 18632 1 716 . 1 1 64 64 LYS CG C 13 25.852 0.005 . 1 . . 1103 . . 52 LYS CG . 18632 1 717 . 1 1 64 64 LYS CD C 13 29.477 0.005 . 1 . . 1102 . . 52 LYS CD . 18632 1 718 . 1 1 64 64 LYS CE C 13 42.091 0.005 . 1 . . 1104 . . 52 LYS CE . 18632 1 719 . 1 1 64 64 LYS N N 15 122.381 0.027 . 1 . . 144 . . 52 LYS N . 18632 1 720 . 1 1 65 65 PRO HA H 1 4.194 0.001 . 1 . . 431 . . 53 PRO HA . 18632 1 721 . 1 1 65 65 PRO HB2 H 1 2.136 0.001 . 2 . . 433 . . 53 PRO HB2 . 18632 1 722 . 1 1 65 65 PRO HB3 H 1 1.741 0.001 . 2 . . 432 . . 53 PRO HB3 . 18632 1 723 . 1 1 65 65 PRO HG2 H 1 1.958 0.001 . 1 . . 947 . . 53 PRO HG2 . 18632 1 724 . 1 1 65 65 PRO HG3 H 1 1.958 0.001 . 1 . . 946 . . 53 PRO HG3 . 18632 1 725 . 1 1 65 65 PRO HD2 H 1 3.531 0.001 . 2 . . 948 . . 53 PRO HD2 . 18632 1 726 . 1 1 65 65 PRO HD3 H 1 3.824 0.001 . 2 . . 949 . . 53 PRO HD3 . 18632 1 727 . 1 1 65 65 PRO C C 13 176.509 0.005 . 1 . . 1746 . . 53 PRO C . 18632 1 728 . 1 1 65 65 PRO CA C 13 62.876 0.005 . 1 . . 1354 . . 53 PRO CA . 18632 1 729 . 1 1 65 65 PRO CB C 13 31.932 0.005 . 1 . . 1353 . . 53 PRO CB . 18632 1 730 . 1 1 65 65 PRO CG C 13 27.377 0.005 . 1 . . 950 . . 53 PRO CG . 18632 1 731 . 1 1 65 65 PRO CD C 13 50.811 0.005 . 1 . . 951 . . 53 PRO CD . 18632 1 732 . 1 1 66 66 ASP H H 1 8.418 0.001 . 1 . . 74 . . 54 ASP H . 18632 1 733 . 1 1 66 66 ASP HA H 1 4.129 0.001 . 1 . . 434 . . 54 ASP HA . 18632 1 734 . 1 1 66 66 ASP HB2 H 1 2.865 0.001 . 2 . . 746 . . 54 ASP HB2 . 18632 1 735 . 1 1 66 66 ASP HB3 H 1 2.808 0.001 . 2 . . 435 . . 54 ASP HB3 . 18632 1 736 . 1 1 66 66 ASP C C 13 173.728 0.005 . 1 . . 1747 . . 54 ASP C . 18632 1 737 . 1 1 66 66 ASP CA C 13 55.342 0.005 . 1 . . 1351 . . 54 ASP CA . 18632 1 738 . 1 1 66 66 ASP CB C 13 39.205 0.005 . 1 . . 1352 . . 54 ASP CB . 18632 1 739 . 1 1 66 66 ASP N N 15 116.087 0.008 . 1 . . 75 . . 54 ASP N . 18632 1 740 . 1 1 67 67 ARG H H 1 6.552 0.002 . 1 . . 33 . . 55 ARG H . 18632 1 741 . 1 1 67 67 ARG HA H 1 4.838 0.001 . 1 . . 436 . . 55 ARG HA . 18632 1 742 . 1 1 67 67 ARG HB2 H 1 0.918 0.001 . 2 . . 438 . . 55 ARG HB2 . 18632 1 743 . 1 1 67 67 ARG HB3 H 1 1.008 0.001 . 2 . . 437 . . 55 ARG HB3 . 18632 1 744 . 1 1 67 67 ARG HG2 H 1 1.137 0.001 . 2 . . 1079 . . 55 ARG HG2 . 18632 1 745 . 1 1 67 67 ARG HG3 H 1 1.342 0.001 . 2 . . 1082 . . 55 ARG HG3 . 18632 1 746 . 1 1 67 67 ARG HD2 H 1 2.646 0.001 . 2 . . 1080 . . 55 ARG HD2 . 18632 1 747 . 1 1 67 67 ARG HD3 H 1 2.805 0.001 . 2 . . 1081 . . 55 ARG HD3 . 18632 1 748 . 1 1 67 67 ARG C C 13 175.309 0.005 . 1 . . 1748 . . 55 ARG C . 18632 1 749 . 1 1 67 67 ARG CA C 13 53.631 0.005 . 1 . . 1350 . . 55 ARG CA . 18632 1 750 . 1 1 67 67 ARG CB C 13 33.475 0.005 . 1 . . 1349 . . 55 ARG CB . 18632 1 751 . 1 1 67 67 ARG CG C 13 28.913 0.005 . 1 . . 1078 . . 55 ARG CG . 18632 1 752 . 1 1 67 67 ARG CD C 13 43.125 0.005 . 1 . . 1083 . . 55 ARG CD . 18632 1 753 . 1 1 67 67 ARG N N 15 113.517 0.012 . 1 . . 34 . . 55 ARG N . 18632 1 754 . 1 1 68 68 TYR H H 1 8.694 0.002 . 1 . . 151 . . 56 TYR H . 18632 1 755 . 1 1 68 68 TYR HA H 1 4.391 0.001 . 1 . . 439 . . 56 TYR HA . 18632 1 756 . 1 1 68 68 TYR HB2 H 1 -0.494 0.001 . 2 . . 1237 . . 56 TYR HB2 . 18632 1 757 . 1 1 68 68 TYR HB3 H 1 2.066 0.001 . 2 . . 747 . . 56 TYR HB3 . 18632 1 758 . 1 1 68 68 TYR C C 13 171.854 0.005 . 1 . . 1749 . . 56 TYR C . 18632 1 759 . 1 1 68 68 TYR CA C 13 58.488 0.005 . 1 . . 1507 . . 56 TYR CA . 18632 1 760 . 1 1 68 68 TYR CB C 13 42.326 0.005 . 1 . . 1508 . . 56 TYR CB . 18632 1 761 . 1 1 68 68 TYR N N 15 120.868 0.017 . 1 . . 152 . . 56 TYR N . 18632 1 762 . 1 1 69 69 ASP H H 1 8.255 0.002 . 1 . . 106 . . 57 ASP H . 18632 1 763 . 1 1 69 69 ASP HA H 1 5.732 0.001 . 1 . . 440 . . 57 ASP HA . 18632 1 764 . 1 1 69 69 ASP HB2 H 1 2.768 0.001 . 2 . . 442 . . 57 ASP HB2 . 18632 1 765 . 1 1 69 69 ASP HB3 H 1 2.421 0.001 . 2 . . 441 . . 57 ASP HB3 . 18632 1 766 . 1 1 69 69 ASP C C 13 175.978 0.005 . 1 . . 1750 . . 57 ASP C . 18632 1 767 . 1 1 69 69 ASP CA C 13 51.677 0.005 . 1 . . 1505 . . 57 ASP CA . 18632 1 768 . 1 1 69 69 ASP CB C 13 43.820 0.005 . 1 . . 1504 . . 57 ASP CB . 18632 1 769 . 1 1 69 69 ASP N N 15 112.530 0.02 . 1 . . 107 . . 57 ASP N . 18632 1 770 . 1 1 70 70 MET H H 1 9.487 0.001 . 1 . . 149 . . 58 MET H . 18632 1 771 . 1 1 70 70 MET HA H 1 5.548 0.001 . 1 . . 443 . . 58 MET HA . 18632 1 772 . 1 1 70 70 MET HB2 H 1 2.130 0.001 . 2 . . 444 . . 58 MET HB2 . 18632 1 773 . 1 1 70 70 MET HB3 H 1 1.812 0.001 . 2 . . 751 . . 58 MET HB3 . 18632 1 774 . 1 1 70 70 MET HG2 H 1 1.952 0.001 . 2 . . 445 . . 58 MET HG2 . 18632 1 775 . 1 1 70 70 MET HG3 H 1 1.654 0.001 . 2 . . 752 . . 58 MET HG3 . 18632 1 776 . 1 1 70 70 MET C C 13 174.675 0.005 . 1 . . 1641 . . 58 MET C . 18632 1 777 . 1 1 70 70 MET CA C 13 54.517 0.005 . 1 . . 1501 . . 58 MET CA . 18632 1 778 . 1 1 70 70 MET CB C 13 37.604 0.005 . 1 . . 1500 . . 58 MET CB . 18632 1 779 . 1 1 70 70 MET CG C 13 33.083 0.005 . 1 . . 753 . . 58 MET CG . 18632 1 780 . 1 1 70 70 MET N N 15 119.654 0.023 . 1 . . 150 . . 58 MET N . 18632 1 781 . 1 1 71 71 GLU H H 1 9.024 0.001 . 1 . . 186 . . 59 GLU H . 18632 1 782 . 1 1 71 71 GLU HA H 1 4.802 0.001 . 1 . . 1706 . . 59 GLU HA . 18632 1 783 . 1 1 71 71 GLU HB2 H 1 1.977 0.001 . 2 . . 1182 . . 59 GLU HB2 . 18632 1 784 . 1 1 71 71 GLU HB3 H 1 1.475 0.001 . 2 . . 1705 . . 59 GLU HB3 . 18632 1 785 . 1 1 71 71 GLU HG2 H 1 1.751 0.001 . 1 . . 1183 . . 59 GLU HG2 . 18632 1 786 . 1 1 71 71 GLU HG3 H 1 1.751 0.001 . 1 . . 1184 . . 59 GLU HG3 . 18632 1 787 . 1 1 71 71 GLU C C 13 175.112 0.005 . 1 . . 1642 . . 59 GLU C . 18632 1 788 . 1 1 71 71 GLU CB C 13 34.489 0.005 . 1 . . 1499 . . 59 GLU CB . 18632 1 789 . 1 1 71 71 GLU CG C 13 37.262 0.005 . 1 . . 1181 . . 59 GLU CG . 18632 1 790 . 1 1 71 71 GLU N N 15 123.660 0.007 . 1 . . 187 . . 59 GLU N . 18632 1 791 . 1 1 72 72 ASN H H 1 7.531 0.004 . 1 . . 1502 . . 60 ASN H . 18632 1 792 . 1 1 72 72 ASN HA H 1 5.168 0.001 . 1 . . 446 . . 60 ASN HA . 18632 1 793 . 1 1 72 72 ASN HB2 H 1 3.143 0.001 . 2 . . 448 . . 60 ASN HB2 . 18632 1 794 . 1 1 72 72 ASN HB3 H 1 2.059 0.001 . 2 . . 447 . . 60 ASN HB3 . 18632 1 795 . 1 1 72 72 ASN HD21 H 1 8.427 0.001 . 1 . . 1708 . . 60 ASN HD21 . 18632 1 796 . 1 1 72 72 ASN HD22 H 1 6.362 0.001 . 1 . . 1265 . . 60 ASN HD22 . 18632 1 797 . 1 1 72 72 ASN C C 13 173.907 0.005 . 1 . . 262 . . 60 ASN C . 18632 1 798 . 1 1 72 72 ASN CA C 13 53.121 0.005 . 1 . . 263 . . 60 ASN CA . 18632 1 799 . 1 1 72 72 ASN CB C 13 41.696 0.005 . 1 . . 279 . . 60 ASN CB . 18632 1 800 . 1 1 72 72 ASN N N 15 119.715 0.037 . 1 . . 1503 . . 60 ASN N . 18632 1 801 . 1 1 72 72 ASN ND2 N 15 115.357 0.012 . 1 . . 1266 . . 60 ASN ND2 . 18632 1 802 . 1 1 73 73 LEU H H 1 9.259 0.003 . 1 . . 56 . . 61 LEU H . 18632 1 803 . 1 1 73 73 LEU HA H 1 5.382 0.001 . 1 . . 451 . . 61 LEU HA . 18632 1 804 . 1 1 73 73 LEU HB2 H 1 1.459 0.001 . 2 . . 449 . . 61 LEU HB2 . 18632 1 805 . 1 1 73 73 LEU HB3 H 1 1.809 0.001 . 2 . . 450 . . 61 LEU HB3 . 18632 1 806 . 1 1 73 73 LEU HG H 1 1.468 0.001 . 1 . . 1131 . . 61 LEU HG . 18632 1 807 . 1 1 73 73 LEU HD11 H 1 0.829 0.001 . 2 . . 755 . . 61 LEU HD11 . 18632 1 808 . 1 1 73 73 LEU HD12 H 1 0.829 0.001 . 2 . . 755 . . 61 LEU HD12 . 18632 1 809 . 1 1 73 73 LEU HD13 H 1 0.829 0.001 . 2 . . 755 . . 61 LEU HD13 . 18632 1 810 . 1 1 73 73 LEU HD21 H 1 0.774 0.001 . 2 . . 754 . . 61 LEU HD21 . 18632 1 811 . 1 1 73 73 LEU HD22 H 1 0.774 0.001 . 2 . . 754 . . 61 LEU HD22 . 18632 1 812 . 1 1 73 73 LEU HD23 H 1 0.774 0.001 . 2 . . 754 . . 61 LEU HD23 . 18632 1 813 . 1 1 73 73 LEU C C 13 177.591 0.005 . 1 . . 261 . . 61 LEU C . 18632 1 814 . 1 1 73 73 LEU CA C 13 53.058 0.005 . 1 . . 282 . . 61 LEU CA . 18632 1 815 . 1 1 73 73 LEU CB C 13 41.486 0.005 . 1 . . 281 . . 61 LEU CB . 18632 1 816 . 1 1 73 73 LEU CG C 13 26.932 0.005 . 1 . . 1130 . . 61 LEU CG . 18632 1 817 . 1 1 73 73 LEU CD1 C 13 24.018 0.005 . 2 . . 757 . . 61 LEU CD1 . 18632 1 818 . 1 1 73 73 LEU CD2 C 13 25.882 0.005 . 2 . . 756 . . 61 LEU CD2 . 18632 1 819 . 1 1 73 73 LEU N N 15 123.095 0.021 . 1 . . 57 . . 61 LEU N . 18632 1 820 . 1 1 74 74 THR H H 1 8.698 0.001 . 1 . . 224 . . 62 THR H . 18632 1 821 . 1 1 74 74 THR HA H 1 5.986 0.001 . 1 . . 891 . . 62 THR HA . 18632 1 822 . 1 1 74 74 THR HB H 1 4.579 0.001 . 1 . . 890 . . 62 THR HB . 18632 1 823 . 1 1 74 74 THR HG1 H 1 6.723 0.007 . 1 . . 1291 . . 62 THR HG1 . 18632 1 824 . 1 1 74 74 THR HG21 H 1 1.367 0.002 . 1 . . 892 . . 62 THR HG21 . 18632 1 825 . 1 1 74 74 THR HG22 H 1 1.367 0.002 . 1 . . 892 . . 62 THR HG22 . 18632 1 826 . 1 1 74 74 THR HG23 H 1 1.367 0.002 . 1 . . 892 . . 62 THR HG23 . 18632 1 827 . 1 1 74 74 THR C C 13 175.397 0.005 . 1 . . 270 . . 62 THR C . 18632 1 828 . 1 1 74 74 THR CA C 13 59.415 0.005 . 1 . . 271 . . 62 THR CA . 18632 1 829 . 1 1 74 74 THR CB C 13 72.724 0.005 . 1 . . 280 . . 62 THR CB . 18632 1 830 . 1 1 74 74 THR CG2 C 13 21.835 0.005 . 1 . . 893 . . 62 THR CG2 . 18632 1 831 . 1 1 74 74 THR N N 15 117.475 0.019 . 1 . . 225 . . 62 THR N . 18632 1 832 . 1 1 75 75 THR H H 1 8.021 0.001 . 1 . . 159 . . 63 THR H . 18632 1 833 . 1 1 75 75 THR HA H 1 4.112 0.001 . 1 . . 453 . . 63 THR HA . 18632 1 834 . 1 1 75 75 THR HB H 1 4.370 0.001 . 1 . . 452 . . 63 THR HB . 18632 1 835 . 1 1 75 75 THR HG21 H 1 1.372 0.001 . 1 . . 884 . . 63 THR HG21 . 18632 1 836 . 1 1 75 75 THR HG22 H 1 1.372 0.001 . 1 . . 884 . . 63 THR HG22 . 18632 1 837 . 1 1 75 75 THR HG23 H 1 1.372 0.001 . 1 . . 884 . . 63 THR HG23 . 18632 1 838 . 1 1 75 75 THR C C 13 174.922 0.005 . 1 . . 314 . . 63 THR C . 18632 1 839 . 1 1 75 75 THR CA C 13 64.207 0.005 . 1 . . 303 . . 63 THR CA . 18632 1 840 . 1 1 75 75 THR CB C 13 68.623 0.005 . 1 . . 283 . . 63 THR CB . 18632 1 841 . 1 1 75 75 THR CG2 C 13 23.194 0.005 . 1 . . 885 . . 63 THR CG2 . 18632 1 842 . 1 1 75 75 THR N N 15 109.197 0.014 . 1 . . 160 . . 63 THR N . 18632 1 843 . 1 1 76 76 LYS H H 1 7.563 0.003 . 1 . . 41 . . 64 LYS H . 18632 1 844 . 1 1 76 76 LYS HA H 1 4.526 0.001 . 1 . . 454 . . 64 LYS HA . 18632 1 845 . 1 1 76 76 LYS HB2 H 1 1.435 0.001 . 2 . . 455 . . 64 LYS HB2 . 18632 1 846 . 1 1 76 76 LYS HB3 H 1 1.710 0.001 . 2 . . 456 . . 64 LYS HB3 . 18632 1 847 . 1 1 76 76 LYS HG2 H 1 1.263 0.001 . 1 . . 759 . . 64 LYS HG2 . 18632 1 848 . 1 1 76 76 LYS HG3 H 1 1.263 0.001 . 1 . . 758 . . 64 LYS HG3 . 18632 1 849 . 1 1 76 76 LYS HD2 H 1 1.606 0.001 . 1 . . 764 . . 64 LYS HD2 . 18632 1 850 . 1 1 76 76 LYS HD3 H 1 1.606 0.001 . 1 . . 763 . . 64 LYS HD3 . 18632 1 851 . 1 1 76 76 LYS HE2 H 1 2.818 0.001 . 2 . . 761 . . 64 LYS HE2 . 18632 1 852 . 1 1 76 76 LYS HE3 H 1 2.970 0.001 . 2 . . 762 . . 64 LYS HE3 . 18632 1 853 . 1 1 76 76 LYS C C 13 175.371 0.005 . 1 . . 1751 . . 64 LYS C . 18632 1 854 . 1 1 76 76 LYS CA C 13 55.037 0.005 . 1 . . 1681 . . 64 LYS CA . 18632 1 855 . 1 1 76 76 LYS CB C 13 34.780 0.005 . 1 . . 1682 . . 64 LYS CB . 18632 1 856 . 1 1 76 76 LYS CG C 13 23.848 0.005 . 1 . . 760 . . 64 LYS CG . 18632 1 857 . 1 1 76 76 LYS CD C 13 27.669 0.005 . 1 . . 1109 . . 64 LYS CD . 18632 1 858 . 1 1 76 76 LYS CE C 13 41.821 0.005 . 1 . . 1110 . . 64 LYS CE . 18632 1 859 . 1 1 76 76 LYS N N 15 117.278 0.012 . 1 . . 42 . . 64 LYS N . 18632 1 860 . 1 1 77 77 LYS H H 1 7.005 0.002 . 1 . . 1506 . . 65 LYS H . 18632 1 861 . 1 1 77 77 LYS HA H 1 4.307 0.001 . 1 . . 457 . . 65 LYS HA . 18632 1 862 . 1 1 77 77 LYS HB2 H 1 1.448 0.001 . 2 . . 458 . . 65 LYS HB2 . 18632 1 863 . 1 1 77 77 LYS HB3 H 1 1.991 0.001 . 2 . . 459 . . 65 LYS HB3 . 18632 1 864 . 1 1 77 77 LYS HG2 H 1 1.272 0.001 . 2 . . 1115 . . 65 LYS HG2 . 18632 1 865 . 1 1 77 77 LYS HG3 H 1 1.695 0.001 . 2 . . 1113 . . 65 LYS HG3 . 18632 1 866 . 1 1 77 77 LYS HD2 H 1 1.634 0.001 . 2 . . 1185 . . 65 LYS HD2 . 18632 1 867 . 1 1 77 77 LYS HD3 H 1 1.821 0.001 . 2 . . 1116 . . 65 LYS HD3 . 18632 1 868 . 1 1 77 77 LYS HE2 H 1 2.997 0.001 . 2 . . 1186 . . 65 LYS HE2 . 18632 1 869 . 1 1 77 77 LYS HE3 H 1 2.808 0.001 . 2 . . 1187 . . 65 LYS HE3 . 18632 1 870 . 1 1 77 77 LYS C C 13 173.428 0.005 . 1 . . 1753 . . 65 LYS C . 18632 1 871 . 1 1 77 77 LYS CA C 13 56.551 0.005 . 1 . . 1498 . . 65 LYS CA . 18632 1 872 . 1 1 77 77 LYS CB C 13 34.791 0.005 . 1 . . 1497 . . 65 LYS CB . 18632 1 873 . 1 1 77 77 LYS CG C 13 24.776 0.005 . 1 . . 1111 . . 65 LYS CG . 18632 1 874 . 1 1 77 77 LYS CD C 13 29.107 0.005 . 1 . . 1114 . . 65 LYS CD . 18632 1 875 . 1 1 77 77 LYS CE C 13 42.622 0.005 . 1 . . 1112 . . 65 LYS CE . 18632 1 876 . 1 1 77 77 LYS N N 15 119.682 0.014 . 1 . . 29 . . 65 LYS N . 18632 1 877 . 1 1 78 78 ASP H H 1 8.591 0.001 . 1 . . 248 . . 66 ASP H . 18632 1 878 . 1 1 78 78 ASP HA H 1 5.978 0.001 . 1 . . 460 . . 66 ASP HA . 18632 1 879 . 1 1 78 78 ASP HB2 H 1 2.446 0.001 . 2 . . 461 . . 66 ASP HB2 . 18632 1 880 . 1 1 78 78 ASP HB3 H 1 2.877 0.001 . 2 . . 462 . . 66 ASP HB3 . 18632 1 881 . 1 1 78 78 ASP C C 13 177.085 0.005 . 1 . . 1752 . . 66 ASP C . 18632 1 882 . 1 1 78 78 ASP CA C 13 52.795 0.005 . 1 . . 1496 . . 66 ASP CA . 18632 1 883 . 1 1 78 78 ASP CB C 13 43.824 0.005 . 1 . . 1495 . . 66 ASP CB . 18632 1 884 . 1 1 78 78 ASP N N 15 127.254 0.009 . 1 . . 249 . . 66 ASP N . 18632 1 885 . 1 1 79 79 THR H H 1 9.401 0.003 . 1 . . 1493 . . 67 THR H . 18632 1 886 . 1 1 79 79 THR HA H 1 4.484 0.001 . 1 . . 895 . . 67 THR HA . 18632 1 887 . 1 1 79 79 THR HB H 1 4.029 0.001 . 1 . . 894 . . 67 THR HB . 18632 1 888 . 1 1 79 79 THR HG1 H 1 4.285 0.001 . 1 . . 1714 . . 67 THR HG1 . 18632 1 889 . 1 1 79 79 THR HG21 H 1 1.007 0.001 . 1 . . 896 . . 67 THR HG21 . 18632 1 890 . 1 1 79 79 THR HG22 H 1 1.007 0.001 . 1 . . 896 . . 67 THR HG22 . 18632 1 891 . 1 1 79 79 THR HG23 H 1 1.007 0.001 . 1 . . 896 . . 67 THR HG23 . 18632 1 892 . 1 1 79 79 THR C C 13 174.266 0.005 . 1 . . 1754 . . 67 THR C . 18632 1 893 . 1 1 79 79 THR CA C 13 60.558 0.005 . 1 . . 1491 . . 67 THR CA . 18632 1 894 . 1 1 79 79 THR CB C 13 71.462 0.005 . 1 . . 1492 . . 67 THR CB . 18632 1 895 . 1 1 79 79 THR CG2 C 13 22.057 0.005 . 1 . . 897 . . 67 THR CG2 . 18632 1 896 . 1 1 79 79 THR N N 15 110.570 0.009 . 1 . . 1494 . . 67 THR N . 18632 1 897 . 1 1 80 80 HIS H H 1 8.065 0.003 . 1 . . 1489 . . 68 HIS H . 18632 1 898 . 1 1 80 80 HIS HA H 1 4.921 0.001 . 1 . . 463 . . 68 HIS HA . 18632 1 899 . 1 1 80 80 HIS HB3 H 1 3.052 0.001 . 1 . . 464 . . 68 HIS HB3 . 18632 1 900 . 1 1 80 80 HIS HD2 H 1 6.502 0.001 . 1 . . 1005 . . 68 HIS HD2 . 18632 1 901 . 1 1 80 80 HIS C C 13 172.623 0.005 . 1 . . 1755 . . 68 HIS C . 18632 1 902 . 1 1 80 80 HIS CA C 13 54.132 0.005 . 1 . . 1487 . . 68 HIS CA . 18632 1 903 . 1 1 80 80 HIS CB C 13 30.946 0.005 . 1 . . 1488 . . 68 HIS CB . 18632 1 904 . 1 1 80 80 HIS CD2 C 13 121.960 0.005 . 1 . . 1048 . . 68 HIS CD2 . 18632 1 905 . 1 1 80 80 HIS N N 15 121.346 0.028 . 1 . . 1490 . . 68 HIS N . 18632 1 906 . 1 1 81 81 HIS H H 1 9.426 0.004 . 1 . . 1485 . . 69 HIS H . 18632 1 907 . 1 1 81 81 HIS HA H 1 5.410 0.001 . 1 . . 465 . . 69 HIS HA . 18632 1 908 . 1 1 81 81 HIS HB2 H 1 3.545 0.001 . 2 . . 765 . . 69 HIS HB2 . 18632 1 909 . 1 1 81 81 HIS HB3 H 1 3.395 0.001 . 2 . . 466 . . 69 HIS HB3 . 18632 1 910 . 1 1 81 81 HIS HD1 H 1 13.445 0.004 . 1 . . 96 . . 69 HIS HD1 . 18632 1 911 . 1 1 81 81 HIS HD2 H 1 7.351 0.001 . 1 . . 1051 . . 69 HIS HD2 . 18632 1 912 . 1 1 81 81 HIS HE1 H 1 7.937 0.001 . 1 . . 1174 . . 69 HIS HE1 . 18632 1 913 . 1 1 81 81 HIS C C 13 174.997 0.005 . 1 . . 1756 . . 69 HIS C . 18632 1 914 . 1 1 81 81 HIS CA C 13 53.599 0.005 . 1 . . 1484 . . 69 HIS CA . 18632 1 915 . 1 1 81 81 HIS CB C 13 29.876 0.005 . 1 . . 1483 . . 69 HIS CB . 18632 1 916 . 1 1 81 81 HIS CD2 C 13 130.227 0.005 . 1 . . 1052 . . 69 HIS CD2 . 18632 1 917 . 1 1 81 81 HIS CE1 C 13 140.544 0.005 . 1 . . 1175 . . 69 HIS CE1 . 18632 1 918 . 1 1 81 81 HIS N N 15 125.696 0.044 . 1 . . 1486 . . 69 HIS N . 18632 1 919 . 1 1 81 81 HIS ND1 N 15 169.021 0.066 . 1 . . 97 . . 69 HIS ND1 . 18632 1 920 . 1 1 82 82 LYS H H 1 9.083 0.001 . 1 . . 250 . . 70 LYS H . 18632 1 921 . 1 1 82 82 LYS HA H 1 5.096 0.001 . 1 . . 467 . . 70 LYS HA . 18632 1 922 . 1 1 82 82 LYS HB3 H 1 1.539 0.001 . 1 . . 468 . . 70 LYS HB3 . 18632 1 923 . 1 1 82 82 LYS HG2 H 1 1.042 0.001 . 1 . . 766 . . 70 LYS HG2 . 18632 1 924 . 1 1 82 82 LYS HD3 H 1 1.390 0.001 . 1 . . 770 . . 70 LYS HD3 . 18632 1 925 . 1 1 82 82 LYS HE3 H 1 2.472 0.001 . 1 . . 768 . . 70 LYS HE3 . 18632 1 926 . 1 1 82 82 LYS C C 13 176.003 0.005 . 1 . . 1757 . . 70 LYS C . 18632 1 927 . 1 1 82 82 LYS CA C 13 55.452 0.005 . 1 . . 1482 . . 70 LYS CA . 18632 1 928 . 1 1 82 82 LYS CB C 13 35.487 0.005 . 1 . . 1481 . . 70 LYS CB . 18632 1 929 . 1 1 82 82 LYS CG C 13 24.834 0.005 . 1 . . 767 . . 70 LYS CG . 18632 1 930 . 1 1 82 82 LYS CD C 13 29.192 0.005 . 1 . . 771 . . 70 LYS CD . 18632 1 931 . 1 1 82 82 LYS CE C 13 41.372 0.005 . 1 . . 769 . . 70 LYS CE . 18632 1 932 . 1 1 82 82 LYS N N 15 125.666 0.02 . 1 . . 251 . . 70 LYS N . 18632 1 933 . 1 1 83 83 ASP H H 1 8.981 0.002 . 1 . . 52 . . 71 ASP H . 18632 1 934 . 1 1 83 83 ASP HA H 1 3.894 0.001 . 1 . . 469 . . 71 ASP HA . 18632 1 935 . 1 1 83 83 ASP HB2 H 1 3.009 0.001 . 2 . . 471 . . 71 ASP HB2 . 18632 1 936 . 1 1 83 83 ASP HB3 H 1 2.557 0.001 . 2 . . 470 . . 71 ASP HB3 . 18632 1 937 . 1 1 83 83 ASP C C 13 175.273 0.005 . 1 . . 1758 . . 71 ASP C . 18632 1 938 . 1 1 83 83 ASP CA C 13 55.776 0.005 . 1 . . 1480 . . 71 ASP CA . 18632 1 939 . 1 1 83 83 ASP CB C 13 39.929 0.005 . 1 . . 1479 . . 71 ASP CB . 18632 1 940 . 1 1 83 83 ASP N N 15 121.242 0.024 . 1 . . 53 . . 71 ASP N . 18632 1 941 . 1 1 84 84 TRP H H 1 8.857 0.003 . 1 . . 123 . . 72 TRP H . 18632 1 942 . 1 1 84 84 TRP HA H 1 5.046 0.008 . 1 . . 472 . . 72 TRP HA . 18632 1 943 . 1 1 84 84 TRP HB2 H 1 3.730 0.001 . 2 . . 474 . . 72 TRP HB2 . 18632 1 944 . 1 1 84 84 TRP HB3 H 1 2.328 0.001 . 2 . . 473 . . 72 TRP HB3 . 18632 1 945 . 1 1 84 84 TRP HD1 H 1 6.364 0.001 . 1 . . 990 . . 72 TRP HD1 . 18632 1 946 . 1 1 84 84 TRP HE1 H 1 7.958 0.002 . 1 . . 1004 . . 72 TRP HE1 . 18632 1 947 . 1 1 84 84 TRP HZ2 H 1 6.513 0.001 . 1 . . 1008 . . 72 TRP HZ2 . 18632 1 948 . 1 1 84 84 TRP HZ3 H 1 6.186 0.001 . 1 . . 1044 . . 72 TRP HZ3 . 18632 1 949 . 1 1 84 84 TRP C C 13 175.483 0.005 . 1 . . 1759 . . 72 TRP C . 18632 1 950 . 1 1 84 84 TRP CA C 13 54.330 0.005 . 1 . . 1477 . . 72 TRP CA . 18632 1 951 . 1 1 84 84 TRP CB C 13 32.443 0.005 . 1 . . 1478 . . 72 TRP CB . 18632 1 952 . 1 1 84 84 TRP CD1 C 13 127.909 0.005 . 1 . . 1003 . . 72 TRP CD1 . 18632 1 953 . 1 1 84 84 TRP CZ2 C 13 112.955 0.005 . 1 . . 1007 . . 72 TRP CZ2 . 18632 1 954 . 1 1 84 84 TRP CZ3 C 13 122.381 0.005 . 1 . . 1045 . . 72 TRP CZ3 . 18632 1 955 . 1 1 84 84 TRP N N 15 118.909 0.012 . 1 . . 214 . . 72 TRP N . 18632 1 956 . 1 1 84 84 TRP NE1 N 15 123.640 0.016 . 1 . . 124 . . 72 TRP NE1 . 18632 1 957 . 1 1 85 85 ALA H H 1 9.102 0.002 . 1 . . 84 . . 73 ALA H . 18632 1 958 . 1 1 85 85 ALA HA H 1 5.213 0.001 . 1 . . 1828 . . 73 ALA HA . 18632 1 959 . 1 1 85 85 ALA HB1 H 1 1.476 0.001 . 1 . . 1829 . . 73 ALA HB1 . 18632 1 960 . 1 1 85 85 ALA HB2 H 1 1.476 0.001 . 1 . . 1829 . . 73 ALA HB2 . 18632 1 961 . 1 1 85 85 ALA HB3 H 1 1.476 0.001 . 1 . . 1829 . . 73 ALA HB3 . 18632 1 962 . 1 1 85 85 ALA C C 13 179.283 0.005 . 1 . . 1760 . . 73 ALA C . 18632 1 963 . 1 1 85 85 ALA CA C 13 49.416 0.005 . 1 . . 1475 . . 73 ALA CA . 18632 1 964 . 1 1 85 85 ALA CB C 13 22.314 0.005 . 1 . . 1476 . . 73 ALA CB . 18632 1 965 . 1 1 85 85 ALA N N 15 120.645 0.024 . 1 . . 85 . . 73 ALA N . 18632 1 966 . 1 1 86 86 LEU H H 1 9.643 0.001 . 1 . . 21 . . 74 LEU H . 18632 1 967 . 1 1 86 86 LEU HA H 1 4.632 0.001 . 1 . . 1830 . . 74 LEU HA . 18632 1 968 . 1 1 86 86 LEU HB2 H 1 1.897 0.001 . 2 . . 476 . . 74 LEU HB2 . 18632 1 969 . 1 1 86 86 LEU HB3 H 1 1.549 0.001 . 2 . . 475 . . 74 LEU HB3 . 18632 1 970 . 1 1 86 86 LEU HG H 1 1.902 0.001 . 1 . . 1135 . . 74 LEU HG . 18632 1 971 . 1 1 86 86 LEU HD11 H 1 0.730 0.001 . 2 . . 1061 . . 74 LEU HD11 . 18632 1 972 . 1 1 86 86 LEU HD12 H 1 0.730 0.001 . 2 . . 1061 . . 74 LEU HD12 . 18632 1 973 . 1 1 86 86 LEU HD13 H 1 0.730 0.001 . 2 . . 1061 . . 74 LEU HD13 . 18632 1 974 . 1 1 86 86 LEU HD21 H 1 0.792 0.001 . 2 . . 1133 . . 74 LEU HD21 . 18632 1 975 . 1 1 86 86 LEU HD22 H 1 0.792 0.001 . 2 . . 1133 . . 74 LEU HD22 . 18632 1 976 . 1 1 86 86 LEU HD23 H 1 0.792 0.001 . 2 . . 1133 . . 74 LEU HD23 . 18632 1 977 . 1 1 86 86 LEU C C 13 178.751 0.005 . 1 . . 1761 . . 74 LEU C . 18632 1 978 . 1 1 86 86 LEU CA C 13 56.040 0.005 . 1 . . 1474 . . 74 LEU CA . 18632 1 979 . 1 1 86 86 LEU CB C 13 41.243 0.005 . 1 . . 1473 . . 74 LEU CB . 18632 1 980 . 1 1 86 86 LEU CG C 13 27.439 0.005 . 1 . . 1134 . . 74 LEU CG . 18632 1 981 . 1 1 86 86 LEU CD1 C 13 26.041 0.005 . 2 . . 1062 . . 74 LEU CD1 . 18632 1 982 . 1 1 86 86 LEU CD2 C 13 24.055 0.005 . 2 . . 1132 . . 74 LEU CD2 . 18632 1 983 . 1 1 86 86 LEU N N 15 124.498 0.019 . 1 . . 22 . . 74 LEU N . 18632 1 984 . 1 1 87 87 GLY H H 1 10.061 0.002 . 1 . . 230 . . 75 GLY H . 18632 1 985 . 1 1 87 87 GLY HA2 H 1 3.507 0.001 . 2 . . 477 . . 75 GLY HA2 . 18632 1 986 . 1 1 87 87 GLY HA3 H 1 4.236 0.001 . 2 . . 478 . . 75 GLY HA3 . 18632 1 987 . 1 1 87 87 GLY C C 13 172.904 0.005 . 1 . . 1762 . . 75 GLY C . 18632 1 988 . 1 1 87 87 GLY CA C 13 45.471 0.005 . 1 . . 1472 . . 75 GLY CA . 18632 1 989 . 1 1 87 87 GLY N N 15 110.765 0.024 . 1 . . 231 . . 75 GLY N . 18632 1 990 . 1 1 88 88 GLU H H 1 7.835 0.001 . 1 . . 58 . . 76 GLU H . 18632 1 991 . 1 1 88 88 GLU HA H 1 4.777 0.001 . 1 . . 617 . . 76 GLU HA . 18632 1 992 . 1 1 88 88 GLU HB2 H 1 1.962 0.001 . 2 . . 618 . . 76 GLU HB2 . 18632 1 993 . 1 1 88 88 GLU HB3 H 1 2.571 0.001 . 2 . . 619 . . 76 GLU HB3 . 18632 1 994 . 1 1 88 88 GLU HG2 H 1 2.346 0.001 . 2 . . 956 . . 76 GLU HG2 . 18632 1 995 . 1 1 88 88 GLU HG3 H 1 2.200 0.001 . 2 . . 957 . . 76 GLU HG3 . 18632 1 996 . 1 1 88 88 GLU C C 13 174.965 0.005 . 1 . . 1763 . . 76 GLU C . 18632 1 997 . 1 1 88 88 GLU CA C 13 55.181 0.005 . 1 . . 1471 . . 76 GLU CA . 18632 1 998 . 1 1 88 88 GLU CB C 13 32.129 0.005 . 1 . . 1470 . . 76 GLU CB . 18632 1 999 . 1 1 88 88 GLU CG C 13 36.941 0.005 . 1 . . 958 . . 76 GLU CG . 18632 1 1000 . 1 1 88 88 GLU N N 15 121.281 0.009 . 1 . . 59 . . 76 GLU N . 18632 1 1001 . 1 1 89 89 GLU H H 1 8.882 0.001 . 1 . . 139 . . 77 GLU H . 18632 1 1002 . 1 1 89 89 GLU HA H 1 4.742 0.001 . 1 . . 479 . . 77 GLU HA . 18632 1 1003 . 1 1 89 89 GLU HB2 H 1 1.841 0.001 . 2 . . 1655 . . 77 GLU HB2 . 18632 1 1004 . 1 1 89 89 GLU HB3 H 1 1.906 0.001 . 2 . . 1656 . . 77 GLU HB3 . 18632 1 1005 . 1 1 89 89 GLU HG2 H 1 1.850 0.001 . 2 . . 952 . . 77 GLU HG2 . 18632 1 1006 . 1 1 89 89 GLU HG3 H 1 1.721 0.001 . 2 . . 1189 . . 77 GLU HG3 . 18632 1 1007 . 1 1 89 89 GLU C C 13 175.396 0.005 . 1 . . 1764 . . 77 GLU C . 18632 1 1008 . 1 1 89 89 GLU CA C 13 57.359 0.005 . 1 . . 1468 . . 77 GLU CA . 18632 1 1009 . 1 1 89 89 GLU CB C 13 31.936 0.005 . 1 . . 1469 . . 77 GLU CB . 18632 1 1010 . 1 1 89 89 GLU CG C 13 37.860 0.005 . 1 . . 1188 . . 77 GLU CG . 18632 1 1011 . 1 1 89 89 GLU N N 15 134.415 0.025 . 1 . . 140 . . 77 GLU N . 18632 1 1012 . 1 1 90 90 PHE H H 1 8.991 0.001 . 1 . . 171 . . 78 PHE H . 18632 1 1013 . 1 1 90 90 PHE HA H 1 5.112 0.001 . 1 . . 1822 . . 78 PHE HA . 18632 1 1014 . 1 1 90 90 PHE HB2 H 1 3.239 0.001 . 1 . . 480 . . 78 PHE HB2 . 18632 1 1015 . 1 1 90 90 PHE HB3 H 1 3.239 0.001 . 1 . . 1823 . . 78 PHE HB3 . 18632 1 1016 . 1 1 90 90 PHE HD1 H 1 7.341 0.001 . 3 . . 983 . . 78 PHE HD1 . 18632 1 1017 . 1 1 90 90 PHE HD2 H 1 7.341 0.001 . 3 . . 983 . . 78 PHE HD2 . 18632 1 1018 . 1 1 90 90 PHE HE1 H 1 7.050 0.004 . 3 . . 1163 . . 78 PHE HE1 . 18632 1 1019 . 1 1 90 90 PHE HE2 H 1 7.050 0.004 . 3 . . 1163 . . 78 PHE HE2 . 18632 1 1020 . 1 1 90 90 PHE HZ H 1 6.617 0.001 . 1 . . 1034 . . 78 PHE HZ . 18632 1 1021 . 1 1 90 90 PHE C C 13 171.418 0.005 . 1 . . 1699 . . 78 PHE C . 18632 1 1022 . 1 1 90 90 PHE CA C 13 55.677 0.005 . 1 . . 1466 . . 78 PHE CA . 18632 1 1023 . 1 1 90 90 PHE CB C 13 41.852 0.005 . 1 . . 1467 . . 78 PHE CB . 18632 1 1024 . 1 1 90 90 PHE CD1 C 13 133.305 0.048 . 3 . . 1033 . . 78 PHE CD1 . 18632 1 1025 . 1 1 90 90 PHE CD2 C 13 133.305 0.048 . 3 . . 1033 . . 78 PHE CD2 . 18632 1 1026 . 1 1 90 90 PHE CE1 C 13 130.590 0.002 . 3 . . 1162 . . 78 PHE CE1 . 18632 1 1027 . 1 1 90 90 PHE CE2 C 13 130.590 0.002 . 3 . . 1162 . . 78 PHE CE2 . 18632 1 1028 . 1 1 90 90 PHE CZ C 13 128.485 0.005 . 1 . . 1035 . . 78 PHE CZ . 18632 1 1029 . 1 1 90 90 PHE N N 15 125.037 0.006 . 1 . . 172 . . 78 PHE N . 18632 1 1030 . 1 1 91 91 GLN H H 1 8.805 0.003 . 1 . . 45 . . 79 GLN H . 18632 1 1031 . 1 1 91 91 GLN HA H 1 5.500 0.001 . 1 . . 481 . . 79 GLN HA . 18632 1 1032 . 1 1 91 91 GLN HB2 H 1 1.904 0.001 . 2 . . 1190 . . 79 GLN HB2 . 18632 1 1033 . 1 1 91 91 GLN HB3 H 1 1.959 0.001 . 2 . . 1191 . . 79 GLN HB3 . 18632 1 1034 . 1 1 91 91 GLN HG2 H 1 1.971 0.001 . 2 . . 748 . . 79 GLN HG2 . 18632 1 1035 . 1 1 91 91 GLN HG3 H 1 2.466 0.001 . 2 . . 750 . . 79 GLN HG3 . 18632 1 1036 . 1 1 91 91 GLN HE21 H 1 6.883 0.001 . 1 . . 15 . . 79 GLN HE21 . 18632 1 1037 . 1 1 91 91 GLN HE22 H 1 8.040 0.001 . 1 . . 13 . . 79 GLN HE22 . 18632 1 1038 . 1 1 91 91 GLN C C 13 175.296 0.005 . 1 . . 1700 . . 79 GLN C . 18632 1 1039 . 1 1 91 91 GLN CA C 13 53.912 0.005 . 1 . . 1464 . . 79 GLN CA . 18632 1 1040 . 1 1 91 91 GLN CB C 13 31.132 0.005 . 1 . . 1465 . . 79 GLN CB . 18632 1 1041 . 1 1 91 91 GLN CG C 13 34.456 0.005 . 1 . . 749 . . 79 GLN CG . 18632 1 1042 . 1 1 91 91 GLN N N 15 121.094 0.022 . 1 . . 46 . . 79 GLN N . 18632 1 1043 . 1 1 91 91 GLN NE2 N 15 112.683 0.007 . 1 . . 14 . . 79 GLN NE2 . 18632 1 1044 . 1 1 92 92 ASP H H 1 9.093 0.002 . 1 . . 1463 . . 80 ASP H . 18632 1 1045 . 1 1 92 92 ASP HA H 1 5.173 0.001 . 1 . . 482 . . 80 ASP HA . 18632 1 1046 . 1 1 92 92 ASP HB2 H 1 2.601 0.001 . 2 . . 483 . . 80 ASP HB2 . 18632 1 1047 . 1 1 92 92 ASP HB3 H 1 3.237 0.001 . 2 . . 484 . . 80 ASP HB3 . 18632 1 1048 . 1 1 92 92 ASP C C 13 173.627 0.005 . 1 . . 1765 . . 80 ASP C . 18632 1 1049 . 1 1 92 92 ASP CA C 13 52.715 0.005 . 1 . . 1460 . . 80 ASP CA . 18632 1 1050 . 1 1 92 92 ASP CB C 13 45.771 0.005 . 1 . . 1461 . . 80 ASP CB . 18632 1 1051 . 1 1 92 92 ASP N N 15 124.053 0.011 . 1 . . 1462 . . 80 ASP N . 18632 1 1052 . 1 1 93 93 GLU H H 1 8.352 0.002 . 1 . . 49 . . 81 GLU H . 18632 1 1053 . 1 1 93 93 GLU HA H 1 4.355 0.001 . 1 . . 1824 . . 81 GLU HA . 18632 1 1054 . 1 1 93 93 GLU HB2 H 1 1.907 0.001 . 1 . . 485 . . 81 GLU HB2 . 18632 1 1055 . 1 1 93 93 GLU HB3 H 1 1.907 0.001 . 1 . . 1825 . . 81 GLU HB3 . 18632 1 1056 . 1 1 93 93 GLU HG2 H 1 1.958 0.001 . 2 . . 954 . . 81 GLU HG2 . 18632 1 1057 . 1 1 93 93 GLU HG3 H 1 2.551 0.001 . 2 . . 953 . . 81 GLU HG3 . 18632 1 1058 . 1 1 93 93 GLU C C 13 175.017 0.005 . 1 . . 1766 . . 81 GLU C . 18632 1 1059 . 1 1 93 93 GLU CA C 13 56.489 0.005 . 1 . . 1459 . . 81 GLU CA . 18632 1 1060 . 1 1 93 93 GLU CB C 13 30.587 0.005 . 1 . . 1458 . . 81 GLU CB . 18632 1 1061 . 1 1 93 93 GLU CG C 13 36.955 0.005 . 1 . . 955 . . 81 GLU CG . 18632 1 1062 . 1 1 93 93 GLU N N 15 121.377 0.048 . 1 . . 50 . . 81 GLU N . 18632 1 1063 . 1 1 94 94 ALA H H 1 8.209 0.001 . 1 . . 135 . . 82 ALA H . 18632 1 1064 . 1 1 94 94 ALA HA H 1 4.665 0.001 . 1 . . 1827 . . 82 ALA HA . 18632 1 1065 . 1 1 94 94 ALA HB1 H 1 0.821 0.001 . 1 . . 1826 . . 82 ALA HB1 . 18632 1 1066 . 1 1 94 94 ALA HB2 H 1 0.821 0.001 . 1 . . 1826 . . 82 ALA HB2 . 18632 1 1067 . 1 1 94 94 ALA HB3 H 1 0.821 0.001 . 1 . . 1826 . . 82 ALA HB3 . 18632 1 1068 . 1 1 94 94 ALA C C 13 178.561 0.005 . 1 . . 1767 . . 82 ALA C . 18632 1 1069 . 1 1 94 94 ALA CA C 13 50.483 0.005 . 1 . . 1456 . . 82 ALA CA . 18632 1 1070 . 1 1 94 94 ALA CB C 13 19.803 0.005 . 1 . . 1457 . . 82 ALA CB . 18632 1 1071 . 1 1 94 94 ALA N N 15 129.753 0.012 . 1 . . 136 . . 82 ALA N . 18632 1 1072 . 1 1 95 95 LEU H H 1 9.231 0.002 . 1 . . 1454 . . 83 LEU H . 18632 1 1073 . 1 1 95 95 LEU HA H 1 3.642 0.001 . 1 . . 486 . . 83 LEU HA . 18632 1 1074 . 1 1 95 95 LEU HB2 H 1 1.723 0.001 . 2 . . 784 . . 83 LEU HB2 . 18632 1 1075 . 1 1 95 95 LEU HB3 H 1 1.240 0.001 . 2 . . 487 . . 83 LEU HB3 . 18632 1 1076 . 1 1 95 95 LEU HG H 1 1.819 0.001 . 1 . . 1151 . . 83 LEU HG . 18632 1 1077 . 1 1 95 95 LEU HD11 H 1 0.808 0.001 . 2 . . 1147 . . 83 LEU HD11 . 18632 1 1078 . 1 1 95 95 LEU HD12 H 1 0.808 0.001 . 2 . . 1147 . . 83 LEU HD12 . 18632 1 1079 . 1 1 95 95 LEU HD13 H 1 0.808 0.001 . 2 . . 1147 . . 83 LEU HD13 . 18632 1 1080 . 1 1 95 95 LEU HD21 H 1 0.818 0.001 . 2 . . 783 . . 83 LEU HD21 . 18632 1 1081 . 1 1 95 95 LEU HD22 H 1 0.818 0.001 . 2 . . 783 . . 83 LEU HD22 . 18632 1 1082 . 1 1 95 95 LEU HD23 H 1 0.818 0.001 . 2 . . 783 . . 83 LEU HD23 . 18632 1 1083 . 1 1 95 95 LEU C C 13 176.088 0.005 . 1 . . 1768 . . 83 LEU C . 18632 1 1084 . 1 1 95 95 LEU CA C 13 57.528 0.005 . 1 . . 1453 . . 83 LEU CA . 18632 1 1085 . 1 1 95 95 LEU CB C 13 42.741 0.005 . 1 . . 1452 . . 83 LEU CB . 18632 1 1086 . 1 1 95 95 LEU CG C 13 27.413 0.005 . 1 . . 1150 . . 83 LEU CG . 18632 1 1087 . 1 1 95 95 LEU CD1 C 13 24.832 0.005 . 2 . . 1148 . . 83 LEU CD1 . 18632 1 1088 . 1 1 95 95 LEU CD2 C 13 26.107 0.005 . 2 . . 1149 . . 83 LEU CD2 . 18632 1 1089 . 1 1 95 95 LEU N N 15 120.582 0.031 . 1 . . 1455 . . 83 LEU N . 18632 1 1090 . 1 1 96 96 ASP H H 1 7.126 0.001 . 1 . . 1450 . . 84 ASP H . 18632 1 1091 . 1 1 96 96 ASP HA H 1 4.212 0.001 . 1 . . 488 . . 84 ASP HA . 18632 1 1092 . 1 1 96 96 ASP HB2 H 1 2.493 0.001 . 2 . . 489 . . 84 ASP HB2 . 18632 1 1093 . 1 1 96 96 ASP HB3 H 1 3.157 0.001 . 2 . . 490 . . 84 ASP HB3 . 18632 1 1094 . 1 1 96 96 ASP C C 13 176.346 0.005 . 1 . . 1769 . . 84 ASP C . 18632 1 1095 . 1 1 96 96 ASP CA C 13 53.394 0.005 . 1 . . 1449 . . 84 ASP CA . 18632 1 1096 . 1 1 96 96 ASP CB C 13 39.725 0.005 . 1 . . 1448 . . 84 ASP CB . 18632 1 1097 . 1 1 96 96 ASP N N 15 113.328 0.013 . 1 . . 1451 . . 84 ASP N . 18632 1 1098 . 1 1 97 97 SER H H 1 8.293 0.002 . 1 . . 194 . . 85 SER H . 18632 1 1099 . 1 1 97 97 SER HA H 1 4.254 0.001 . 1 . . 491 . . 85 SER HA . 18632 1 1100 . 1 1 97 97 SER HB2 H 1 4.119 0.001 . 2 . . 1194 . . 85 SER HB2 . 18632 1 1101 . 1 1 97 97 SER HB3 H 1 4.413 0.001 . 2 . . 1192 . . 85 SER HB3 . 18632 1 1102 . 1 1 97 97 SER C C 13 173.228 0.005 . 1 . . 1770 . . 85 SER C . 18632 1 1103 . 1 1 97 97 SER CA C 13 60.956 0.005 . 1 . . 1680 . . 85 SER CA . 18632 1 1104 . 1 1 97 97 SER CB C 13 60.892 0.005 . 1 . . 1193 . . 85 SER CB . 18632 1 1105 . 1 1 97 97 SER N N 15 107.403 0.004 . 1 . . 195 . . 85 SER N . 18632 1 1106 . 1 1 98 98 THR H H 1 8.260 0.002 . 1 . . 238 . . 86 THR H . 18632 1 1107 . 1 1 98 98 THR HA H 1 4.889 0.001 . 1 . . 492 . . 86 THR HA . 18632 1 1108 . 1 1 98 98 THR HB H 1 4.330 0.001 . 1 . . 493 . . 86 THR HB . 18632 1 1109 . 1 1 98 98 THR HG21 H 1 1.065 0.001 . 1 . . 772 . . 86 THR HG21 . 18632 1 1110 . 1 1 98 98 THR HG22 H 1 1.065 0.001 . 1 . . 772 . . 86 THR HG22 . 18632 1 1111 . 1 1 98 98 THR HG23 H 1 1.065 0.001 . 1 . . 772 . . 86 THR HG23 . 18632 1 1112 . 1 1 98 98 THR C C 13 173.147 0.005 . 1 . . 1771 . . 86 THR C . 18632 1 1113 . 1 1 98 98 THR CA C 13 60.070 0.005 . 1 . . 1447 . . 86 THR CA . 18632 1 1114 . 1 1 98 98 THR CB C 13 71.775 0.005 . 1 . . 1446 . . 86 THR CB . 18632 1 1115 . 1 1 98 98 THR CG2 C 13 21.654 0.005 . 1 . . 773 . . 86 THR CG2 . 18632 1 1116 . 1 1 98 98 THR N N 15 112.678 0.045 . 1 . . 239 . . 86 THR N . 18632 1 1117 . 1 1 99 99 GLN H H 1 8.560 0.001 . 1 . . 100 . . 87 GLN H . 18632 1 1118 . 1 1 99 99 GLN HA H 1 4.534 0.009 . 1 . . 494 . . 87 GLN HA . 18632 1 1119 . 1 1 99 99 GLN HB2 H 1 1.926 0.001 . 2 . . 496 . . 87 GLN HB2 . 18632 1 1120 . 1 1 99 99 GLN HB3 H 1 2.022 0.001 . 2 . . 495 . . 87 GLN HB3 . 18632 1 1121 . 1 1 99 99 GLN HG2 H 1 2.393 0.001 . 1 . . 1059 . . 87 GLN HG2 . 18632 1 1122 . 1 1 99 99 GLN HG3 H 1 2.393 0.001 . 1 . . 1060 . . 87 GLN HG3 . 18632 1 1123 . 1 1 99 99 GLN HE21 H 1 7.891 0.004 . 1 . . 5 . . 87 GLN HE21 . 18632 1 1124 . 1 1 99 99 GLN HE22 H 1 7.018 0.008 . 1 . . 7 . . 87 GLN HE22 . 18632 1 1125 . 1 1 99 99 GLN C C 13 176.668 0.005 . 1 . . 1772 . . 87 GLN C . 18632 1 1126 . 1 1 99 99 GLN CA C 13 54.979 0.005 . 1 . . 1445 . . 87 GLN CA . 18632 1 1127 . 1 1 99 99 GLN CB C 13 29.233 0.005 . 1 . . 1444 . . 87 GLN CB . 18632 1 1128 . 1 1 99 99 GLN CG C 13 33.544 0.005 . 1 . . 1064 . . 87 GLN CG . 18632 1 1129 . 1 1 99 99 GLN N N 15 115.340 0.01 . 1 . . 101 . . 87 GLN N . 18632 1 1130 . 1 1 99 99 GLN NE2 N 15 114.218 0.047 . 1 . . 6 . . 87 GLN NE2 . 18632 1 1131 . 1 1 100 100 HIS H H 1 9.427 0.002 . 1 . . 153 . . 88 HIS H . 18632 1 1132 . 1 1 100 100 HIS HA H 1 5.459 0.001 . 1 . . 499 . . 88 HIS HA . 18632 1 1133 . 1 1 100 100 HIS HB2 H 1 2.770 0.001 . 1 . . 498 . . 88 HIS HB2 . 18632 1 1134 . 1 1 100 100 HIS HB3 H 1 2.770 0.001 . 1 . . 497 . . 88 HIS HB3 . 18632 1 1135 . 1 1 100 100 HIS HD2 H 1 7.040 0.001 . 1 . . 1046 . . 88 HIS HD2 . 18632 1 1136 . 1 1 100 100 HIS HE1 H 1 8.301 0.001 . 1 . . 1172 . . 88 HIS HE1 . 18632 1 1137 . 1 1 100 100 HIS C C 13 174.697 0.005 . 1 . . 1644 . . 88 HIS C . 18632 1 1138 . 1 1 100 100 HIS CA C 13 52.852 0.005 . 1 . . 1298 . . 88 HIS CA . 18632 1 1139 . 1 1 100 100 HIS CB C 13 35.461 0.005 . 1 . . 1297 . . 88 HIS CB . 18632 1 1140 . 1 1 100 100 HIS CD2 C 13 116.063 0.005 . 1 . . 1047 . . 88 HIS CD2 . 18632 1 1141 . 1 1 100 100 HIS CE1 C 13 134.670 0.005 . 1 . . 1173 . . 88 HIS CE1 . 18632 1 1142 . 1 1 100 100 HIS N N 15 123.015 0.035 . 1 . . 154 . . 88 HIS N . 18632 1 1143 . 1 1 101 101 LYS H H 1 9.361 0.002 . 1 . . 25 . . 89 LYS H . 18632 1 1144 . 1 1 101 101 LYS HA H 1 4.702 0.001 . 1 . . 500 . . 89 LYS HA . 18632 1 1145 . 1 1 101 101 LYS HB2 H 1 1.567 0.001 . 2 . . 502 . . 89 LYS HB2 . 18632 1 1146 . 1 1 101 101 LYS HB3 H 1 1.388 0.001 . 2 . . 501 . . 89 LYS HB3 . 18632 1 1147 . 1 1 101 101 LYS HG2 H 1 1.231 0.001 . 2 . . 1024 . . 89 LYS HG2 . 18632 1 1148 . 1 1 101 101 LYS HG3 H 1 1.137 0.001 . 2 . . 1023 . . 89 LYS HG3 . 18632 1 1149 . 1 1 101 101 LYS HE2 H 1 2.813 0.001 . 1 . . 1026 . . 89 LYS HE2 . 18632 1 1150 . 1 1 101 101 LYS HE3 H 1 2.813 0.001 . 1 . . 1025 . . 89 LYS HE3 . 18632 1 1151 . 1 1 101 101 LYS C C 13 175.830 0.005 . 1 . . 1643 . . 89 LYS C . 18632 1 1152 . 1 1 101 101 LYS CA C 13 55.425 0.005 . 1 . . 1299 . . 89 LYS CA . 18632 1 1153 . 1 1 101 101 LYS CB C 13 32.554 0.005 . 1 . . 1300 . . 89 LYS CB . 18632 1 1154 . 1 1 101 101 LYS CG C 13 25.228 0.005 . 1 . . 1117 . . 89 LYS CG . 18632 1 1155 . 1 1 101 101 LYS CD C 13 29.264 0.005 . 1 . . 1118 . . 89 LYS CD . 18632 1 1156 . 1 1 101 101 LYS CE C 13 41.996 0.005 . 1 . . 1119 . . 89 LYS CE . 18632 1 1157 . 1 1 101 101 LYS N N 15 119.915 0.011 . 1 . . 26 . . 89 LYS N . 18632 1 1158 . 1 1 102 102 ILE H H 1 8.942 0.001 . 1 . . 1 . . 90 ILE H . 18632 1 1159 . 1 1 102 102 ILE HA H 1 4.601 0.001 . 1 . . 503 . . 90 ILE HA . 18632 1 1160 . 1 1 102 102 ILE HB H 1 -0.232 0.001 . 1 . . 504 . . 90 ILE HB . 18632 1 1161 . 1 1 102 102 ILE HG12 H 1 0.856 0.001 . 2 . . 779 . . 90 ILE HG12 . 18632 1 1162 . 1 1 102 102 ILE HG13 H 1 -0.733 0.001 . 2 . . 780 . . 90 ILE HG13 . 18632 1 1163 . 1 1 102 102 ILE HG21 H 1 -0.481 0.001 . 1 . . 774 . . 90 ILE HG21 . 18632 1 1164 . 1 1 102 102 ILE HG22 H 1 -0.481 0.001 . 1 . . 774 . . 90 ILE HG22 . 18632 1 1165 . 1 1 102 102 ILE HG23 H 1 -0.481 0.001 . 1 . . 774 . . 90 ILE HG23 . 18632 1 1166 . 1 1 102 102 ILE HD11 H 1 0.076 0.001 . 1 . . 776 . . 90 ILE HD11 . 18632 1 1167 . 1 1 102 102 ILE HD12 H 1 0.076 0.001 . 1 . . 776 . . 90 ILE HD12 . 18632 1 1168 . 1 1 102 102 ILE HD13 H 1 0.076 0.001 . 1 . . 776 . . 90 ILE HD13 . 18632 1 1169 . 1 1 102 102 ILE C C 13 173.655 0.005 . 1 . . 1773 . . 90 ILE C . 18632 1 1170 . 1 1 102 102 ILE CA C 13 58.975 0.005 . 1 . . 1522 . . 90 ILE CA . 18632 1 1171 . 1 1 102 102 ILE CB C 13 39.555 0.005 . 1 . . 1521 . . 90 ILE CB . 18632 1 1172 . 1 1 102 102 ILE CG1 C 13 27.392 0.005 . 1 . . 778 . . 90 ILE CG1 . 18632 1 1173 . 1 1 102 102 ILE CG2 C 13 16.630 0.005 . 1 . . 775 . . 90 ILE CG2 . 18632 1 1174 . 1 1 102 102 ILE CD1 C 13 13.766 0.005 . 1 . . 777 . . 90 ILE CD1 . 18632 1 1175 . 1 1 102 102 ILE N N 15 128.653 0.019 . 1 . . 2 . . 90 ILE N . 18632 1 1176 . 1 1 103 103 THR H H 1 7.796 0.002 . 1 . . 212 . . 91 THR H . 18632 1 1177 . 1 1 103 103 THR HA H 1 4.292 0.001 . 1 . . 505 . . 91 THR HA . 18632 1 1178 . 1 1 103 103 THR HB H 1 3.525 0.001 . 1 . . 506 . . 91 THR HB . 18632 1 1179 . 1 1 103 103 THR HG21 H 1 0.873 0.001 . 1 . . 781 . . 91 THR HG21 . 18632 1 1180 . 1 1 103 103 THR HG22 H 1 0.873 0.001 . 1 . . 781 . . 91 THR HG22 . 18632 1 1181 . 1 1 103 103 THR HG23 H 1 0.873 0.001 . 1 . . 781 . . 91 THR HG23 . 18632 1 1182 . 1 1 103 103 THR C C 13 175.268 0.005 . 1 . . 1584 . . 91 THR C . 18632 1 1183 . 1 1 103 103 THR CA C 13 61.816 0.005 . 1 . . 1519 . . 91 THR CA . 18632 1 1184 . 1 1 103 103 THR CB C 13 71.634 0.005 . 1 . . 1520 . . 91 THR CB . 18632 1 1185 . 1 1 103 103 THR CG2 C 13 20.661 0.005 . 1 . . 782 . . 91 THR CG2 . 18632 1 1186 . 1 1 103 103 THR N N 15 116.914 0.006 . 1 . . 213 . . 91 THR N . 18632 1 1187 . 1 1 104 104 PHE H H 1 10.122 0.002 . 1 . . 86 . . 92 PHE H . 18632 1 1188 . 1 1 104 104 PHE HA H 1 5.683 0.001 . 1 . . 507 . . 92 PHE HA . 18632 1 1189 . 1 1 104 104 PHE HB2 H 1 2.355 0.001 . 1 . . 509 . . 92 PHE HB2 . 18632 1 1190 . 1 1 104 104 PHE HB3 H 1 2.355 0.001 . 1 . . 508 . . 92 PHE HB3 . 18632 1 1191 . 1 1 104 104 PHE HD1 H 1 6.366 0.003 . 3 . . 1009 . . 92 PHE HD1 . 18632 1 1192 . 1 1 104 104 PHE HD2 H 1 6.366 0.003 . 3 . . 1009 . . 92 PHE HD2 . 18632 1 1193 . 1 1 104 104 PHE C C 13 175.225 0.005 . 1 . . 1774 . . 92 PHE C . 18632 1 1194 . 1 1 104 104 PHE CA C 13 56.997 0.005 . 1 . . 1518 . . 92 PHE CA . 18632 1 1195 . 1 1 104 104 PHE CB C 13 41.747 0.005 . 1 . . 1517 . . 92 PHE CB . 18632 1 1196 . 1 1 104 104 PHE CD1 C 13 130.748 0.005 . 3 . . 1010 . . 92 PHE CD1 . 18632 1 1197 . 1 1 104 104 PHE CD2 C 13 130.748 0.005 . 3 . . 1010 . . 92 PHE CD2 . 18632 1 1198 . 1 1 104 104 PHE N N 15 132.890 0.05 . 1 . . 87 . . 92 PHE N . 18632 1 1199 . 1 1 105 105 ASP H H 1 9.173 0.002 . 1 . . 198 . . 93 ASP H . 18632 1 1200 . 1 1 105 105 ASP HA H 1 4.880 0.001 . 1 . . 512 . . 93 ASP HA . 18632 1 1201 . 1 1 105 105 ASP HB2 H 1 2.460 0.001 . 2 . . 511 . . 93 ASP HB2 . 18632 1 1202 . 1 1 105 105 ASP HB3 H 1 2.265 0.001 . 2 . . 510 . . 93 ASP HB3 . 18632 1 1203 . 1 1 105 105 ASP C C 13 173.132 0.005 . 1 . . 1775 . . 93 ASP C . 18632 1 1204 . 1 1 105 105 ASP CA C 13 53.193 0.005 . 1 . . 1516 . . 93 ASP CA . 18632 1 1205 . 1 1 105 105 ASP CB C 13 44.661 0.005 . 1 . . 1515 . . 93 ASP CB . 18632 1 1206 . 1 1 105 105 ASP N N 15 121.700 0.012 . 1 . . 199 . . 93 ASP N . 18632 1 1207 . 1 1 106 106 LEU H H 1 9.023 0.001 . 1 . . 200 . . 94 LEU H . 18632 1 1208 . 1 1 106 106 LEU HA H 1 5.089 0.001 . 1 . . 513 . . 94 LEU HA . 18632 1 1209 . 1 1 106 106 LEU HB2 H 1 1.240 0.001 . 2 . . 514 . . 94 LEU HB2 . 18632 1 1210 . 1 1 106 106 LEU HB3 H 1 1.694 0.001 . 2 . . 515 . . 94 LEU HB3 . 18632 1 1211 . 1 1 106 106 LEU HG H 1 1.506 0.001 . 1 . . 785 . . 94 LEU HG . 18632 1 1212 . 1 1 106 106 LEU HD11 H 1 0.839 0.001 . 2 . . 1145 . . 94 LEU HD11 . 18632 1 1213 . 1 1 106 106 LEU HD12 H 1 0.839 0.001 . 2 . . 1145 . . 94 LEU HD12 . 18632 1 1214 . 1 1 106 106 LEU HD13 H 1 0.839 0.001 . 2 . . 1145 . . 94 LEU HD13 . 18632 1 1215 . 1 1 106 106 LEU HD21 H 1 0.796 0.001 . 2 . . 1146 . . 94 LEU HD21 . 18632 1 1216 . 1 1 106 106 LEU HD22 H 1 0.796 0.001 . 2 . . 1146 . . 94 LEU HD22 . 18632 1 1217 . 1 1 106 106 LEU HD23 H 1 0.796 0.001 . 2 . . 1146 . . 94 LEU HD23 . 18632 1 1218 . 1 1 106 106 LEU C C 13 176.689 0.005 . 1 . . 1776 . . 94 LEU C . 18632 1 1219 . 1 1 106 106 LEU CA C 13 53.071 0.005 . 1 . . 1514 . . 94 LEU CA . 18632 1 1220 . 1 1 106 106 LEU CB C 13 43.122 0.005 . 1 . . 1513 . . 94 LEU CB . 18632 1 1221 . 1 1 106 106 LEU CG C 13 26.762 0.005 . 1 . . 1142 . . 94 LEU CG . 18632 1 1222 . 1 1 106 106 LEU CD1 C 13 25.576 0.005 . 2 . . 1144 . . 94 LEU CD1 . 18632 1 1223 . 1 1 106 106 LEU CD2 C 13 24.492 0.005 . 2 . . 1143 . . 94 LEU CD2 . 18632 1 1224 . 1 1 106 106 LEU N N 15 122.093 0.011 . 1 . . 201 . . 94 LEU N . 18632 1 1225 . 1 1 107 107 LYS H H 1 8.377 0.002 . 1 . . 219 . . 95 LYS H . 18632 1 1226 . 1 1 107 107 LYS HA H 1 4.077 0.001 . 1 . . 516 . . 95 LYS HA . 18632 1 1227 . 1 1 107 107 LYS HB2 H 1 1.797 0.001 . 2 . . 518 . . 95 LYS HB2 . 18632 1 1228 . 1 1 107 107 LYS HB3 H 1 1.546 0.001 . 2 . . 517 . . 95 LYS HB3 . 18632 1 1229 . 1 1 107 107 LYS HG2 H 1 1.441 0.001 . 2 . . 787 . . 95 LYS HG2 . 18632 1 1230 . 1 1 107 107 LYS HG3 H 1 1.354 0.001 . 2 . . 786 . . 95 LYS HG3 . 18632 1 1231 . 1 1 107 107 LYS HD2 H 1 1.537 0.001 . 1 . . 1027 . . 95 LYS HD2 . 18632 1 1232 . 1 1 107 107 LYS HD3 H 1 1.537 0.001 . 1 . . 1029 . . 95 LYS HD3 . 18632 1 1233 . 1 1 107 107 LYS HE2 H 1 2.909 0.001 . 1 . . 789 . . 95 LYS HE2 . 18632 1 1234 . 1 1 107 107 LYS HE3 H 1 2.909 0.001 . 1 . . 788 . . 95 LYS HE3 . 18632 1 1235 . 1 1 107 107 LYS C C 13 176.337 0.005 . 1 . . 1777 . . 95 LYS C . 18632 1 1236 . 1 1 107 107 LYS CA C 13 58.485 0.005 . 1 . . 1509 . . 95 LYS CA . 18632 1 1237 . 1 1 107 107 LYS CB C 13 34.145 0.005 . 1 . . 1510 . . 95 LYS CB . 18632 1 1238 . 1 1 107 107 LYS CG C 13 24.858 0.005 . 1 . . 790 . . 95 LYS CG . 18632 1 1239 . 1 1 107 107 LYS CD C 13 29.614 0.005 . 1 . . 1028 . . 95 LYS CD . 18632 1 1240 . 1 1 107 107 LYS CE C 13 41.834 0.005 . 1 . . 1195 . . 95 LYS CE . 18632 1 1241 . 1 1 107 107 LYS N N 15 128.144 0.037 . 1 . . 220 . . 95 LYS N . 18632 1 1242 . 1 1 108 108 ASP H H 1 8.433 0.002 . 1 . . 202 . . 96 ASP H . 18632 1 1243 . 1 1 108 108 ASP HA H 1 4.561 0.001 . 1 . . 853 . . 96 ASP HA . 18632 1 1244 . 1 1 108 108 ASP HB2 H 1 3.095 0.001 . 2 . . 855 . . 96 ASP HB2 . 18632 1 1245 . 1 1 108 108 ASP HB3 H 1 2.936 0.001 . 2 . . 854 . . 96 ASP HB3 . 18632 1 1246 . 1 1 108 108 ASP C C 13 173.784 0.005 . 1 . . 1778 . . 96 ASP C . 18632 1 1247 . 1 1 108 108 ASP CA C 13 52.500 0.005 . 1 . . 1511 . . 96 ASP CA . 18632 1 1248 . 1 1 108 108 ASP CB C 13 40.059 0.005 . 1 . . 1512 . . 96 ASP CB . 18632 1 1249 . 1 1 108 108 ASP N N 15 115.780 0.022 . 1 . . 203 . . 96 ASP N . 18632 1 1250 . 1 1 109 109 PRO HA H 1 4.304 0.001 . 1 . . 519 . . 97 PRO HA . 18632 1 1251 . 1 1 109 109 PRO HB2 H 1 2.512 0.001 . 2 . . 521 . . 97 PRO HB2 . 18632 1 1252 . 1 1 109 109 PRO HB3 H 1 1.725 0.001 . 2 . . 520 . . 97 PRO HB3 . 18632 1 1253 . 1 1 109 109 PRO HG2 H 1 1.931 0.001 . 2 . . 980 . . 97 PRO HG2 . 18632 1 1254 . 1 1 109 109 PRO HG3 H 1 2.088 0.001 . 2 . . 981 . . 97 PRO HG3 . 18632 1 1255 . 1 1 109 109 PRO HD2 H 1 3.605 0.001 . 2 . . 1071 . . 97 PRO HD2 . 18632 1 1256 . 1 1 109 109 PRO HD3 H 1 3.806 0.001 . 2 . . 1073 . . 97 PRO HD3 . 18632 1 1257 . 1 1 109 109 PRO C C 13 175.719 0.005 . 1 . . 1779 . . 97 PRO C . 18632 1 1258 . 1 1 109 109 PRO CA C 13 65.671 0.005 . 1 . . 1562 . . 97 PRO CA . 18632 1 1259 . 1 1 109 109 PRO CB C 13 32.370 0.005 . 1 . . 1561 . . 97 PRO CB . 18632 1 1260 . 1 1 109 109 PRO CG C 13 27.959 0.005 . 1 . . 982 . . 97 PRO CG . 18632 1 1261 . 1 1 109 109 PRO CD C 13 50.820 0.005 . 1 . . 1072 . . 97 PRO CD . 18632 1 1262 . 1 1 110 110 ASN H H 1 8.304 0.002 . 1 . . 35 . . 98 ASN H . 18632 1 1263 . 1 1 110 110 ASN HA H 1 5.021 0.001 . 1 . . 522 . . 98 ASN HA . 18632 1 1264 . 1 1 110 110 ASN HB2 H 1 3.013 0.001 . 2 . . 524 . . 98 ASN HB2 . 18632 1 1265 . 1 1 110 110 ASN HB3 H 1 2.700 0.001 . 2 . . 523 . . 98 ASN HB3 . 18632 1 1266 . 1 1 110 110 ASN HD21 H 1 7.795 0.002 . 1 . . 9 . . 98 ASN HD21 . 18632 1 1267 . 1 1 110 110 ASN HD22 H 1 7.091 0.003 . 1 . . 1063 . . 98 ASN HD22 . 18632 1 1268 . 1 1 110 110 ASN C C 13 175.657 0.005 . 1 . . 1780 . . 98 ASN C . 18632 1 1269 . 1 1 110 110 ASN CA C 13 52.257 0.005 . 1 . . 1380 . . 98 ASN CA . 18632 1 1270 . 1 1 110 110 ASN CB C 13 41.747 0.005 . 1 . . 1381 . . 98 ASN CB . 18632 1 1271 . 1 1 110 110 ASN N N 15 110.362 0.009 . 1 . . 36 . . 98 ASN N . 18632 1 1272 . 1 1 110 110 ASN ND2 N 15 115.259 0.065 . 1 . . 8 . . 98 ASN ND2 . 18632 1 1273 . 1 1 111 111 THR H H 1 7.850 0.002 . 1 . . 47 . . 99 THR H . 18632 1 1274 . 1 1 111 111 THR HA H 1 5.138 0.001 . 1 . . 525 . . 99 THR HA . 18632 1 1275 . 1 1 111 111 THR HB H 1 3.814 0.001 . 1 . . 526 . . 99 THR HB . 18632 1 1276 . 1 1 111 111 THR HG21 H 1 1.006 0.001 . 1 . . 791 . . 99 THR HG21 . 18632 1 1277 . 1 1 111 111 THR HG22 H 1 1.006 0.001 . 1 . . 791 . . 99 THR HG22 . 18632 1 1278 . 1 1 111 111 THR HG23 H 1 1.006 0.001 . 1 . . 791 . . 99 THR HG23 . 18632 1 1279 . 1 1 111 111 THR C C 13 171.893 0.005 . 1 . . 1781 . . 99 THR C . 18632 1 1280 . 1 1 111 111 THR CA C 13 62.732 0.005 . 1 . . 1382 . . 99 THR CA . 18632 1 1281 . 1 1 111 111 THR CB C 13 70.128 0.005 . 1 . . 1383 . . 99 THR CB . 18632 1 1282 . 1 1 111 111 THR CG2 C 13 20.669 0.005 . 1 . . 792 . . 99 THR CG2 . 18632 1 1283 . 1 1 111 111 THR N N 15 118.427 0.04 . 1 . . 48 . . 99 THR N . 18632 1 1284 . 1 1 112 112 LEU H H 1 8.574 0.002 . 1 . . 228 . . 100 LEU H . 18632 1 1285 . 1 1 112 112 LEU HA H 1 4.893 0.003 . 1 . . 527 . . 100 LEU HA . 18632 1 1286 . 1 1 112 112 LEU HB2 H 1 1.209 0.001 . 2 . . 529 . . 100 LEU HB2 . 18632 1 1287 . 1 1 112 112 LEU HB3 H 1 -0.068 0.001 . 2 . . 528 . . 100 LEU HB3 . 18632 1 1288 . 1 1 112 112 LEU HG H 1 1.319 0.001 . 1 . . 1141 . . 100 LEU HG . 18632 1 1289 . 1 1 112 112 LEU HD11 H 1 -0.034 0.001 . 2 . . 1137 . . 100 LEU HD11 . 18632 1 1290 . 1 1 112 112 LEU HD12 H 1 -0.034 0.001 . 2 . . 1137 . . 100 LEU HD12 . 18632 1 1291 . 1 1 112 112 LEU HD13 H 1 -0.034 0.001 . 2 . . 1137 . . 100 LEU HD13 . 18632 1 1292 . 1 1 112 112 LEU HD21 H 1 0.629 0.001 . 2 . . 1136 . . 100 LEU HD21 . 18632 1 1293 . 1 1 112 112 LEU HD22 H 1 0.629 0.001 . 2 . . 1136 . . 100 LEU HD22 . 18632 1 1294 . 1 1 112 112 LEU HD23 H 1 0.629 0.001 . 2 . . 1136 . . 100 LEU HD23 . 18632 1 1295 . 1 1 112 112 LEU C C 13 175.422 0.005 . 1 . . 1782 . . 100 LEU C . 18632 1 1296 . 1 1 112 112 LEU CA C 13 53.189 0.005 . 1 . . 1379 . . 100 LEU CA . 18632 1 1297 . 1 1 112 112 LEU CB C 13 44.548 0.005 . 1 . . 1378 . . 100 LEU CB . 18632 1 1298 . 1 1 112 112 LEU CG C 13 27.024 0.005 . 1 . . 1140 . . 100 LEU CG . 18632 1 1299 . 1 1 112 112 LEU CD1 C 13 26.329 0.005 . 2 . . 1138 . . 100 LEU CD1 . 18632 1 1300 . 1 1 112 112 LEU CD2 C 13 23.678 0.005 . 2 . . 1139 . . 100 LEU CD2 . 18632 1 1301 . 1 1 112 112 LEU N N 15 132.373 0.016 . 1 . . 229 . . 100 LEU N . 18632 1 1302 . 1 1 113 113 THR H H 1 9.872 0.001 . 1 . . 27 . . 101 THR H . 18632 1 1303 . 1 1 113 113 THR HA H 1 5.523 0.001 . 1 . . 530 . . 101 THR HA . 18632 1 1304 . 1 1 113 113 THR HB H 1 4.112 0.001 . 1 . . 531 . . 101 THR HB . 18632 1 1305 . 1 1 113 113 THR HG21 H 1 1.087 0.001 . 1 . . 793 . . 101 THR HG21 . 18632 1 1306 . 1 1 113 113 THR HG22 H 1 1.087 0.001 . 1 . . 793 . . 101 THR HG22 . 18632 1 1307 . 1 1 113 113 THR HG23 H 1 1.087 0.001 . 1 . . 793 . . 101 THR HG23 . 18632 1 1308 . 1 1 113 113 THR C C 13 173.172 0.005 . 1 . . 1783 . . 101 THR C . 18632 1 1309 . 1 1 113 113 THR CA C 13 59.292 0.005 . 1 . . 1377 . . 101 THR CA . 18632 1 1310 . 1 1 113 113 THR CB C 13 70.736 0.005 . 1 . . 1376 . . 101 THR CB . 18632 1 1311 . 1 1 113 113 THR CG2 C 13 22.269 0.005 . 1 . . 794 . . 101 THR CG2 . 18632 1 1312 . 1 1 113 113 THR N N 15 117.491 0.012 . 1 . . 28 . . 101 THR N . 18632 1 1313 . 1 1 114 114 GLU H H 1 8.717 0.001 . 1 . . 240 . . 102 GLU H . 18632 1 1314 . 1 1 114 114 GLU HA H 1 4.294 0.001 . 1 . . 534 . . 102 GLU HA . 18632 1 1315 . 1 1 114 114 GLU HB2 H 1 2.105 0.001 . 1 . . 535 . . 102 GLU HB2 . 18632 1 1316 . 1 1 114 114 GLU HB3 H 1 2.105 0.001 . 1 . . 536 . . 102 GLU HB3 . 18632 1 1317 . 1 1 114 114 GLU C C 13 174.748 0.005 . 1 . . 1786 . . 102 GLU C . 18632 1 1318 . 1 1 114 114 GLU CA C 13 54.378 0.005 . 1 . . 1443 . . 102 GLU CA . 18632 1 1319 . 1 1 114 114 GLU CB C 13 34.339 0.005 . 1 . . 1442 . . 102 GLU CB . 18632 1 1320 . 1 1 114 114 GLU N N 15 124.865 0.016 . 1 . . 241 . . 102 GLU N . 18632 1 1321 . 1 1 115 115 THR H H 1 8.746 0.003 . 1 . . 215 . . 103 THR H . 18632 1 1322 . 1 1 115 115 THR HA H 1 4.912 0.001 . 1 . . 537 . . 103 THR HA . 18632 1 1323 . 1 1 115 115 THR HB H 1 3.659 0.001 . 1 . . 538 . . 103 THR HB . 18632 1 1324 . 1 1 115 115 THR HG21 H 1 0.947 0.001 . 1 . . 634 . . 103 THR HG21 . 18632 1 1325 . 1 1 115 115 THR HG22 H 1 0.947 0.001 . 1 . . 634 . . 103 THR HG22 . 18632 1 1326 . 1 1 115 115 THR HG23 H 1 0.947 0.001 . 1 . . 634 . . 103 THR HG23 . 18632 1 1327 . 1 1 115 115 THR C C 13 172.813 0.005 . 1 . . 1785 . . 103 THR C . 18632 1 1328 . 1 1 115 115 THR CA C 13 62.739 0.005 . 1 . . 1441 . . 103 THR CA . 18632 1 1329 . 1 1 115 115 THR CB C 13 70.237 0.005 . 1 . . 1440 . . 103 THR CB . 18632 1 1330 . 1 1 115 115 THR CG2 C 13 20.928 0.005 . 1 . . 635 . . 103 THR CG2 . 18632 1 1331 . 1 1 115 115 THR N N 15 125.108 0.016 . 1 . . 216 . . 103 THR N . 18632 1 1332 . 1 1 116 116 HIS H H 1 9.414 0.002 . 1 . . 125 . . 104 HIS H . 18632 1 1333 . 1 1 116 116 HIS HA H 1 4.577 0.001 . 1 . . 539 . . 104 HIS HA . 18632 1 1334 . 1 1 116 116 HIS HB2 H 1 2.783 0.001 . 1 . . 541 . . 104 HIS HB2 . 18632 1 1335 . 1 1 116 116 HIS HB3 H 1 2.783 0.001 . 1 . . 540 . . 104 HIS HB3 . 18632 1 1336 . 1 1 116 116 HIS HD2 H 1 6.143 0.001 . 1 . . 989 . . 104 HIS HD2 . 18632 1 1337 . 1 1 116 116 HIS C C 13 174.348 0.005 . 1 . . 1784 . . 104 HIS C . 18632 1 1338 . 1 1 116 116 HIS CA C 13 55.312 0.005 . 1 . . 1438 . . 104 HIS CA . 18632 1 1339 . 1 1 116 116 HIS CB C 13 31.668 0.005 . 1 . . 1439 . . 104 HIS CB . 18632 1 1340 . 1 1 116 116 HIS CD2 C 13 117.891 0.005 . 1 . . 1006 . . 104 HIS CD2 . 18632 1 1341 . 1 1 116 116 HIS N N 15 124.516 0.013 . 1 . . 126 . . 104 HIS N . 18632 1 1342 . 1 1 117 117 ILE H H 1 9.096 0.008 . 1 . . 1436 . . 105 ILE H . 18632 1 1343 . 1 1 117 117 ILE HA H 1 4.834 0.001 . 1 . . 543 . . 105 ILE HA . 18632 1 1344 . 1 1 117 117 ILE HB H 1 1.585 0.001 . 1 . . 542 . . 105 ILE HB . 18632 1 1345 . 1 1 117 117 ILE HG12 H 1 1.375 0.001 . 2 . . 633 . . 105 ILE HG12 . 18632 1 1346 . 1 1 117 117 ILE HG13 H 1 1.001 0.001 . 2 . . 632 . . 105 ILE HG13 . 18632 1 1347 . 1 1 117 117 ILE HG21 H 1 0.809 0.001 . 1 . . 627 . . 105 ILE HG21 . 18632 1 1348 . 1 1 117 117 ILE HG22 H 1 0.809 0.001 . 1 . . 627 . . 105 ILE HG22 . 18632 1 1349 . 1 1 117 117 ILE HG23 H 1 0.809 0.001 . 1 . . 627 . . 105 ILE HG23 . 18632 1 1350 . 1 1 117 117 ILE HD11 H 1 0.792 0.001 . 1 . . 630 . . 105 ILE HD11 . 18632 1 1351 . 1 1 117 117 ILE HD12 H 1 0.792 0.001 . 1 . . 630 . . 105 ILE HD12 . 18632 1 1352 . 1 1 117 117 ILE HD13 H 1 0.792 0.001 . 1 . . 630 . . 105 ILE HD13 . 18632 1 1353 . 1 1 117 117 ILE C C 13 176.705 0.005 . 1 . . 1787 . . 105 ILE C . 18632 1 1354 . 1 1 117 117 ILE CA C 13 60.173 0.005 . 1 . . 1435 . . 105 ILE CA . 18632 1 1355 . 1 1 117 117 ILE CB C 13 40.971 0.005 . 1 . . 1434 . . 105 ILE CB . 18632 1 1356 . 1 1 117 117 ILE CG1 C 13 27.536 0.005 . 1 . . 631 . . 105 ILE CG1 . 18632 1 1357 . 1 1 117 117 ILE CG2 C 13 16.627 0.005 . 1 . . 628 . . 105 ILE CG2 . 18632 1 1358 . 1 1 117 117 ILE CD1 C 13 13.824 0.005 . 1 . . 629 . . 105 ILE CD1 . 18632 1 1359 . 1 1 117 117 ILE N N 15 125.469 0.007 . 1 . . 1437 . . 105 ILE N . 18632 1 1360 . 1 1 118 118 LYS H H 1 7.499 0.002 . 1 . . 226 . . 106 LYS H . 18632 1 1361 . 1 1 118 118 LYS HA H 1 3.825 0.001 . 1 . . 544 . . 106 LYS HA . 18632 1 1362 . 1 1 118 118 LYS HB2 H 1 1.793 0.001 . 2 . . 545 . . 106 LYS HB2 . 18632 1 1363 . 1 1 118 118 LYS HB3 H 1 2.029 0.001 . 2 . . 546 . . 106 LYS HB3 . 18632 1 1364 . 1 1 118 118 LYS HG2 H 1 1.342 0.001 . 2 . . 1124 . . 106 LYS HG2 . 18632 1 1365 . 1 1 118 118 LYS HG3 H 1 0.706 0.001 . 2 . . 1122 . . 106 LYS HG3 . 18632 1 1366 . 1 1 118 118 LYS HD2 H 1 1.604 0.001 . 2 . . 1127 . . 106 LYS HD2 . 18632 1 1367 . 1 1 118 118 LYS HD3 H 1 1.406 0.001 . 2 . . 1126 . . 106 LYS HD3 . 18632 1 1368 . 1 1 118 118 LYS HE2 H 1 2.719 0.001 . 2 . . 1125 . . 106 LYS HE2 . 18632 1 1369 . 1 1 118 118 LYS HE3 H 1 2.845 0.001 . 2 . . 1128 . . 106 LYS HE3 . 18632 1 1370 . 1 1 118 118 LYS C C 13 177.128 0.005 . 1 . . 1790 . . 106 LYS C . 18632 1 1371 . 1 1 118 118 LYS CA C 13 58.564 0.005 . 1 . . 1432 . . 106 LYS CA . 18632 1 1372 . 1 1 118 118 LYS CB C 13 31.630 0.005 . 1 . . 1433 . . 106 LYS CB . 18632 1 1373 . 1 1 118 118 LYS CG C 13 25.930 0.005 . 1 . . 1120 . . 106 LYS CG . 18632 1 1374 . 1 1 118 118 LYS CD C 13 29.381 0.005 . 1 . . 1121 . . 106 LYS CD . 18632 1 1375 . 1 1 118 118 LYS CE C 13 42.484 0.005 . 1 . . 1123 . . 106 LYS CE . 18632 1 1376 . 1 1 118 118 LYS N N 15 127.222 0.008 . 1 . . 227 . . 106 LYS N . 18632 1 1377 . 1 1 119 119 VAL H H 1 7.926 0.002 . 1 . . 82 . . 107 VAL H . 18632 1 1378 . 1 1 119 119 VAL HA H 1 3.474 0.001 . 1 . . 547 . . 107 VAL HA . 18632 1 1379 . 1 1 119 119 VAL HB H 1 1.941 0.001 . 1 . . 548 . . 107 VAL HB . 18632 1 1380 . 1 1 119 119 VAL HG11 H 1 0.856 0.001 . 2 . . 637 . . 107 VAL HG11 . 18632 1 1381 . 1 1 119 119 VAL HG12 H 1 0.856 0.001 . 2 . . 637 . . 107 VAL HG12 . 18632 1 1382 . 1 1 119 119 VAL HG13 H 1 0.856 0.001 . 2 . . 637 . . 107 VAL HG13 . 18632 1 1383 . 1 1 119 119 VAL HG21 H 1 0.780 0.001 . 2 . . 636 . . 107 VAL HG21 . 18632 1 1384 . 1 1 119 119 VAL HG22 H 1 0.780 0.001 . 2 . . 636 . . 107 VAL HG22 . 18632 1 1385 . 1 1 119 119 VAL HG23 H 1 0.780 0.001 . 2 . . 636 . . 107 VAL HG23 . 18632 1 1386 . 1 1 119 119 VAL C C 13 177.975 0.005 . 1 . . 1789 . . 107 VAL C . 18632 1 1387 . 1 1 119 119 VAL CA C 13 66.496 0.005 . 1 . . 1430 . . 107 VAL CA . 18632 1 1388 . 1 1 119 119 VAL CB C 13 31.308 0.005 . 1 . . 1431 . . 107 VAL CB . 18632 1 1389 . 1 1 119 119 VAL CG1 C 13 20.875 0.005 . 2 . . 639 . . 107 VAL CG1 . 18632 1 1390 . 1 1 119 119 VAL CG2 C 13 23.852 0.005 . 2 . . 638 . . 107 VAL CG2 . 18632 1 1391 . 1 1 119 119 VAL N N 15 125.841 0.008 . 1 . . 83 . . 107 VAL N . 18632 1 1392 . 1 1 120 120 ASP H H 1 8.809 0.001 . 1 . . 173 . . 108 ASP H . 18632 1 1393 . 1 1 120 120 ASP HA H 1 4.486 0.001 . 1 . . 858 . . 108 ASP HA . 18632 1 1394 . 1 1 120 120 ASP HB2 H 1 2.764 0.001 . 2 . . 857 . . 108 ASP HB2 . 18632 1 1395 . 1 1 120 120 ASP HB3 H 1 2.501 0.001 . 2 . . 856 . . 108 ASP HB3 . 18632 1 1396 . 1 1 120 120 ASP C C 13 176.202 0.005 . 1 . . 1788 . . 108 ASP C . 18632 1 1397 . 1 1 120 120 ASP CA C 13 55.171 0.005 . 1 . . 1427 . . 108 ASP CA . 18632 1 1398 . 1 1 120 120 ASP CB C 13 40.906 0.005 . 1 . . 1429 . . 108 ASP CB . 18632 1 1399 . 1 1 120 120 ASP N N 15 115.385 0.01 . 1 . . 174 . . 108 ASP N . 18632 1 1400 . 1 1 121 121 ASP H H 1 6.707 0.001 . 1 . . 163 . . 109 ASP H . 18632 1 1401 . 1 1 121 121 ASP HA H 1 4.798 0.001 . 1 . . 931 . . 109 ASP HA . 18632 1 1402 . 1 1 121 121 ASP HB2 H 1 2.547 0.001 . 2 . . 930 . . 109 ASP HB2 . 18632 1 1403 . 1 1 121 121 ASP HB3 H 1 2.718 0.001 . 2 . . 932 . . 109 ASP HB3 . 18632 1 1404 . 1 1 121 121 ASP C C 13 172.601 0.005 . 1 . . 1791 . . 109 ASP C . 18632 1 1405 . 1 1 121 121 ASP CA C 13 51.869 0.005 . 1 . . 1426 . . 109 ASP CA . 18632 1 1406 . 1 1 121 121 ASP CB C 13 40.682 0.005 . 1 . . 1428 . . 109 ASP CB . 18632 1 1407 . 1 1 121 121 ASP N N 15 112.574 0.004 . 1 . . 164 . . 109 ASP N . 18632 1 1408 . 1 1 122 122 PRO HA H 1 4.492 0.001 . 1 . . 549 . . 110 PRO HA . 18632 1 1409 . 1 1 122 122 PRO HB2 H 1 2.219 0.001 . 2 . . 551 . . 110 PRO HB2 . 18632 1 1410 . 1 1 122 122 PRO HB3 H 1 1.940 0.001 . 2 . . 550 . . 110 PRO HB3 . 18632 1 1411 . 1 1 122 122 PRO HG2 H 1 2.006 0.001 . 2 . . 944 . . 110 PRO HG2 . 18632 1 1412 . 1 1 122 122 PRO HG3 H 1 1.932 0.001 . 2 . . 940 . . 110 PRO HG3 . 18632 1 1413 . 1 1 122 122 PRO HD2 H 1 3.796 0.001 . 2 . . 942 . . 110 PRO HD2 . 18632 1 1414 . 1 1 122 122 PRO HD3 H 1 3.493 0.001 . 2 . . 941 . . 110 PRO HD3 . 18632 1 1415 . 1 1 122 122 PRO C C 13 176.504 0.005 . 1 . . 1795 . . 110 PRO C . 18632 1 1416 . 1 1 122 122 PRO CA C 13 63.917 0.005 . 1 . . 1425 . . 110 PRO CA . 18632 1 1417 . 1 1 122 122 PRO CB C 13 31.675 0.005 . 1 . . 1424 . . 110 PRO CB . 18632 1 1418 . 1 1 122 122 PRO CG C 13 27.015 0.005 . 1 . . 943 . . 110 PRO CG . 18632 1 1419 . 1 1 122 122 PRO CD C 13 50.313 0.005 . 1 . . 945 . . 110 PRO CD . 18632 1 1420 . 1 1 123 123 THR H H 1 7.573 0.001 . 1 . . 62 . . 111 THR H . 18632 1 1421 . 1 1 123 123 THR HA H 1 4.313 0.001 . 1 . . 552 . . 111 THR HA . 18632 1 1422 . 1 1 123 123 THR HB H 1 4.348 0.001 . 1 . . 796 . . 111 THR HB . 18632 1 1423 . 1 1 123 123 THR HG21 H 1 1.214 0.001 . 1 . . 795 . . 111 THR HG21 . 18632 1 1424 . 1 1 123 123 THR HG22 H 1 1.214 0.001 . 1 . . 795 . . 111 THR HG22 . 18632 1 1425 . 1 1 123 123 THR HG23 H 1 1.214 0.001 . 1 . . 795 . . 111 THR HG23 . 18632 1 1426 . 1 1 123 123 THR C C 13 174.650 0.005 . 1 . . 1794 . . 111 THR C . 18632 1 1427 . 1 1 123 123 THR CA C 13 62.640 0.005 . 1 . . 1423 . . 111 THR CA . 18632 1 1428 . 1 1 123 123 THR CB C 13 69.100 0.005 . 1 . . 1422 . . 111 THR CB . 18632 1 1429 . 1 1 123 123 THR CG2 C 13 21.748 0.005 . 1 . . 797 . . 111 THR CG2 . 18632 1 1430 . 1 1 123 123 THR N N 15 107.026 0.01 . 1 . . 63 . . 111 THR N . 18632 1 1431 . 1 1 124 124 ASP H H 1 8.456 0.002 . 1 . . 64 . . 112 ASP H . 18632 1 1432 . 1 1 124 124 ASP HA H 1 4.646 0.001 . 1 . . 553 . . 112 ASP HA . 18632 1 1433 . 1 1 124 124 ASP HB2 H 1 2.275 0.001 . 2 . . 554 . . 112 ASP HB2 . 18632 1 1434 . 1 1 124 124 ASP HB3 H 1 3.232 0.001 . 2 . . 555 . . 112 ASP HB3 . 18632 1 1435 . 1 1 124 124 ASP C C 13 172.454 0.005 . 1 . . 1793 . . 112 ASP C . 18632 1 1436 . 1 1 124 124 ASP CA C 13 54.475 0.005 . 1 . . 1421 . . 112 ASP CA . 18632 1 1437 . 1 1 124 124 ASP CB C 13 41.126 0.005 . 1 . . 1420 . . 112 ASP CB . 18632 1 1438 . 1 1 124 124 ASP N N 15 127.075 0.013 . 1 . . 65 . . 112 ASP N . 18632 1 1439 . 1 1 125 125 VAL H H 1 7.174 0.002 . 1 . . 208 . . 113 VAL H . 18632 1 1440 . 1 1 125 125 VAL HA H 1 4.896 0.001 . 1 . . 556 . . 113 VAL HA . 18632 1 1441 . 1 1 125 125 VAL HB H 1 1.891 0.001 . 1 . . 557 . . 113 VAL HB . 18632 1 1442 . 1 1 125 125 VAL HG11 H 1 0.862 0.001 . 2 . . 641 . . 113 VAL HG11 . 18632 1 1443 . 1 1 125 125 VAL HG12 H 1 0.862 0.001 . 2 . . 641 . . 113 VAL HG12 . 18632 1 1444 . 1 1 125 125 VAL HG13 H 1 0.862 0.001 . 2 . . 641 . . 113 VAL HG13 . 18632 1 1445 . 1 1 125 125 VAL HG21 H 1 0.787 0.001 . 2 . . 640 . . 113 VAL HG21 . 18632 1 1446 . 1 1 125 125 VAL HG22 H 1 0.787 0.001 . 2 . . 640 . . 113 VAL HG22 . 18632 1 1447 . 1 1 125 125 VAL HG23 H 1 0.787 0.001 . 2 . . 640 . . 113 VAL HG23 . 18632 1 1448 . 1 1 125 125 VAL C C 13 174.986 0.005 . 1 . . 1792 . . 113 VAL C . 18632 1 1449 . 1 1 125 125 VAL CA C 13 60.175 0.005 . 1 . . 1419 . . 113 VAL CA . 18632 1 1450 . 1 1 125 125 VAL CB C 13 34.662 0.005 . 1 . . 1418 . . 113 VAL CB . 18632 1 1451 . 1 1 125 125 VAL CG1 C 13 20.949 0.005 . 2 . . 642 . . 113 VAL CG1 . 18632 1 1452 . 1 1 125 125 VAL CG2 C 13 20.108 0.005 . 2 . . 643 . . 113 VAL CG2 . 18632 1 1453 . 1 1 125 125 VAL N N 15 123.585 0.025 . 1 . . 209 . . 113 VAL N . 18632 1 1454 . 1 1 126 126 GLU H H 1 8.740 0.002 . 1 . . 131 . . 114 GLU H . 18632 1 1455 . 1 1 126 126 GLU HA H 1 4.854 0.001 . 1 . . 558 . . 114 GLU HA . 18632 1 1456 . 1 1 126 126 GLU HB2 H 1 1.816 0.001 . 2 . . 559 . . 114 GLU HB2 . 18632 1 1457 . 1 1 126 126 GLU HB3 H 1 1.998 0.001 . 2 . . 560 . . 114 GLU HB3 . 18632 1 1458 . 1 1 126 126 GLU HG2 H 1 2.848 0.001 . 2 . . 964 . . 114 GLU HG2 . 18632 1 1459 . 1 1 126 126 GLU HG3 H 1 2.257 0.001 . 2 . . 966 . . 114 GLU HG3 . 18632 1 1460 . 1 1 126 126 GLU C C 13 173.679 0.005 . 1 . . 1796 . . 114 GLU C . 18632 1 1461 . 1 1 126 126 GLU CA C 13 55.756 0.005 . 1 . . 1417 . . 114 GLU CA . 18632 1 1462 . 1 1 126 126 GLU CB C 13 33.686 0.005 . 1 . . 1416 . . 114 GLU CB . 18632 1 1463 . 1 1 126 126 GLU CG C 13 36.878 0.005 . 1 . . 965 . . 114 GLU CG . 18632 1 1464 . 1 1 126 126 GLU N N 15 127.368 0.028 . 1 . . 132 . . 114 GLU N . 18632 1 1465 . 1 1 127 127 THR H H 1 8.916 0.002 . 1 . . 119 . . 115 THR H . 18632 1 1466 . 1 1 127 127 THR HA H 1 4.912 0.001 . 1 . . 561 . . 115 THR HA . 18632 1 1467 . 1 1 127 127 THR HB H 1 3.826 0.001 . 1 . . 562 . . 115 THR HB . 18632 1 1468 . 1 1 127 127 THR HG21 H 1 1.129 0.001 . 1 . . 798 . . 115 THR HG21 . 18632 1 1469 . 1 1 127 127 THR HG22 H 1 1.129 0.001 . 1 . . 798 . . 115 THR HG22 . 18632 1 1470 . 1 1 127 127 THR HG23 H 1 1.129 0.001 . 1 . . 798 . . 115 THR HG23 . 18632 1 1471 . 1 1 127 127 THR C C 13 174.085 0.005 . 1 . . 1799 . . 115 THR C . 18632 1 1472 . 1 1 127 127 THR CA C 13 62.121 0.005 . 1 . . 1415 . . 115 THR CA . 18632 1 1473 . 1 1 127 127 THR CB C 13 71.355 0.005 . 1 . . 1414 . . 115 THR CB . 18632 1 1474 . 1 1 127 127 THR CG2 C 13 22.790 0.005 . 1 . . 799 . . 115 THR CG2 . 18632 1 1475 . 1 1 127 127 THR N N 15 122.873 0.012 . 1 . . 120 . . 115 THR N . 18632 1 1476 . 1 1 128 128 TYR H H 1 9.129 0.003 . 1 . . 147 . . 116 TYR H . 18632 1 1477 . 1 1 128 128 TYR HA H 1 5.255 0.001 . 1 . . 372 . . 116 TYR HA . 18632 1 1478 . 1 1 128 128 TYR HB2 H 1 2.794 0.001 . 1 . . 371 . . 116 TYR HB2 . 18632 1 1479 . 1 1 128 128 TYR HB3 H 1 2.794 0.001 . 1 . . 1657 . . 116 TYR HB3 . 18632 1 1480 . 1 1 128 128 TYR HD1 H 1 6.949 0.001 . 3 . . 1055 . . 116 TYR HD1 . 18632 1 1481 . 1 1 128 128 TYR HD2 H 1 6.949 0.001 . 3 . . 1055 . . 116 TYR HD2 . 18632 1 1482 . 1 1 128 128 TYR HE1 H 1 6.374 0.001 . 3 . . 1042 . . 116 TYR HE1 . 18632 1 1483 . 1 1 128 128 TYR HE2 H 1 6.374 0.001 . 3 . . 1042 . . 116 TYR HE2 . 18632 1 1484 . 1 1 128 128 TYR C C 13 175.486 0.005 . 1 . . 1798 . . 116 TYR C . 18632 1 1485 . 1 1 128 128 TYR CA C 13 52.838 0.005 . 1 . . 1412 . . 116 TYR CA . 18632 1 1486 . 1 1 128 128 TYR CB C 13 39.055 0.005 . 1 . . 1413 . . 116 TYR CB . 18632 1 1487 . 1 1 128 128 TYR CD1 C 13 131.935 0.005 . 3 . . 1056 . . 116 TYR CD1 . 18632 1 1488 . 1 1 128 128 TYR CD2 C 13 131.935 0.005 . 3 . . 1056 . . 116 TYR CD2 . 18632 1 1489 . 1 1 128 128 TYR CE1 C 13 117.517 0.005 . 3 . . 1043 . . 116 TYR CE1 . 18632 1 1490 . 1 1 128 128 TYR CE2 C 13 117.517 0.005 . 3 . . 1043 . . 116 TYR CE2 . 18632 1 1491 . 1 1 128 128 TYR N N 15 130.617 0.01 . 1 . . 148 . . 116 TYR N . 18632 1 1492 . 1 1 129 129 GLU H H 1 8.375 0.003 . 1 . . 1410 . . 117 GLU H . 18632 1 1493 . 1 1 129 129 GLU HA H 1 5.050 0.001 . 1 . . 563 . . 117 GLU HA . 18632 1 1494 . 1 1 129 129 GLU HB2 H 1 1.886 0.001 . 2 . . 565 . . 117 GLU HB2 . 18632 1 1495 . 1 1 129 129 GLU HB3 H 1 1.756 0.001 . 2 . . 564 . . 117 GLU HB3 . 18632 1 1496 . 1 1 129 129 GLU HG2 H 1 2.259 0.001 . 1 . . 801 . . 117 GLU HG2 . 18632 1 1497 . 1 1 129 129 GLU HG3 H 1 2.259 0.001 . 1 . . 800 . . 117 GLU HG3 . 18632 1 1498 . 1 1 129 129 GLU C C 13 174.868 0.005 . 1 . . 1797 . . 117 GLU C . 18632 1 1499 . 1 1 129 129 GLU CA C 13 54.828 0.005 . 1 . . 1408 . . 117 GLU CA . 18632 1 1500 . 1 1 129 129 GLU CB C 13 33.504 0.005 . 1 . . 1409 . . 117 GLU CB . 18632 1 1501 . 1 1 129 129 GLU CG C 13 36.565 0.005 . 1 . . 802 . . 117 GLU CG . 18632 1 1502 . 1 1 129 129 GLU N N 15 119.470 0.014 . 1 . . 1411 . . 117 GLU N . 18632 1 1503 . 1 1 130 130 TYR H H 1 10.006 0.003 . 1 . . 39 . . 118 TYR H . 18632 1 1504 . 1 1 130 130 TYR HA H 1 5.738 0.001 . 1 . . 566 . . 118 TYR HA . 18632 1 1505 . 1 1 130 130 TYR HB2 H 1 2.894 0.001 . 2 . . 568 . . 118 TYR HB2 . 18632 1 1506 . 1 1 130 130 TYR HB3 H 1 2.666 0.001 . 2 . . 567 . . 118 TYR HB3 . 18632 1 1507 . 1 1 130 130 TYR HD1 H 1 6.773 0.006 . 3 . . 985 . . 118 TYR HD1 . 18632 1 1508 . 1 1 130 130 TYR HD2 H 1 6.773 0.006 . 3 . . 985 . . 118 TYR HD2 . 18632 1 1509 . 1 1 130 130 TYR HE1 H 1 7.100 0.007 . 3 . . 1018 . . 118 TYR HE1 . 18632 1 1510 . 1 1 130 130 TYR HE2 H 1 7.100 0.007 . 3 . . 1018 . . 118 TYR HE2 . 18632 1 1511 . 1 1 130 130 TYR HH H 1 10.287 0.003 . 1 . . 1289 . . 118 TYR HH . 18632 1 1512 . 1 1 130 130 TYR C C 13 174.955 0.005 . 1 . . 1800 . . 118 TYR C . 18632 1 1513 . 1 1 130 130 TYR CA C 13 56.922 0.005 . 1 . . 1407 . . 118 TYR CA . 18632 1 1514 . 1 1 130 130 TYR CB C 13 41.426 0.003 . 1 . . 1406 . . 118 TYR CB . 18632 1 1515 . 1 1 130 130 TYR CD1 C 13 132.319 0.005 . 3 . . 1017 . . 118 TYR CD1 . 18632 1 1516 . 1 1 130 130 TYR CD2 C 13 132.319 0.005 . 3 . . 1017 . . 118 TYR CD2 . 18632 1 1517 . 1 1 130 130 TYR CE1 C 13 117.514 0.005 . 3 . . 1019 . . 118 TYR CE1 . 18632 1 1518 . 1 1 130 130 TYR CE2 C 13 117.514 0.005 . 3 . . 1019 . . 118 TYR CE2 . 18632 1 1519 . 1 1 130 130 TYR N N 15 122.111 0.039 . 1 . . 40 . . 118 TYR N . 18632 1 1520 . 1 1 131 131 ARG H H 1 8.856 0.003 . 1 . . 1404 . . 119 ARG H . 18632 1 1521 . 1 1 131 131 ARG HA H 1 5.173 0.001 . 1 . . 569 . . 119 ARG HA . 18632 1 1522 . 1 1 131 131 ARG HB2 H 1 1.679 0.001 . 2 . . 570 . . 119 ARG HB2 . 18632 1 1523 . 1 1 131 131 ARG HB3 H 1 1.943 0.001 . 2 . . 571 . . 119 ARG HB3 . 18632 1 1524 . 1 1 131 131 ARG HG2 H 1 1.973 0.001 . 2 . . 804 . . 119 ARG HG2 . 18632 1 1525 . 1 1 131 131 ARG HG3 H 1 1.525 0.001 . 2 . . 803 . . 119 ARG HG3 . 18632 1 1526 . 1 1 131 131 ARG HD2 H 1 3.065 0.001 . 2 . . 805 . . 119 ARG HD2 . 18632 1 1527 . 1 1 131 131 ARG HD3 H 1 3.135 0.001 . 2 . . 806 . . 119 ARG HD3 . 18632 1 1528 . 1 1 131 131 ARG C C 13 175.322 0.005 . 1 . . 1801 . . 119 ARG C . 18632 1 1529 . 1 1 131 131 ARG CA C 13 54.366 0.005 . 1 . . 1401 . . 119 ARG CA . 18632 1 1530 . 1 1 131 131 ARG CB C 13 35.159 0.005 . 1 . . 1400 . . 119 ARG CB . 18632 1 1531 . 1 1 131 131 ARG CG C 13 27.849 0.005 . 1 . . 808 . . 119 ARG CG . 18632 1 1532 . 1 1 131 131 ARG CD C 13 43.452 0.005 . 1 . . 807 . . 119 ARG CD . 18632 1 1533 . 1 1 131 131 ARG N N 15 118.116 0.016 . 1 . . 1405 . . 119 ARG N . 18632 1 1534 . 1 1 132 132 ARG H H 1 9.444 0.002 . 1 . . 68 . . 120 ARG H . 18632 1 1535 . 1 1 132 132 ARG HA H 1 5.158 0.001 . 1 . . 572 . . 120 ARG HA . 18632 1 1536 . 1 1 132 132 ARG HB2 H 1 1.716 0.001 . 2 . . 574 . . 120 ARG HB2 . 18632 1 1537 . 1 1 132 132 ARG HB3 H 1 1.382 0.001 . 2 . . 573 . . 120 ARG HB3 . 18632 1 1538 . 1 1 132 132 ARG HG2 H 1 0.843 0.001 . 2 . . 962 . . 120 ARG HG2 . 18632 1 1539 . 1 1 132 132 ARG HG3 H 1 1.080 0.001 . 2 . . 1264 . . 120 ARG HG3 . 18632 1 1540 . 1 1 132 132 ARG HD2 H 1 3.150 0.001 . 2 . . 1262 . . 120 ARG HD2 . 18632 1 1541 . 1 1 132 132 ARG HD3 H 1 3.024 0.001 . 2 . . 1263 . . 120 ARG HD3 . 18632 1 1542 . 1 1 132 132 ARG HE H 1 6.628 0.007 . 1 . . 1617 . . 120 ARG HE . 18632 1 1543 . 1 1 132 132 ARG C C 13 176.000 0.005 . 1 . . 1590 . . 120 ARG C . 18632 1 1544 . 1 1 132 132 ARG CA C 13 52.652 0.005 . 1 . . 1396 . . 120 ARG CA . 18632 1 1545 . 1 1 132 132 ARG CB C 13 29.752 0.005 . 1 . . 1397 . . 120 ARG CB . 18632 1 1546 . 1 1 132 132 ARG CG C 13 25.860 0.005 . 1 . . 963 . . 120 ARG CG . 18632 1 1547 . 1 1 132 132 ARG CD C 13 40.523 0.005 . 1 . . 1261 . . 120 ARG CD . 18632 1 1548 . 1 1 132 132 ARG N N 15 120.893 0.011 . 1 . . 69 . . 120 ARG N . 18632 1 1549 . 1 1 132 132 ARG NE N 15 79.805 0.049 . 1 . . 1618 . . 120 ARG NE . 18632 1 1550 . 1 1 133 133 ASP H H 1 8.586 0.002 . 1 . . 236 . . 121 ASP H . 18632 1 1551 . 1 1 133 133 ASP HA H 1 4.805 0.001 . 1 . . 862 . . 121 ASP HA . 18632 1 1552 . 1 1 133 133 ASP HB2 H 1 2.416 0.001 . 2 . . 864 . . 121 ASP HB2 . 18632 1 1553 . 1 1 133 133 ASP HB3 H 1 2.802 0.001 . 2 . . 863 . . 121 ASP HB3 . 18632 1 1554 . 1 1 133 133 ASP C C 13 176.215 0.005 . 1 . . 1802 . . 121 ASP C . 18632 1 1555 . 1 1 133 133 ASP CA C 13 53.455 0.005 . 1 . . 1399 . . 121 ASP CA . 18632 1 1556 . 1 1 133 133 ASP CB C 13 43.147 0.005 . 1 . . 1398 . . 121 ASP CB . 18632 1 1557 . 1 1 133 133 ASP N N 15 124.282 0.014 . 1 . . 237 . . 121 ASP N . 18632 1 1558 . 1 1 134 134 GLY H H 1 9.013 0.001 . 1 . . 1614 . . 122 GLY H . 18632 1 1559 . 1 1 134 134 GLY HA2 H 1 3.770 0.001 . 2 . . 1070 . . 122 GLY HA2 . 18632 1 1560 . 1 1 134 134 GLY HA3 H 1 4.136 0.001 . 2 . . 1069 . . 122 GLY HA3 . 18632 1 1561 . 1 1 134 134 GLY CA C 13 47.053 0.005 . 1 . . 1629 . . 122 GLY CA . 18632 1 1562 . 1 1 134 134 GLY N N 15 116.039 0.005 . 1 . . 1615 . . 122 GLY N . 18632 1 1563 . 1 1 135 135 ASP HA H 1 4.674 0.001 . 1 . . 588 . . 123 ASP HA . 18632 1 1564 . 1 1 135 135 ASP HB2 H 1 2.951 0.001 . 2 . . 576 . . 123 ASP HB2 . 18632 1 1565 . 1 1 135 135 ASP HB3 H 1 2.265 0.001 . 2 . . 575 . . 123 ASP HB3 . 18632 1 1566 . 1 1 135 135 ASP C C 13 173.153 0.005 . 1 . . 1805 . . 123 ASP C . 18632 1 1567 . 1 1 135 135 ASP CA C 13 55.445 0.005 . 1 . . 1392 . . 123 ASP CA . 18632 1 1568 . 1 1 135 135 ASP CB C 13 40.872 0.005 . 1 . . 1393 . . 123 ASP CB . 18632 1 1569 . 1 1 136 136 TYR H H 1 8.376 0.001 . 1 . . 60 . . 124 TYR H . 18632 1 1570 . 1 1 136 136 TYR HA H 1 5.391 0.001 . 1 . . 577 . . 124 TYR HA . 18632 1 1571 . 1 1 136 136 TYR HB2 H 1 2.880 0.001 . 2 . . 578 . . 124 TYR HB2 . 18632 1 1572 . 1 1 136 136 TYR HB3 H 1 3.281 0.001 . 2 . . 579 . . 124 TYR HB3 . 18632 1 1573 . 1 1 136 136 TYR HD1 H 1 7.126 0.003 . 3 . . 986 . . 124 TYR HD1 . 18632 1 1574 . 1 1 136 136 TYR HD2 H 1 7.126 0.003 . 3 . . 986 . . 124 TYR HD2 . 18632 1 1575 . 1 1 136 136 TYR HE1 H 1 6.848 0.001 . 3 . . 1020 . . 124 TYR HE1 . 18632 1 1576 . 1 1 136 136 TYR HE2 H 1 6.848 0.001 . 3 . . 1020 . . 124 TYR HE2 . 18632 1 1577 . 1 1 136 136 TYR C C 13 176.876 0.005 . 1 . . 1804 . . 124 TYR C . 18632 1 1578 . 1 1 136 136 TYR CA C 13 58.109 0.005 . 1 . . 1390 . . 124 TYR CA . 18632 1 1579 . 1 1 136 136 TYR CB C 13 40.751 0.046 . 1 . . 1391 . . 124 TYR CB . 18632 1 1580 . 1 1 136 136 TYR CD1 C 13 133.054 0.029 . 3 . . 1022 . . 124 TYR CD1 . 18632 1 1581 . 1 1 136 136 TYR CD2 C 13 133.054 0.029 . 3 . . 1022 . . 124 TYR CD2 . 18632 1 1582 . 1 1 136 136 TYR CE1 C 13 117.975 0.005 . 3 . . 1021 . . 124 TYR CE1 . 18632 1 1583 . 1 1 136 136 TYR CE2 C 13 117.975 0.005 . 3 . . 1021 . . 124 TYR CE2 . 18632 1 1584 . 1 1 136 136 TYR N N 15 115.117 0.011 . 1 . . 61 . . 124 TYR N . 18632 1 1585 . 1 1 137 137 LEU H H 1 9.998 0.004 . 1 . . 180 . . 125 LEU H . 18632 1 1586 . 1 1 137 137 LEU HA H 1 4.748 0.001 . 1 . . 580 . . 125 LEU HA . 18632 1 1587 . 1 1 137 137 LEU HB2 H 1 0.419 0.001 . 2 . . 581 . . 125 LEU HB2 . 18632 1 1588 . 1 1 137 137 LEU HB3 H 1 1.695 0.001 . 2 . . 582 . . 125 LEU HB3 . 18632 1 1589 . 1 1 137 137 LEU HG H 1 1.302 0.001 . 1 . . 809 . . 125 LEU HG . 18632 1 1590 . 1 1 137 137 LEU HD11 H 1 0.233 0.001 . 2 . . 810 . . 125 LEU HD11 . 18632 1 1591 . 1 1 137 137 LEU HD12 H 1 0.233 0.001 . 2 . . 810 . . 125 LEU HD12 . 18632 1 1592 . 1 1 137 137 LEU HD13 H 1 0.233 0.001 . 2 . . 810 . . 125 LEU HD13 . 18632 1 1593 . 1 1 137 137 LEU HD21 H 1 0.497 0.001 . 2 . . 811 . . 125 LEU HD21 . 18632 1 1594 . 1 1 137 137 LEU HD22 H 1 0.497 0.001 . 2 . . 811 . . 125 LEU HD22 . 18632 1 1595 . 1 1 137 137 LEU HD23 H 1 0.497 0.001 . 2 . . 811 . . 125 LEU HD23 . 18632 1 1596 . 1 1 137 137 LEU C C 13 174.319 0.005 . 1 . . 1803 . . 125 LEU C . 18632 1 1597 . 1 1 137 137 LEU CA C 13 54.360 0.005 . 1 . . 1389 . . 125 LEU CA . 18632 1 1598 . 1 1 137 137 LEU CB C 13 44.804 0.005 . 1 . . 1388 . . 125 LEU CB . 18632 1 1599 . 1 1 137 137 LEU CG C 13 26.782 0.005 . 1 . . 814 . . 125 LEU CG . 18632 1 1600 . 1 1 137 137 LEU CD1 C 13 25.495 0.005 . 2 . . 813 . . 125 LEU CD1 . 18632 1 1601 . 1 1 137 137 LEU CD2 C 13 23.560 0.005 . 2 . . 812 . . 125 LEU CD2 . 18632 1 1602 . 1 1 137 137 LEU N N 15 127.764 0.039 . 1 . . 181 . . 125 LEU N . 18632 1 1603 . 1 1 138 138 VAL H H 1 9.708 0.003 . 1 . . 37 . . 126 VAL H . 18632 1 1604 . 1 1 138 138 VAL HA H 1 4.760 0.001 . 1 . . 583 . . 126 VAL HA . 18632 1 1605 . 1 1 138 138 VAL HB H 1 1.864 0.001 . 1 . . 584 . . 126 VAL HB . 18632 1 1606 . 1 1 138 138 VAL HG11 H 1 0.826 0.001 . 2 . . 645 . . 126 VAL HG11 . 18632 1 1607 . 1 1 138 138 VAL HG12 H 1 0.826 0.001 . 2 . . 645 . . 126 VAL HG12 . 18632 1 1608 . 1 1 138 138 VAL HG13 H 1 0.826 0.001 . 2 . . 645 . . 126 VAL HG13 . 18632 1 1609 . 1 1 138 138 VAL HG21 H 1 0.316 0.001 . 2 . . 644 . . 126 VAL HG21 . 18632 1 1610 . 1 1 138 138 VAL HG22 H 1 0.316 0.001 . 2 . . 644 . . 126 VAL HG22 . 18632 1 1611 . 1 1 138 138 VAL HG23 H 1 0.316 0.001 . 2 . . 644 . . 126 VAL HG23 . 18632 1 1612 . 1 1 138 138 VAL C C 13 175.304 0.005 . 1 . . 1807 . . 126 VAL C . 18632 1 1613 . 1 1 138 138 VAL CA C 13 61.167 0.005 . 1 . . 1385 . . 126 VAL CA . 18632 1 1614 . 1 1 138 138 VAL CB C 13 33.117 0.005 . 1 . . 1384 . . 126 VAL CB . 18632 1 1615 . 1 1 138 138 VAL CG1 C 13 21.710 0.005 . 2 . . 647 . . 126 VAL CG1 . 18632 1 1616 . 1 1 138 138 VAL CG2 C 13 20.452 0.005 . 2 . . 646 . . 126 VAL CG2 . 18632 1 1617 . 1 1 138 138 VAL N N 15 129.462 0.015 . 1 . . 38 . . 126 VAL N . 18632 1 1618 . 1 1 139 139 MET H H 1 9.412 0.001 . 1 . . 111 . . 127 MET H . 18632 1 1619 . 1 1 139 139 MET HA H 1 5.206 0.001 . 1 . . 585 . . 127 MET HA . 18632 1 1620 . 1 1 139 139 MET HB2 H 1 1.543 0.001 . 2 . . 586 . . 127 MET HB2 . 18632 1 1621 . 1 1 139 139 MET HB3 H 1 2.045 0.001 . 2 . . 587 . . 127 MET HB3 . 18632 1 1622 . 1 1 139 139 MET HG2 H 1 1.030 0.001 . 2 . . 959 . . 127 MET HG2 . 18632 1 1623 . 1 1 139 139 MET HG3 H 1 1.647 0.001 . 2 . . 960 . . 127 MET HG3 . 18632 1 1624 . 1 1 139 139 MET C C 13 173.915 0.005 . 1 . . 1811 . . 127 MET C . 18632 1 1625 . 1 1 139 139 MET CA C 13 53.463 0.005 . 1 . . 1387 . . 127 MET CA . 18632 1 1626 . 1 1 139 139 MET CB C 13 36.995 0.005 . 1 . . 1386 . . 127 MET CB . 18632 1 1627 . 1 1 139 139 MET CG C 13 32.401 0.005 . 1 . . 961 . . 127 MET CG . 18632 1 1628 . 1 1 139 139 MET N N 15 130.006 0.011 . 1 . . 112 . . 127 MET N . 18632 1 1629 . 1 1 140 140 LYS H H 1 9.484 0.002 . 1 . . 157 . . 128 LYS H . 18632 1 1630 . 1 1 140 140 LYS HA H 1 5.412 0.001 . 1 . . 589 . . 128 LYS HA . 18632 1 1631 . 1 1 140 140 LYS HB2 H 1 1.611 0.001 . 2 . . 815 . . 128 LYS HB2 . 18632 1 1632 . 1 1 140 140 LYS HB3 H 1 1.697 0.001 . 2 . . 590 . . 128 LYS HB3 . 18632 1 1633 . 1 1 140 140 LYS HG2 H 1 1.429 0.001 . 2 . . 817 . . 128 LYS HG2 . 18632 1 1634 . 1 1 140 140 LYS HG3 H 1 1.207 0.001 . 2 . . 816 . . 128 LYS HG3 . 18632 1 1635 . 1 1 140 140 LYS HD2 H 1 1.540 0.001 . 1 . . 820 . . 128 LYS HD2 . 18632 1 1636 . 1 1 140 140 LYS HD3 H 1 1.540 0.001 . 1 . . 821 . . 128 LYS HD3 . 18632 1 1637 . 1 1 140 140 LYS HE2 H 1 2.813 0.001 . 1 . . 818 . . 128 LYS HE2 . 18632 1 1638 . 1 1 140 140 LYS HE3 H 1 2.813 0.001 . 1 . . 819 . . 128 LYS HE3 . 18632 1 1639 . 1 1 140 140 LYS C C 13 176.618 0.005 . 1 . . 1810 . . 128 LYS C . 18632 1 1640 . 1 1 140 140 LYS CA C 13 54.551 0.005 . 1 . . 1583 . . 128 LYS CA . 18632 1 1641 . 1 1 140 140 LYS CB C 13 35.742 0.005 . 1 . . 1582 . . 128 LYS CB . 18632 1 1642 . 1 1 140 140 LYS CG C 13 24.960 0.005 . 1 . . 822 . . 128 LYS CG . 18632 1 1643 . 1 1 140 140 LYS CD C 13 29.679 0.005 . 1 . . 823 . . 128 LYS CD . 18632 1 1644 . 1 1 140 140 LYS N N 15 128.818 0.008 . 1 . . 158 . . 128 LYS N . 18632 1 1645 . 1 1 141 141 MET H H 1 8.416 0.001 . 1 . . 19 . . 129 MET H . 18632 1 1646 . 1 1 141 141 MET HA H 1 5.108 0.001 . 1 . . 591 . . 129 MET HA . 18632 1 1647 . 1 1 141 141 MET HB2 H 1 1.956 0.001 . 2 . . 592 . . 129 MET HB2 . 18632 1 1648 . 1 1 141 141 MET HB3 H 1 0.947 0.001 . 2 . . 824 . . 129 MET HB3 . 18632 1 1649 . 1 1 141 141 MET HG2 H 1 1.701 0.001 . 2 . . 825 . . 129 MET HG2 . 18632 1 1650 . 1 1 141 141 MET HG3 H 1 1.854 0.001 . 2 . . 826 . . 129 MET HG3 . 18632 1 1651 . 1 1 141 141 MET C C 13 174.958 0.005 . 1 . . 1809 . . 129 MET C . 18632 1 1652 . 1 1 141 141 MET CA C 13 53.910 0.005 . 1 . . 1580 . . 129 MET CA . 18632 1 1653 . 1 1 141 141 MET CB C 13 35.607 0.005 . 1 . . 1581 . . 129 MET CB . 18632 1 1654 . 1 1 141 141 MET CG C 13 32.009 0.005 . 1 . . 827 . . 129 MET CG . 18632 1 1655 . 1 1 141 141 MET N N 15 124.549 0.053 . 1 . . 20 . . 129 MET N . 18632 1 1656 . 1 1 142 142 SER H H 1 10.160 0.002 . 1 . . 127 . . 130 SER H . 18632 1 1657 . 1 1 142 142 SER HA H 1 5.706 0.001 . 1 . . 593 . . 130 SER HA . 18632 1 1658 . 1 1 142 142 SER HB2 H 1 3.651 0.001 . 2 . . 594 . . 130 SER HB2 . 18632 1 1659 . 1 1 142 142 SER HB3 H 1 3.759 0.001 . 2 . . 595 . . 130 SER HB3 . 18632 1 1660 . 1 1 142 142 SER C C 13 173.145 0.005 . 1 . . 1808 . . 130 SER C . 18632 1 1661 . 1 1 142 142 SER CA C 13 57.519 0.005 . 1 . . 1578 . . 130 SER CA . 18632 1 1662 . 1 1 142 142 SER CB C 13 65.706 0.005 . 1 . . 1579 . . 130 SER CB . 18632 1 1663 . 1 1 142 142 SER N N 15 117.171 0.03 . 1 . . 128 . . 130 SER N . 18632 1 1664 . 1 1 143 143 TRP H H 1 9.160 0.003 . 1 . . 204 . . 131 TRP H . 18632 1 1665 . 1 1 143 143 TRP HA H 1 4.953 0.001 . 1 . . 596 . . 131 TRP HA . 18632 1 1666 . 1 1 143 143 TRP HB2 H 1 2.815 0.001 . 2 . . 597 . . 131 TRP HB2 . 18632 1 1667 . 1 1 143 143 TRP HB3 H 1 3.378 0.001 . 2 . . 598 . . 131 TRP HB3 . 18632 1 1668 . 1 1 143 143 TRP HD1 H 1 6.533 0.002 . 1 . . 993 . . 131 TRP HD1 . 18632 1 1669 . 1 1 143 143 TRP HE1 H 1 10.069 0.001 . 1 . . 117 . . 131 TRP HE1 . 18632 1 1670 . 1 1 143 143 TRP HE3 H 1 7.988 0.001 . 1 . . 1049 . . 131 TRP HE3 . 18632 1 1671 . 1 1 143 143 TRP HZ2 H 1 7.404 0.001 . 1 . . 994 . . 131 TRP HZ2 . 18632 1 1672 . 1 1 143 143 TRP HZ3 H 1 7.337 0.001 . 1 . . 1040 . . 131 TRP HZ3 . 18632 1 1673 . 1 1 143 143 TRP HH2 H 1 7.216 0.001 . 1 . . 999 . . 131 TRP HH2 . 18632 1 1674 . 1 1 143 143 TRP C C 13 174.791 0.005 . 1 . . 1812 . . 131 TRP C . 18632 1 1675 . 1 1 143 143 TRP CA C 13 57.047 0.005 . 1 . . 1576 . . 131 TRP CA . 18632 1 1676 . 1 1 143 143 TRP CB C 13 33.561 0.005 . 1 . . 1577 . . 131 TRP CB . 18632 1 1677 . 1 1 143 143 TRP CD1 C 13 125.478 0.005 . 1 . . 1002 . . 131 TRP CD1 . 18632 1 1678 . 1 1 143 143 TRP CE3 C 13 120.906 0.005 . 1 . . 1050 . . 131 TRP CE3 . 18632 1 1679 . 1 1 143 143 TRP CZ2 C 13 114.821 0.005 . 1 . . 996 . . 131 TRP CZ2 . 18632 1 1680 . 1 1 143 143 TRP CZ3 C 13 122.793 0.005 . 1 . . 1041 . . 131 TRP CZ3 . 18632 1 1681 . 1 1 143 143 TRP CH2 C 13 126.122 0.005 . 1 . . 1000 . . 131 TRP CH2 . 18632 1 1682 . 1 1 143 143 TRP N N 15 126.683 0.022 . 1 . . 205 . . 131 TRP N . 18632 1 1683 . 1 1 143 143 TRP NE1 N 15 127.410 0.021 . 1 . . 118 . . 131 TRP NE1 . 18632 1 1684 . 1 1 144 144 LYS H H 1 8.487 0.001 . 1 . . 217 . . 132 LYS H . 18632 1 1685 . 1 1 144 144 LYS HA H 1 3.448 0.001 . 1 . . 599 . . 132 LYS HA . 18632 1 1686 . 1 1 144 144 LYS HB2 H 1 1.822 0.001 . 2 . . 601 . . 132 LYS HB2 . 18632 1 1687 . 1 1 144 144 LYS HB3 H 1 1.570 0.001 . 2 . . 600 . . 132 LYS HB3 . 18632 1 1688 . 1 1 144 144 LYS HG2 H 1 0.612 0.001 . 1 . . 831 . . 132 LYS HG2 . 18632 1 1689 . 1 1 144 144 LYS HG3 H 1 0.612 0.001 . 1 . . 830 . . 132 LYS HG3 . 18632 1 1690 . 1 1 144 144 LYS HD2 H 1 1.493 0.001 . 1 . . 828 . . 132 LYS HD2 . 18632 1 1691 . 1 1 144 144 LYS HD3 H 1 1.493 0.001 . 1 . . 829 . . 132 LYS HD3 . 18632 1 1692 . 1 1 144 144 LYS HE2 H 1 2.750 0.001 . 2 . . 832 . . 132 LYS HE2 . 18632 1 1693 . 1 1 144 144 LYS HE3 H 1 2.860 0.001 . 2 . . 833 . . 132 LYS HE3 . 18632 1 1694 . 1 1 144 144 LYS C C 13 176.420 0.005 . 1 . . 1816 . . 132 LYS C . 18632 1 1695 . 1 1 144 144 LYS CA C 13 57.040 0.005 . 1 . . 1575 . . 132 LYS CA . 18632 1 1696 . 1 1 144 144 LYS CB C 13 30.142 0.005 . 1 . . 1574 . . 132 LYS CB . 18632 1 1697 . 1 1 144 144 LYS CG C 13 25.010 0.005 . 1 . . 834 . . 132 LYS CG . 18632 1 1698 . 1 1 144 144 LYS CD C 13 29.194 0.005 . 1 . . 836 . . 132 LYS CD . 18632 1 1699 . 1 1 144 144 LYS CE C 13 42.376 0.005 . 1 . . 835 . . 132 LYS CE . 18632 1 1700 . 1 1 144 144 LYS N N 15 123.268 0.011 . 1 . . 218 . . 132 LYS N . 18632 1 1701 . 1 1 145 145 GLY H H 1 8.524 0.002 . 1 . . 161 . . 133 GLY H . 18632 1 1702 . 1 1 145 145 GLY HA2 H 1 3.479 0.001 . 2 . . 532 . . 133 GLY HA2 . 18632 1 1703 . 1 1 145 145 GLY HA3 H 1 4.108 0.001 . 2 . . 533 . . 133 GLY HA3 . 18632 1 1704 . 1 1 145 145 GLY C C 13 174.192 0.005 . 1 . . 1815 . . 133 GLY C . 18632 1 1705 . 1 1 145 145 GLY CA C 13 45.235 0.005 . 1 . . 1573 . . 133 GLY CA . 18632 1 1706 . 1 1 145 145 GLY N N 15 103.583 0.022 . 1 . . 162 . . 133 GLY N . 18632 1 1707 . 1 1 146 146 VAL H H 1 8.167 0.002 . 1 . . 54 . . 134 VAL H . 18632 1 1708 . 1 1 146 146 VAL HA H 1 4.171 0.001 . 1 . . 898 . . 134 VAL HA . 18632 1 1709 . 1 1 146 146 VAL HB H 1 2.317 0.001 . 1 . . 899 . . 134 VAL HB . 18632 1 1710 . 1 1 146 146 VAL HG11 H 1 0.912 0.001 . 2 . . 1065 . . 134 VAL HG11 . 18632 1 1711 . 1 1 146 146 VAL HG12 H 1 0.912 0.001 . 2 . . 1065 . . 134 VAL HG12 . 18632 1 1712 . 1 1 146 146 VAL HG13 H 1 0.912 0.001 . 2 . . 1065 . . 134 VAL HG13 . 18632 1 1713 . 1 1 146 146 VAL HG21 H 1 0.947 0.001 . 2 . . 1067 . . 134 VAL HG21 . 18632 1 1714 . 1 1 146 146 VAL HG22 H 1 0.947 0.001 . 2 . . 1067 . . 134 VAL HG22 . 18632 1 1715 . 1 1 146 146 VAL HG23 H 1 0.947 0.001 . 2 . . 1067 . . 134 VAL HG23 . 18632 1 1716 . 1 1 146 146 VAL C C 13 174.952 0.005 . 1 . . 1814 . . 134 VAL C . 18632 1 1717 . 1 1 146 146 VAL CA C 13 62.617 0.005 . 1 . . 1571 . . 134 VAL CA . 18632 1 1718 . 1 1 146 146 VAL CB C 13 32.562 0.005 . 1 . . 1572 . . 134 VAL CB . 18632 1 1719 . 1 1 146 146 VAL CG1 C 13 21.357 0.005 . 2 . . 1066 . . 134 VAL CG1 . 18632 1 1720 . 1 1 146 146 VAL CG2 C 13 21.109 0.005 . 2 . . 1068 . . 134 VAL CG2 . 18632 1 1721 . 1 1 146 146 VAL N N 15 124.659 0.007 . 1 . . 55 . . 134 VAL N . 18632 1 1722 . 1 1 147 147 SER H H 1 8.675 0.002 . 1 . . 254 . . 135 SER H . 18632 1 1723 . 1 1 147 147 SER HA H 1 5.884 0.001 . 1 . . 602 . . 135 SER HA . 18632 1 1724 . 1 1 147 147 SER HB2 H 1 3.808 0.001 . 2 . . 604 . . 135 SER HB2 . 18632 1 1725 . 1 1 147 147 SER HB3 H 1 3.756 0.001 . 2 . . 603 . . 135 SER HB3 . 18632 1 1726 . 1 1 147 147 SER C C 13 173.145 0.005 . 1 . . 1813 . . 135 SER C . 18632 1 1727 . 1 1 147 147 SER CA C 13 56.753 0.005 . 1 . . 1569 . . 135 SER CA . 18632 1 1728 . 1 1 147 147 SER CB C 13 66.075 0.005 . 1 . . 1570 . . 135 SER CB . 18632 1 1729 . 1 1 147 147 SER N N 15 120.741 0.011 . 1 . . 255 . . 135 SER N . 18632 1 1730 . 1 1 148 148 THR H H 1 9.011 0.004 . 1 . . 115 . . 136 THR H . 18632 1 1731 . 1 1 148 148 THR HA H 1 5.083 0.001 . 1 . . 605 . . 136 THR HA . 18632 1 1732 . 1 1 148 148 THR HB H 1 4.142 0.001 . 1 . . 606 . . 136 THR HB . 18632 1 1733 . 1 1 148 148 THR HG1 H 1 4.387 0.004 . 1 . . 1628 . . 136 THR HG1 . 18632 1 1734 . 1 1 148 148 THR HG21 H 1 0.767 0.001 . 1 . . 837 . . 136 THR HG21 . 18632 1 1735 . 1 1 148 148 THR HG22 H 1 0.767 0.001 . 1 . . 837 . . 136 THR HG22 . 18632 1 1736 . 1 1 148 148 THR HG23 H 1 0.767 0.001 . 1 . . 837 . . 136 THR HG23 . 18632 1 1737 . 1 1 148 148 THR C C 13 171.846 0.005 . 1 . . 1606 . . 136 THR C . 18632 1 1738 . 1 1 148 148 THR CA C 13 59.092 0.005 . 1 . . 1568 . . 136 THR CA . 18632 1 1739 . 1 1 148 148 THR CB C 13 70.552 0.005 . 1 . . 1567 . . 136 THR CB . 18632 1 1740 . 1 1 148 148 THR CG2 C 13 21.284 0.005 . 1 . . 838 . . 136 THR CG2 . 18632 1 1741 . 1 1 148 148 THR N N 15 119.094 0.008 . 1 . . 116 . . 136 THR N . 18632 1 1742 . 1 1 149 149 SER H H 1 7.408 0.002 . 1 . . 102 . . 137 SER H . 18632 1 1743 . 1 1 149 149 SER HA H 1 5.556 0.004 . 1 . . 860 . . 137 SER HA . 18632 1 1744 . 1 1 149 149 SER HB2 H 1 3.617 0.001 . 2 . . 861 . . 137 SER HB2 . 18632 1 1745 . 1 1 149 149 SER HB3 H 1 3.149 0.001 . 2 . . 859 . . 137 SER HB3 . 18632 1 1746 . 1 1 149 149 SER C C 13 172.510 0.005 . 1 . . 1605 . . 137 SER C . 18632 1 1747 . 1 1 149 149 SER CA C 13 57.353 0.005 . 1 . . 1565 . . 137 SER CA . 18632 1 1748 . 1 1 149 149 SER CB C 13 66.373 0.005 . 1 . . 1566 . . 137 SER CB . 18632 1 1749 . 1 1 149 149 SER N N 15 120.250 0.027 . 1 . . 103 . . 137 SER N . 18632 1 1750 . 1 1 150 150 ARG H H 1 9.268 0.001 . 1 . . 1601 . . 138 ARG H . 18632 1 1751 . 1 1 150 150 ARG N N 15 122.251 0.08 . 1 . . 1602 . . 138 ARG N . 18632 1 1752 . 1 1 151 151 TYR HA H 1 4.756 0.008 . 1 . . 967 . . 139 TYR HA . 18632 1 1753 . 1 1 151 151 TYR HB2 H 1 2.799 0.001 . 2 . . 968 . . 139 TYR HB2 . 18632 1 1754 . 1 1 151 151 TYR HB3 H 1 2.498 0.001 . 2 . . 607 . . 139 TYR HB3 . 18632 1 1755 . 1 1 151 151 TYR HD1 H 1 6.522 0.003 . 3 . . 987 . . 139 TYR HD1 . 18632 1 1756 . 1 1 151 151 TYR HD2 H 1 6.522 0.003 . 3 . . 987 . . 139 TYR HD2 . 18632 1 1757 . 1 1 151 151 TYR HE1 H 1 6.466 0.003 . 3 . . 1015 . . 139 TYR HE1 . 18632 1 1758 . 1 1 151 151 TYR HE2 H 1 6.466 0.003 . 3 . . 1015 . . 139 TYR HE2 . 18632 1 1759 . 1 1 151 151 TYR C C 13 174.635 0.005 . 1 . . 1818 . . 139 TYR C . 18632 1 1760 . 1 1 151 151 TYR CA C 13 58.357 0.005 . 1 . . 1563 . . 139 TYR CA . 18632 1 1761 . 1 1 151 151 TYR CB C 13 39.512 0.005 . 1 . . 1564 . . 139 TYR CB . 18632 1 1762 . 1 1 151 151 TYR CD1 C 13 132.721 0.012 . 3 . . 1011 . . 139 TYR CD1 . 18632 1 1763 . 1 1 151 151 TYR CD2 C 13 132.721 0.012 . 3 . . 1011 . . 139 TYR CD2 . 18632 1 1764 . 1 1 151 151 TYR CE1 C 13 118.135 0.005 . 3 . . 1016 . . 139 TYR CE1 . 18632 1 1765 . 1 1 151 151 TYR CE2 C 13 118.135 0.005 . 3 . . 1016 . . 139 TYR CE2 . 18632 1 1766 . 1 1 152 152 TYR H H 1 9.799 0.004 . 1 . . 88 . . 140 TYR H . 18632 1 1767 . 1 1 152 152 TYR HA H 1 5.109 0.001 . 1 . . 608 . . 140 TYR HA . 18632 1 1768 . 1 1 152 152 TYR HB2 H 1 2.635 0.001 . 2 . . 610 . . 140 TYR HB2 . 18632 1 1769 . 1 1 152 152 TYR HB3 H 1 3.469 0.001 . 2 . . 609 . . 140 TYR HB3 . 18632 1 1770 . 1 1 152 152 TYR HD1 H 1 7.125 0.001 . 3 . . 1153 . . 140 TYR HD1 . 18632 1 1771 . 1 1 152 152 TYR HD2 H 1 7.125 0.001 . 3 . . 1153 . . 140 TYR HD2 . 18632 1 1772 . 1 1 152 152 TYR HE1 H 1 6.528 0.001 . 3 . . 1154 . . 140 TYR HE1 . 18632 1 1773 . 1 1 152 152 TYR HE2 H 1 6.528 0.001 . 3 . . 1154 . . 140 TYR HE2 . 18632 1 1774 . 1 1 152 152 TYR C C 13 175.213 0.005 . 1 . . 1817 . . 140 TYR C . 18632 1 1775 . 1 1 152 152 TYR CA C 13 55.666 0.005 . 1 . . 1560 . . 140 TYR CA . 18632 1 1776 . 1 1 152 152 TYR CB C 13 40.420 0.005 . 1 . . 1559 . . 140 TYR CB . 18632 1 1777 . 1 1 152 152 TYR CD1 C 13 133.121 0.005 . 3 . . 1152 . . 140 TYR CD1 . 18632 1 1778 . 1 1 152 152 TYR CD2 C 13 133.121 0.005 . 3 . . 1152 . . 140 TYR CD2 . 18632 1 1779 . 1 1 152 152 TYR CE1 C 13 118.712 0.005 . 3 . . 1155 . . 140 TYR CE1 . 18632 1 1780 . 1 1 152 152 TYR CE2 C 13 118.712 0.005 . 3 . . 1155 . . 140 TYR CE2 . 18632 1 1781 . 1 1 152 152 TYR N N 15 124.226 0.031 . 1 . . 89 . . 140 TYR N . 18632 1 1782 . 1 1 153 153 LYS H H 1 9.415 0.002 . 1 . . 196 . . 141 LYS H . 18632 1 1783 . 1 1 153 153 LYS HA H 1 4.115 0.001 . 1 . . 611 . . 141 LYS HA . 18632 1 1784 . 1 1 153 153 LYS HB2 H 1 1.945 0.001 . 2 . . 613 . . 141 LYS HB2 . 18632 1 1785 . 1 1 153 153 LYS HB3 H 1 1.709 0.001 . 2 . . 612 . . 141 LYS HB3 . 18632 1 1786 . 1 1 153 153 LYS HG2 H 1 0.818 0.001 . 2 . . 839 . . 141 LYS HG2 . 18632 1 1787 . 1 1 153 153 LYS HG3 H 1 1.509 0.001 . 2 . . 844 . . 141 LYS HG3 . 18632 1 1788 . 1 1 153 153 LYS HD2 H 1 1.467 0.001 . 2 . . 846 . . 141 LYS HD2 . 18632 1 1789 . 1 1 153 153 LYS HD3 H 1 1.545 0.001 . 2 . . 847 . . 141 LYS HD3 . 18632 1 1790 . 1 1 153 153 LYS HE2 H 1 2.915 0.001 . 1 . . 842 . . 141 LYS HE2 . 18632 1 1791 . 1 1 153 153 LYS HE3 H 1 2.915 0.001 . 1 . . 841 . . 141 LYS HE3 . 18632 1 1792 . 1 1 153 153 LYS C C 13 177.348 0.005 . 1 . . 1819 . . 141 LYS C . 18632 1 1793 . 1 1 153 153 LYS CA C 13 56.137 0.005 . 1 . . 1558 . . 141 LYS CA . 18632 1 1794 . 1 1 153 153 LYS CB C 13 34.302 0.005 . 1 . . 1557 . . 141 LYS CB . 18632 1 1795 . 1 1 153 153 LYS CG C 13 24.725 0.005 . 1 . . 843 . . 141 LYS CG . 18632 1 1796 . 1 1 153 153 LYS CD C 13 28.346 0.005 . 1 . . 845 . . 141 LYS CD . 18632 1 1797 . 1 1 153 153 LYS CE C 13 42.390 0.005 . 1 . . 840 . . 141 LYS CE . 18632 1 1798 . 1 1 153 153 LYS N N 15 129.051 0.02 . 1 . . 197 . . 141 LYS N . 18632 1 1799 . 1 1 154 154 LYS H H 1 9.175 0.002 . 1 . . 188 . . 142 LYS H . 18632 1 1800 . 1 1 154 154 LYS HA H 1 4.182 0.001 . 1 . . 614 . . 142 LYS HA . 18632 1 1801 . 1 1 154 154 LYS HB2 H 1 1.588 0.001 . 2 . . 615 . . 142 LYS HB2 . 18632 1 1802 . 1 1 154 154 LYS HB3 H 1 1.831 0.001 . 2 . . 616 . . 142 LYS HB3 . 18632 1 1803 . 1 1 154 154 LYS HG2 H 1 0.759 0.001 . 1 . . 848 . . 142 LYS HG2 . 18632 1 1804 . 1 1 154 154 LYS HE2 H 1 3.009 0.001 . 2 . . 851 . . 142 LYS HE2 . 18632 1 1805 . 1 1 154 154 LYS HE3 H 1 2.959 0.001 . 2 . . 849 . . 142 LYS HE3 . 18632 1 1806 . 1 1 154 154 LYS C C 13 175.313 0.005 . 1 . . 1820 . . 142 LYS C . 18632 1 1807 . 1 1 154 154 LYS CA C 13 58.645 0.005 . 1 . . 1556 . . 142 LYS CA . 18632 1 1808 . 1 1 154 154 LYS CB C 13 32.991 0.005 . 1 . . 1555 . . 142 LYS CB . 18632 1 1809 . 1 1 154 154 LYS CG C 13 25.003 0.005 . 1 . . 852 . . 142 LYS CG . 18632 1 1810 . 1 1 154 154 LYS CD C 13 29.171 0.005 . 1 . . 1129 . . 142 LYS CD . 18632 1 1811 . 1 1 154 154 LYS CE C 13 42.774 0.005 . 1 . . 850 . . 142 LYS CE . 18632 1 1812 . 1 1 154 154 LYS N N 15 133.301 0.038 . 1 . . 189 . . 142 LYS N . 18632 1 1813 . 1 1 155 155 GLN H H 1 8.646 0.003 . 1 . . 121 . . 143 GLN H . 18632 1 1814 . 1 1 155 155 GLN HA H 1 4.148 0.009 . 1 . . 874 . . 143 GLN HA . 18632 1 1815 . 1 1 155 155 GLN HB2 H 1 2.171 0.001 . 2 . . 879 . . 143 GLN HB2 . 18632 1 1816 . 1 1 155 155 GLN HB3 H 1 1.637 0.001 . 2 . . 876 . . 143 GLN HB3 . 18632 1 1817 . 1 1 155 155 GLN HG2 H 1 2.171 0.001 . 2 . . 878 . . 143 GLN HG2 . 18632 1 1818 . 1 1 155 155 GLN HG3 H 1 2.324 0.001 . 2 . . 875 . . 143 GLN HG3 . 18632 1 1819 . 1 1 155 155 GLN HE21 H 1 7.044 0.002 . 1 . . 18 . . 143 GLN HE21 . 18632 1 1820 . 1 1 155 155 GLN HE22 H 1 7.475 0.002 . 1 . . 17 . . 143 GLN HE22 . 18632 1 1821 . 1 1 155 155 GLN C C 13 180.987 0.005 . 1 . . 1821 . . 143 GLN C . 18632 1 1822 . 1 1 155 155 GLN CA C 13 55.932 0.005 . 1 . . 1554 . . 143 GLN CA . 18632 1 1823 . 1 1 155 155 GLN CB C 13 31.148 0.005 . 1 . . 1553 . . 143 GLN CB . 18632 1 1824 . 1 1 155 155 GLN CG C 13 34.969 0.005 . 1 . . 877 . . 143 GLN CG . 18632 1 1825 . 1 1 155 155 GLN N N 15 132.205 0.008 . 1 . . 122 . . 143 GLN N . 18632 1 1826 . 1 1 155 155 GLN NE2 N 15 115.543 0.008 . 1 . . 16 . . 143 GLN NE2 . 18632 1 1827 . 2 2 1 1 OLA H9 H 1 5.155 0.01 . 1 . . 1283 . . 1 OLA H9 . 18632 1 1828 . 2 2 1 1 OLA H10 H 1 5.162 0.012 . 1 . . 1831 . . 1 OLA H10 . 18632 1 1829 . 2 2 1 1 OLA H21 H 1 1.838 0.001 . 1 . . 1625 . . 1 OLA H21 . 18632 1 1830 . 2 2 1 1 OLA H22 H 1 1.838 0.001 . 1 . . 1837 . . 1 OLA H22 . 18632 1 1831 . 2 2 1 1 OLA H81 H 1 1.836 0.004 . 1 . . 1833 . . 1 OLA H81 . 18632 1 1832 . 2 2 1 1 OLA H82 H 1 1.835 0.004 . 1 . . 1622 . . 1 OLA H82 . 18632 1 1833 . 2 2 1 1 OLA H111 H 1 1.838 0.004 . 1 . . 1623 . . 1 OLA H111 . 18632 1 1834 . 2 2 1 1 OLA H112 H 1 1.838 0.004 . 1 . . 1624 . . 1 OLA H112 . 18632 1 1835 . 2 2 1 1 OLA H161 H 1 0.910 0.004 . 1 . . 1287 . . 1 OLA H161 . 18632 1 1836 . 2 2 1 1 OLA H181 H 1 0.832 0.003 . 1 . . 1832 . . 1 OLA H181 . 18632 1 1837 . 2 2 1 1 OLA H182 H 1 0.832 0.003 . 1 . . 1832 . . 1 OLA H182 . 18632 1 1838 . 2 2 1 1 OLA H183 H 1 0.832 0.003 . 1 . . 1832 . . 1 OLA H183 . 18632 1 1839 . 2 2 1 1 OLA C2 C 13 41.008 0.005 . 1 . . 1838 . . 1 OLA C2 . 18632 1 1840 . 2 2 1 1 OLA C8 C 13 29.568 0.005 . 1 . . 1836 . . 1 OLA C8 . 18632 1 1841 . 2 2 1 1 OLA C10 C 13 133.713 0.005 . 1 . . 1835 . . 1 OLA C10 . 18632 1 1842 . 2 2 1 1 OLA C18 C 13 17.312 0.005 . 1 . . 1834 . . 1 OLA C18 . 18632 1 stop_ save_ ################################### # 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_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1_2 _Assigned_chem_shift_list.Entry_ID 18632 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $Asp18NC005 _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 8 '3D 1H-13C NOESY' 2 $NC005Asp18 isotropic 18632 2 9 '2D 1H-13C HSQC/HMQC' 2 $NC005Asp18 isotropic 18632 2 14 'mxen HCCH (hC_CH.relayed)' 2 $NC005Asp18 isotropic 18632 2 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 1 1 MET HA H 1 3.755 0.001 . 1 . . 1662 . . -11 MET HA . 18632 2 2 . 1 1 1 1 MET HB2 H 1 2.525 0.001 . 1 . . 1677 . . -11 MET HB2 . 18632 2 3 . 1 1 1 1 MET HB3 H 1 2.525 0.001 . 1 . . 1676 . . -11 MET HB3 . 18632 2 4 . 1 1 1 1 MET HG2 H 1 2.403 0.001 . 1 . . 1661 . . -11 MET HG2 . 18632 2 5 . 1 1 1 1 MET HG3 H 1 2.403 0.001 . 1 . . 1281 . . -11 MET HG3 . 18632 2 6 . 1 1 1 1 MET HE1 H 1 2.028 0.001 . 1 . . 1243 . . -11 MET HE1 . 18632 2 7 . 1 1 1 1 MET HE2 H 1 2.028 0.001 . 1 . . 1243 . . -11 MET HE2 . 18632 2 8 . 1 1 1 1 MET HE3 H 1 2.028 0.001 . 1 . . 1243 . . -11 MET HE3 . 18632 2 9 . 1 1 1 1 MET CA C 13 55.801 0.035 . 1 . . 1663 . . -11 MET CA . 18632 2 10 . 1 1 1 1 MET CB C 13 31.493 0.018 . 1 . . 1675 . . -11 MET CB . 18632 2 11 . 1 1 1 1 MET CG C 13 35.081 0.069 . 1 . . 1282 . . -11 MET CG . 18632 2 12 . 1 1 1 1 MET CE C 13 16.806 0.005 . 1 . . 1244 . . -11 MET CE . 18632 2 13 . 1 1 2 2 ARG HA H 1 4.329 0.001 . 1 . . 970 . . -10 ARG HA . 18632 2 14 . 1 1 2 2 ARG HB2 H 1 1.770 0.001 . 2 . . 972 . . -10 ARG HB2 . 18632 2 15 . 1 1 2 2 ARG HB3 H 1 1.843 0.001 . 2 . . 973 . . -10 ARG HB3 . 18632 2 16 . 1 1 2 2 ARG HG2 H 1 1.630 0.001 . 1 . . 975 . . -10 ARG HG2 . 18632 2 17 . 1 1 2 2 ARG HG3 H 1 1.630 0.001 . 1 . . 974 . . -10 ARG HG3 . 18632 2 18 . 1 1 2 2 ARG HD2 H 1 3.151 0.002 . 1 . . 976 . . -10 ARG HD2 . 18632 2 19 . 1 1 2 2 ARG HD3 H 1 3.151 0.002 . 1 . . 971 . . -10 ARG HD3 . 18632 2 20 . 1 1 2 2 ARG CA C 13 56.471 0.005 . 1 . . 969 . . -10 ARG CA . 18632 2 21 . 1 1 2 2 ARG CB C 13 30.855 0.005 . 1 . . 978 . . -10 ARG CB . 18632 2 22 . 1 1 2 2 ARG CG C 13 27.127 0.005 . 1 . . 979 . . -10 ARG CG . 18632 2 23 . 1 1 2 2 ARG CD C 13 43.339 0.012 . 1 . . 977 . . -10 ARG CD . 18632 2 24 . 1 1 7 7 HIS HA H 1 4.557 0.003 . 1 . . 1664 . . -5 HIS HA . 18632 2 25 . 1 1 7 7 HIS HB2 H 1 2.976 0.007 . 1 . . 1667 . . -5 HIS HB2 . 18632 2 26 . 1 1 7 7 HIS HB3 H 1 2.976 0.007 . 1 . . 1668 . . -5 HIS HB3 . 18632 2 27 . 1 1 7 7 HIS HE1 H 1 7.723 0.001 . 1 . . 1168 . . -5 HIS HE1 . 18632 2 28 . 1 1 7 7 HIS CA C 13 56.381 0.075 . 1 . . 1666 . . -5 HIS CA . 18632 2 29 . 1 1 7 7 HIS CB C 13 30.991 0.029 . 1 . . 1665 . . -5 HIS CB . 18632 2 30 . 1 1 7 7 HIS CE1 C 13 138.507 0.005 . 1 . . 1169 . . -5 HIS CE1 . 18632 2 31 . 1 1 10 10 HIS HB2 H 1 3.117 0.001 . 1 . . 1672 . . -2 HIS HB2 . 18632 2 32 . 1 1 10 10 HIS HB3 H 1 3.117 0.001 . 1 . . 1673 . . -2 HIS HB3 . 18632 2 33 . 1 1 10 10 HIS HE1 H 1 7.793 0.001 . 1 . . 1171 . . -2 HIS HE1 . 18632 2 34 . 1 1 10 10 HIS CA C 13 56.421 0.005 . 1 . . 1694 . . -2 HIS CA . 18632 2 35 . 1 1 10 10 HIS CB C 13 30.970 0.054 . 1 . . 1695 . . -2 HIS CB . 18632 2 36 . 1 1 10 10 HIS CE1 C 13 138.477 0.005 . 1 . . 1170 . . -2 HIS CE1 . 18632 2 37 . 1 1 11 11 GLY HA2 H 1 3.973 0.001 . 1 . . 1669 . . -1 GLY HA2 . 18632 2 38 . 1 1 11 11 GLY HA3 H 1 3.973 0.001 . 1 . . 1671 . . -1 GLY HA3 . 18632 2 39 . 1 1 11 11 GLY CA C 13 45.210 0.038 . 1 . . 1670 . . -1 GLY CA . 18632 2 40 . 1 1 12 12 SER H H 1 8.271 0.007 . 1 . . 1402 . . 0 SER H . 18632 2 41 . 1 1 12 12 SER HA H 1 4.501 0.004 . 1 . . 315 . . 0 SER HA . 18632 2 42 . 1 1 12 12 SER HB2 H 1 3.878 0.004 . 1 . . 317 . . 0 SER HB2 . 18632 2 43 . 1 1 12 12 SER HB3 H 1 3.878 0.004 . 1 . . 316 . . 0 SER HB3 . 18632 2 44 . 1 1 12 12 SER CA C 13 58.569 0.073 . 1 . . 1303 . . 0 SER CA . 18632 2 45 . 1 1 12 12 SER CB C 13 64.084 0.048 . 1 . . 1306 . . 0 SER CB . 18632 2 46 . 1 1 12 12 SER N N 15 116.034 0.005 . 1 . . 1403 . . 0 SER N . 18632 2 47 . 1 1 13 13 LYS H H 1 8.554 0.011 . 1 . . 190 . . 1 LYS H . 18632 2 48 . 1 1 13 13 LYS HA H 1 4.563 0.002 . 1 . . 318 . . 1 LYS HA . 18632 2 49 . 1 1 13 13 LYS HB2 H 1 1.743 0.001 . 2 . . 319 . . 1 LYS HB2 . 18632 2 50 . 1 1 13 13 LYS HB3 H 1 1.899 0.003 . 2 . . 320 . . 1 LYS HB3 . 18632 2 51 . 1 1 13 13 LYS HG2 H 1 1.520 0.001 . 2 . . 663 . . 1 LYS HG2 . 18632 2 52 . 1 1 13 13 LYS HG3 H 1 1.433 0.002 . 2 . . 662 . . 1 LYS HG3 . 18632 2 53 . 1 1 13 13 LYS HD2 H 1 1.645 0.004 . 2 . . 664 . . 1 LYS HD2 . 18632 2 54 . 1 1 13 13 LYS HD3 H 1 1.721 0.001 . 2 . . 665 . . 1 LYS HD3 . 18632 2 55 . 1 1 13 13 LYS HE2 H 1 2.914 0.001 . 2 . . 1180 . . 1 LYS HE2 . 18632 2 56 . 1 1 13 13 LYS HE3 H 1 2.971 0.004 . 2 . . 666 . . 1 LYS HE3 . 18632 2 57 . 1 1 13 13 LYS CA C 13 55.872 0.061 . 1 . . 1305 . . 1 LYS CA . 18632 2 58 . 1 1 13 13 LYS CB C 13 34.294 0.018 . 1 . . 1304 . . 1 LYS CB . 18632 2 59 . 1 1 13 13 LYS CG C 13 24.949 0.034 . 1 . . 667 . . 1 LYS CG . 18632 2 60 . 1 1 13 13 LYS CD C 13 29.615 0.033 . 1 . . 1100 . . 1 LYS CD . 18632 2 61 . 1 1 13 13 LYS CE C 13 42.106 0.024 . 1 . . 1101 . . 1 LYS CE . 18632 2 62 . 1 1 13 13 LYS N N 15 122.741 0.005 . 1 . . 191 . . 1 LYS N . 18632 2 63 . 1 1 14 14 THR H H 1 7.959 0.01 . 1 . . 210 . . 2 THR H . 18632 2 64 . 1 1 14 14 THR HA H 1 4.632 0.008 . 1 . . 321 . . 2 THR HA . 18632 2 65 . 1 1 14 14 THR HB H 1 3.860 0.002 . 1 . . 322 . . 2 THR HB . 18632 2 66 . 1 1 14 14 THR HG21 H 1 1.177 0.002 . 1 . . 717 . . 2 THR HG21 . 18632 2 67 . 1 1 14 14 THR HG22 H 1 1.177 0.002 . 1 . . 717 . . 2 THR HG22 . 18632 2 68 . 1 1 14 14 THR HG23 H 1 1.177 0.002 . 1 . . 717 . . 2 THR HG23 . 18632 2 69 . 1 1 14 14 THR CA C 13 60.979 0.093 . 1 . . 1307 . . 2 THR CA . 18632 2 70 . 1 1 14 14 THR CB C 13 70.806 0.027 . 1 . . 1308 . . 2 THR CB . 18632 2 71 . 1 1 14 14 THR CG2 C 13 22.321 0.02 . 1 . . 718 . . 2 THR CG2 . 18632 2 72 . 1 1 14 14 THR N N 15 116.526 0.005 . 1 . . 211 . . 2 THR N . 18632 2 73 . 1 1 15 15 LEU H H 1 8.180 0.004 . 1 . . 169 . . 3 LEU H . 18632 2 74 . 1 1 15 15 LEU HA H 1 4.201 0.004 . 1 . . 865 . . 3 LEU HA . 18632 2 75 . 1 1 15 15 LEU HB2 H 1 0.283 0.004 . 2 . . 867 . . 3 LEU HB2 . 18632 2 76 . 1 1 15 15 LEU HB3 H 1 1.255 0.001 . 2 . . 866 . . 3 LEU HB3 . 18632 2 77 . 1 1 15 15 LEU HG H 1 1.405 0.001 . 1 . . 868 . . 3 LEU HG . 18632 2 78 . 1 1 15 15 LEU HD11 H 1 0.431 0.002 . 2 . . 869 . . 3 LEU HD11 . 18632 2 79 . 1 1 15 15 LEU HD12 H 1 0.431 0.002 . 2 . . 869 . . 3 LEU HD12 . 18632 2 80 . 1 1 15 15 LEU HD13 H 1 0.431 0.002 . 2 . . 869 . . 3 LEU HD13 . 18632 2 81 . 1 1 15 15 LEU HD21 H 1 0.217 0.003 . 2 . . 870 . . 3 LEU HD21 . 18632 2 82 . 1 1 15 15 LEU HD22 H 1 0.217 0.003 . 2 . . 870 . . 3 LEU HD22 . 18632 2 83 . 1 1 15 15 LEU HD23 H 1 0.217 0.003 . 2 . . 870 . . 3 LEU HD23 . 18632 2 84 . 1 1 15 15 LEU CA C 13 52.056 0.016 . 1 . . 1310 . . 3 LEU CA . 18632 2 85 . 1 1 15 15 LEU CB C 13 43.566 0.036 . 1 . . 1309 . . 3 LEU CB . 18632 2 86 . 1 1 15 15 LEU CG C 13 25.714 0.155 . 1 . . 871 . . 3 LEU CG . 18632 2 87 . 1 1 15 15 LEU CD1 C 13 25.949 0.031 . 2 . . 873 . . 3 LEU CD1 . 18632 2 88 . 1 1 15 15 LEU CD2 C 13 25.524 0.02 . 2 . . 872 . . 3 LEU CD2 . 18632 2 89 . 1 1 15 15 LEU N N 15 127.983 0.005 . 1 . . 170 . . 3 LEU N . 18632 2 90 . 1 1 16 16 PRO HA H 1 4.407 0.002 . 1 . . 323 . . 4 PRO HA . 18632 2 91 . 1 1 16 16 PRO HB2 H 1 2.611 0.003 . 2 . . 325 . . 4 PRO HB2 . 18632 2 92 . 1 1 16 16 PRO HB3 H 1 1.955 0.002 . 2 . . 324 . . 4 PRO HB3 . 18632 2 93 . 1 1 16 16 PRO HG2 H 1 2.422 0.004 . 2 . . 913 . . 4 PRO HG2 . 18632 2 94 . 1 1 16 16 PRO HG3 H 1 2.180 0.007 . 2 . . 912 . . 4 PRO HG3 . 18632 2 95 . 1 1 16 16 PRO HD2 H 1 4.386 0.004 . 2 . . 917 . . 4 PRO HD2 . 18632 2 96 . 1 1 16 16 PRO HD3 H 1 3.576 0.001 . 2 . . 915 . . 4 PRO HD3 . 18632 2 97 . 1 1 16 16 PRO CA C 13 63.532 0.038 . 1 . . 1311 . . 4 PRO CA . 18632 2 98 . 1 1 16 16 PRO CB C 13 32.893 0.06 . 1 . . 1314 . . 4 PRO CB . 18632 2 99 . 1 1 16 16 PRO CG C 13 27.938 0.037 . 1 . . 914 . . 4 PRO CG . 18632 2 100 . 1 1 16 16 PRO CD C 13 51.810 0.03 . 1 . . 916 . . 4 PRO CD . 18632 2 101 . 1 1 17 17 ASP H H 1 8.481 0.003 . 1 . . 104 . . 5 ASP H . 18632 2 102 . 1 1 17 17 ASP HA H 1 4.219 0.002 . 1 . . 326 . . 5 ASP HA . 18632 2 103 . 1 1 17 17 ASP HB2 H 1 2.692 0.001 . 1 . . 328 . . 5 ASP HB2 . 18632 2 104 . 1 1 17 17 ASP HB3 H 1 2.692 0.001 . 1 . . 327 . . 5 ASP HB3 . 18632 2 105 . 1 1 17 17 ASP CA C 13 57.224 0.005 . 1 . . 1313 . . 5 ASP CA . 18632 2 106 . 1 1 17 17 ASP CB C 13 40.749 0.013 . 1 . . 1312 . . 5 ASP CB . 18632 2 107 . 1 1 17 17 ASP N N 15 122.185 0.005 . 1 . . 105 . . 5 ASP N . 18632 2 108 . 1 1 18 18 LYS H H 1 8.026 0.001 . 1 . . 94 . . 6 LYS H . 18632 2 109 . 1 1 18 18 LYS HA H 1 4.228 0.001 . 1 . . 329 . . 6 LYS HA . 18632 2 110 . 1 1 18 18 LYS HB2 H 1 1.662 0.014 . 1 . . 331 . . 6 LYS HB2 . 18632 2 111 . 1 1 18 18 LYS HB3 H 1 1.662 0.014 . 1 . . 330 . . 6 LYS HB3 . 18632 2 112 . 1 1 18 18 LYS HG2 H 1 0.072 0.004 . 2 . . 669 . . 6 LYS HG2 . 18632 2 113 . 1 1 18 18 LYS HG3 H 1 0.936 0.001 . 2 . . 670 . . 6 LYS HG3 . 18632 2 114 . 1 1 18 18 LYS HD2 H 1 1.398 0.001 . 2 . . 671 . . 6 LYS HD2 . 18632 2 115 . 1 1 18 18 LYS HD3 H 1 1.457 0.001 . 2 . . 672 . . 6 LYS HD3 . 18632 2 116 . 1 1 18 18 LYS HE2 H 1 2.858 0.001 . 1 . . 675 . . 6 LYS HE2 . 18632 2 117 . 1 1 18 18 LYS HE3 H 1 2.858 0.001 . 1 . . 676 . . 6 LYS HE3 . 18632 2 118 . 1 1 18 18 LYS CA C 13 57.358 0.025 . 1 . . 1316 . . 6 LYS CA . 18632 2 119 . 1 1 18 18 LYS CB C 13 31.185 0.066 . 1 . . 1315 . . 6 LYS CB . 18632 2 120 . 1 1 18 18 LYS CG C 13 23.091 0.066 . 1 . . 677 . . 6 LYS CG . 18632 2 121 . 1 1 18 18 LYS CD C 13 29.921 0.018 . 1 . . 673 . . 6 LYS CD . 18632 2 122 . 1 1 18 18 LYS CE C 13 41.864 0.003 . 1 . . 674 . . 6 LYS CE . 18632 2 123 . 1 1 18 18 LYS N N 15 115.758 0.005 . 1 . . 95 . . 6 LYS N . 18632 2 124 . 1 1 19 19 PHE H H 1 7.757 0.003 . 1 . . 192 . . 7 PHE H . 18632 2 125 . 1 1 19 19 PHE HA H 1 4.161 0.001 . 1 . . 334 . . 7 PHE HA . 18632 2 126 . 1 1 19 19 PHE HB2 H 1 2.267 0.008 . 2 . . 332 . . 7 PHE HB2 . 18632 2 127 . 1 1 19 19 PHE HB3 H 1 2.704 0.004 . 2 . . 333 . . 7 PHE HB3 . 18632 2 128 . 1 1 19 19 PHE HD1 H 1 6.774 0.006 . 3 . . 988 . . 7 PHE HD1 . 18632 2 129 . 1 1 19 19 PHE HD2 H 1 6.774 0.006 . 3 . . 988 . . 7 PHE HD2 . 18632 2 130 . 1 1 19 19 PHE CA C 13 59.754 0.031 . 1 . . 1318 . . 7 PHE CA . 18632 2 131 . 1 1 19 19 PHE CB C 13 39.517 0.031 . 1 . . 1317 . . 7 PHE CB . 18632 2 132 . 1 1 19 19 PHE CD1 C 13 130.956 0.053 . 3 . . 1032 . . 7 PHE CD1 . 18632 2 133 . 1 1 19 19 PHE CD2 C 13 130.956 0.053 . 3 . . 1032 . . 7 PHE CD2 . 18632 2 134 . 1 1 19 19 PHE N N 15 117.927 0.005 . 1 . . 193 . . 7 PHE N . 18632 2 135 . 1 1 20 20 LEU H H 1 7.273 0.001 . 1 . . 78 . . 8 LEU H . 18632 2 136 . 1 1 20 20 LEU HA H 1 4.414 0.003 . 1 . . 335 . . 8 LEU HA . 18632 2 137 . 1 1 20 20 LEU HB2 H 1 2.045 0.002 . 2 . . 337 . . 8 LEU HB2 . 18632 2 138 . 1 1 20 20 LEU HB3 H 1 1.361 0.002 . 2 . . 336 . . 8 LEU HB3 . 18632 2 139 . 1 1 20 20 LEU HG H 1 1.648 0.003 . 1 . . 668 . . 8 LEU HG . 18632 2 140 . 1 1 20 20 LEU HD11 H 1 0.694 0.001 . 2 . . 720 . . 8 LEU HD11 . 18632 2 141 . 1 1 20 20 LEU HD12 H 1 0.694 0.001 . 2 . . 720 . . 8 LEU HD12 . 18632 2 142 . 1 1 20 20 LEU HD13 H 1 0.694 0.001 . 2 . . 720 . . 8 LEU HD13 . 18632 2 143 . 1 1 20 20 LEU HD21 H 1 1.039 0.004 . 2 . . 719 . . 8 LEU HD21 . 18632 2 144 . 1 1 20 20 LEU HD22 H 1 1.039 0.004 . 2 . . 719 . . 8 LEU HD22 . 18632 2 145 . 1 1 20 20 LEU HD23 H 1 1.039 0.004 . 2 . . 719 . . 8 LEU HD23 . 18632 2 146 . 1 1 20 20 LEU CA C 13 54.383 0.072 . 1 . . 1320 . . 8 LEU CA . 18632 2 147 . 1 1 20 20 LEU CB C 13 41.986 0.025 . 1 . . 1319 . . 8 LEU CB . 18632 2 148 . 1 1 20 20 LEU CG C 13 26.538 0.105 . 1 . . 721 . . 8 LEU CG . 18632 2 149 . 1 1 20 20 LEU CD1 C 13 23.594 0.02 . 2 . . 722 . . 8 LEU CD1 . 18632 2 150 . 1 1 20 20 LEU CD2 C 13 26.257 0.029 . 2 . . 723 . . 8 LEU CD2 . 18632 2 151 . 1 1 20 20 LEU N N 15 114.063 0.005 . 1 . . 79 . . 8 LEU N . 18632 2 152 . 1 1 21 21 GLY H H 1 8.761 0.009 . 1 . . 130 . . 9 GLY H . 18632 2 153 . 1 1 21 21 GLY HA2 H 1 3.707 0.003 . 2 . . 338 . . 9 GLY HA2 . 18632 2 154 . 1 1 21 21 GLY HA3 H 1 4.052 0.001 . 2 . . 339 . . 9 GLY HA3 . 18632 2 155 . 1 1 21 21 GLY CA C 13 44.455 0.061 . 1 . . 1321 . . 9 GLY CA . 18632 2 156 . 1 1 21 21 GLY N N 15 109.144 0.005 . 1 . . 1620 . . 9 GLY N . 18632 2 157 . 1 1 22 22 THR H H 1 8.318 0.003 . 1 . . 141 . . 10 THR H . 18632 2 158 . 1 1 22 22 THR HA H 1 4.950 0.001 . 1 . . 340 . . 10 THR HA . 18632 2 159 . 1 1 22 22 THR HB H 1 3.763 0.004 . 1 . . 341 . . 10 THR HB . 18632 2 160 . 1 1 22 22 THR HG21 H 1 1.001 0.002 . 1 . . 678 . . 10 THR HG21 . 18632 2 161 . 1 1 22 22 THR HG22 H 1 1.001 0.002 . 1 . . 678 . . 10 THR HG22 . 18632 2 162 . 1 1 22 22 THR HG23 H 1 1.001 0.002 . 1 . . 678 . . 10 THR HG23 . 18632 2 163 . 1 1 22 22 THR CA C 13 61.764 0.005 . 1 . . 1323 . . 10 THR CA . 18632 2 164 . 1 1 22 22 THR CB C 13 70.554 0.029 . 1 . . 1322 . . 10 THR CB . 18632 2 165 . 1 1 22 22 THR CG2 C 13 22.380 0.045 . 1 . . 679 . . 10 THR CG2 . 18632 2 166 . 1 1 22 22 THR N N 15 117.512 0.005 . 1 . . 142 . . 10 THR N . 18632 2 167 . 1 1 23 23 PHE H H 1 9.709 0.004 . 1 . . 92 . . 11 PHE H . 18632 2 168 . 1 1 23 23 PHE HA H 1 5.309 0.007 . 1 . . 342 . . 11 PHE HA . 18632 2 169 . 1 1 23 23 PHE HB2 H 1 2.752 0.001 . 2 . . 344 . . 11 PHE HB2 . 18632 2 170 . 1 1 23 23 PHE HB3 H 1 2.987 0.001 . 2 . . 343 . . 11 PHE HB3 . 18632 2 171 . 1 1 23 23 PHE HD1 H 1 7.111 0.001 . 3 . . 1166 . . 11 PHE HD1 . 18632 2 172 . 1 1 23 23 PHE HD2 H 1 7.111 0.001 . 3 . . 1166 . . 11 PHE HD2 . 18632 2 173 . 1 1 23 23 PHE CA C 13 55.632 0.047 . 1 . . 1324 . . 11 PHE CA . 18632 2 174 . 1 1 23 23 PHE CB C 13 42.682 0.046 . 1 . . 1325 . . 11 PHE CB . 18632 2 175 . 1 1 23 23 PHE CD1 C 13 133.219 0.005 . 3 . . 1167 . . 11 PHE CD1 . 18632 2 176 . 1 1 23 23 PHE CD2 C 13 133.219 0.005 . 3 . . 1167 . . 11 PHE CD2 . 18632 2 177 . 1 1 23 23 PHE N N 15 124.035 0.005 . 1 . . 93 . . 11 PHE N . 18632 2 178 . 1 1 24 24 LYS H H 1 9.145 0.004 . 1 . . 246 . . 12 LYS H . 18632 2 179 . 1 1 24 24 LYS HA H 1 5.295 0.001 . 1 . . 345 . . 12 LYS HA . 18632 2 180 . 1 1 24 24 LYS HB2 H 1 2.013 0.004 . 2 . . 346 . . 12 LYS HB2 . 18632 2 181 . 1 1 24 24 LYS HB3 H 1 1.617 0.003 . 2 . . 880 . . 12 LYS HB3 . 18632 2 182 . 1 1 24 24 LYS HG2 H 1 1.446 0.001 . 2 . . 918 . . 12 LYS HG2 . 18632 2 183 . 1 1 24 24 LYS HG3 H 1 1.537 0.004 . 2 . . 919 . . 12 LYS HG3 . 18632 2 184 . 1 1 24 24 LYS HD2 H 1 1.658 0.001 . 1 . . 923 . . 12 LYS HD2 . 18632 2 185 . 1 1 24 24 LYS HD3 H 1 1.658 0.001 . 1 . . 924 . . 12 LYS HD3 . 18632 2 186 . 1 1 24 24 LYS HE2 H 1 2.986 0.001 . 1 . . 921 . . 12 LYS HE2 . 18632 2 187 . 1 1 24 24 LYS HE3 H 1 2.986 0.001 . 1 . . 922 . . 12 LYS HE3 . 18632 2 188 . 1 1 24 24 LYS CA C 13 55.824 0.005 . 1 . . 1327 . . 12 LYS CA . 18632 2 189 . 1 1 24 24 LYS CB C 13 36.505 0.027 . 1 . . 1326 . . 12 LYS CB . 18632 2 190 . 1 1 24 24 LYS CG C 13 24.950 0.036 . 1 . . 920 . . 12 LYS CG . 18632 2 191 . 1 1 24 24 LYS CD C 13 29.609 0.005 . 1 . . 925 . . 12 LYS CD . 18632 2 192 . 1 1 24 24 LYS CE C 13 42.105 0.005 . 1 . . 926 . . 12 LYS CE . 18632 2 193 . 1 1 24 24 LYS N N 15 126.521 0.005 . 1 . . 247 . . 12 LYS N . 18632 2 194 . 1 1 25 25 LEU H H 1 9.389 0.014 . 1 . . 129 . . 13 LEU H . 18632 2 195 . 1 1 25 25 LEU HA H 1 3.783 0.004 . 1 . . 347 . . 13 LEU HA . 18632 2 196 . 1 1 25 25 LEU HB2 H 1 1.576 0.004 . 2 . . 348 . . 13 LEU HB2 . 18632 2 197 . 1 1 25 25 LEU HB3 H 1 2.081 0.004 . 2 . . 690 . . 13 LEU HB3 . 18632 2 198 . 1 1 25 25 LEU HG H 1 1.218 0.009 . 1 . . 681 . . 13 LEU HG . 18632 2 199 . 1 1 25 25 LEU HD11 H 1 0.256 0.002 . 2 . . 682 . . 13 LEU HD11 . 18632 2 200 . 1 1 25 25 LEU HD12 H 1 0.256 0.002 . 2 . . 682 . . 13 LEU HD12 . 18632 2 201 . 1 1 25 25 LEU HD13 H 1 0.256 0.002 . 2 . . 682 . . 13 LEU HD13 . 18632 2 202 . 1 1 25 25 LEU HD21 H 1 0.923 0.002 . 2 . . 680 . . 13 LEU HD21 . 18632 2 203 . 1 1 25 25 LEU HD22 H 1 0.923 0.002 . 2 . . 680 . . 13 LEU HD22 . 18632 2 204 . 1 1 25 25 LEU HD23 H 1 0.923 0.002 . 2 . . 680 . . 13 LEU HD23 . 18632 2 205 . 1 1 25 25 LEU CA C 13 57.536 0.056 . 1 . . 1328 . . 13 LEU CA . 18632 2 206 . 1 1 25 25 LEU CB C 13 43.029 0.057 . 1 . . 1329 . . 13 LEU CB . 18632 2 207 . 1 1 25 25 LEU CG C 13 26.505 0.014 . 1 . . 691 . . 13 LEU CG . 18632 2 208 . 1 1 25 25 LEU CD1 C 13 21.433 0.027 . 2 . . 684 . . 13 LEU CD1 . 18632 2 209 . 1 1 25 25 LEU CD2 C 13 26.801 0.029 . 2 . . 683 . . 13 LEU CD2 . 18632 2 210 . 1 1 25 25 LEU N N 15 131.408 0.005 . 1 . . 1633 . . 13 LEU N . 18632 2 211 . 1 1 26 26 GLU H H 1 9.460 0.001 . 1 . . 1330 . . 14 GLU H . 18632 2 212 . 1 1 26 26 GLU HA H 1 4.668 0.001 . 1 . . 349 . . 14 GLU HA . 18632 2 213 . 1 1 26 26 GLU HB2 H 1 2.254 0.004 . 2 . . 351 . . 14 GLU HB2 . 18632 2 214 . 1 1 26 26 GLU HB3 H 1 2.061 0.001 . 2 . . 350 . . 14 GLU HB3 . 18632 2 215 . 1 1 26 26 GLU HG2 H 1 2.492 0.002 . 2 . . 685 . . 14 GLU HG2 . 18632 2 216 . 1 1 26 26 GLU HG3 H 1 2.135 0.001 . 2 . . 687 . . 14 GLU HG3 . 18632 2 217 . 1 1 26 26 GLU CA C 13 57.159 0.006 . 1 . . 1333 . . 14 GLU CA . 18632 2 218 . 1 1 26 26 GLU CB C 13 34.565 0.021 . 1 . . 1332 . . 14 GLU CB . 18632 2 219 . 1 1 26 26 GLU CG C 13 37.584 0.049 . 1 . . 686 . . 14 GLU CG . 18632 2 220 . 1 1 26 26 GLU N N 15 126.451 0.005 . 1 . . 1331 . . 14 GLU N . 18632 2 221 . 1 1 27 27 ARG H H 1 7.658 0.006 . 1 . . 43 . . 15 ARG H . 18632 2 222 . 1 1 27 27 ARG HA H 1 4.836 0.001 . 1 . . 352 . . 15 ARG HA . 18632 2 223 . 1 1 27 27 ARG HB2 H 1 1.891 0.004 . 2 . . 353 . . 15 ARG HB2 . 18632 2 224 . 1 1 27 27 ARG HB3 H 1 1.962 0.001 . 2 . . 354 . . 15 ARG HB3 . 18632 2 225 . 1 1 27 27 ARG HG2 H 1 1.141 0.006 . 2 . . 694 . . 15 ARG HG2 . 18632 2 226 . 1 1 27 27 ARG HG3 H 1 1.317 0.002 . 2 . . 695 . . 15 ARG HG3 . 18632 2 227 . 1 1 27 27 ARG HD2 H 1 2.929 0.001 . 1 . . 692 . . 15 ARG HD2 . 18632 2 228 . 1 1 27 27 ARG HD3 H 1 2.929 0.001 . 1 . . 693 . . 15 ARG HD3 . 18632 2 229 . 1 1 27 27 ARG CA C 13 54.907 0.013 . 1 . . 1334 . . 15 ARG CA . 18632 2 230 . 1 1 27 27 ARG CB C 13 31.999 0.013 . 1 . . 1335 . . 15 ARG CB . 18632 2 231 . 1 1 27 27 ARG CG C 13 26.310 0.032 . 1 . . 696 . . 15 ARG CG . 18632 2 232 . 1 1 27 27 ARG CD C 13 42.733 0.006 . 1 . . 1074 . . 15 ARG CD . 18632 2 233 . 1 1 27 27 ARG N N 15 112.102 0.005 . 1 . . 44 . . 15 ARG N . 18632 2 234 . 1 1 28 28 ASP H H 1 8.527 0.003 . 1 . . 1337 . . 16 ASP H . 18632 2 235 . 1 1 28 28 ASP HA H 1 5.180 0.001 . 1 . . 355 . . 16 ASP HA . 18632 2 236 . 1 1 28 28 ASP HB2 H 1 2.718 0.001 . 1 . . 357 . . 16 ASP HB2 . 18632 2 237 . 1 1 28 28 ASP HB3 H 1 2.718 0.001 . 1 . . 356 . . 16 ASP HB3 . 18632 2 238 . 1 1 28 28 ASP CA C 13 53.137 0.021 . 1 . . 1338 . . 16 ASP CA . 18632 2 239 . 1 1 28 28 ASP CB C 13 45.566 0.02 . 1 . . 1339 . . 16 ASP CB . 18632 2 240 . 1 1 28 28 ASP N N 15 116.216 0.005 . 1 . . 1336 . . 16 ASP N . 18632 2 241 . 1 1 29 29 GLU H H 1 8.656 0.001 . 1 . . 51 . . 17 GLU H . 18632 2 242 . 1 1 29 29 GLU HA H 1 4.823 0.006 . 1 . . 1654 . . 17 GLU HA . 18632 2 243 . 1 1 29 29 GLU HB2 H 1 2.153 0.004 . 1 . . 1651 . . 17 GLU HB2 . 18632 2 244 . 1 1 29 29 GLU HB3 H 1 2.153 0.004 . 1 . . 1650 . . 17 GLU HB3 . 18632 2 245 . 1 1 29 29 GLU HG2 H 1 2.222 0.002 . 2 . . 1652 . . 17 GLU HG2 . 18632 2 246 . 1 1 29 29 GLU HG3 H 1 2.390 0.001 . 2 . . 907 . . 17 GLU HG3 . 18632 2 247 . 1 1 29 29 GLU CA C 13 55.724 0.005 . 1 . . 1342 . . 17 GLU CA . 18632 2 248 . 1 1 29 29 GLU CB C 13 33.108 0.016 . 1 . . 1341 . . 17 GLU CB . 18632 2 249 . 1 1 29 29 GLU CG C 13 36.612 0.098 . 1 . . 908 . . 17 GLU CG . 18632 2 250 . 1 1 29 29 GLU N N 15 115.747 0.005 . 1 . . 1340 . . 17 GLU N . 18632 2 251 . 1 1 30 30 ASN HA H 1 4.822 0.007 . 1 . . 909 . . 18 ASN HA . 18632 2 252 . 1 1 30 30 ASN HB2 H 1 3.945 0.003 . 2 . . 911 . . 18 ASN HB2 . 18632 2 253 . 1 1 30 30 ASN HB3 H 1 2.722 0.001 . 2 . . 910 . . 18 ASN HB3 . 18632 2 254 . 1 1 30 30 ASN HD21 H 1 8.066 0.001 . 1 . . 1058 . . 18 ASN HD21 . 18632 2 255 . 1 1 30 30 ASN HD22 H 1 7.003 0.001 . 1 . . 3 . . 18 ASN HD22 . 18632 2 256 . 1 1 30 30 ASN CA C 13 54.387 0.047 . 1 . . 1549 . . 18 ASN CA . 18632 2 257 . 1 1 30 30 ASN CB C 13 40.438 0.03 . 1 . . 1550 . . 18 ASN CB . 18632 2 258 . 1 1 30 30 ASN ND2 N 15 111.685 0.002 . 1 . . 4 . . 18 ASN ND2 . 18632 2 259 . 1 1 31 31 PHE H H 1 8.814 0.001 . 1 . . 244 . . 19 PHE H . 18632 2 260 . 1 1 31 31 PHE HA H 1 4.819 0.001 . 1 . . 358 . . 19 PHE HA . 18632 2 261 . 1 1 31 31 PHE HB2 H 1 2.929 0.003 . 2 . . 359 . . 19 PHE HB2 . 18632 2 262 . 1 1 31 31 PHE HB3 H 1 2.854 0.003 . 2 . . 1658 . . 19 PHE HB3 . 18632 2 263 . 1 1 31 31 PHE HD1 H 1 7.419 0.001 . 3 . . 1030 . . 19 PHE HD1 . 18632 2 264 . 1 1 31 31 PHE HD2 H 1 7.419 0.001 . 3 . . 1030 . . 19 PHE HD2 . 18632 2 265 . 1 1 31 31 PHE HE1 H 1 6.936 0.002 . 3 . . 1158 . . 19 PHE HE1 . 18632 2 266 . 1 1 31 31 PHE HE2 H 1 6.936 0.002 . 3 . . 1158 . . 19 PHE HE2 . 18632 2 267 . 1 1 31 31 PHE HZ H 1 6.722 0.003 . 1 . . 1157 . . 19 PHE HZ . 18632 2 268 . 1 1 31 31 PHE CA C 13 60.209 0.005 . 1 . . 1552 . . 19 PHE CA . 18632 2 269 . 1 1 31 31 PHE CB C 13 39.863 0.028 . 1 . . 1551 . . 19 PHE CB . 18632 2 270 . 1 1 31 31 PHE CD1 C 13 131.307 0.045 . 3 . . 1031 . . 19 PHE CD1 . 18632 2 271 . 1 1 31 31 PHE CD2 C 13 131.307 0.045 . 3 . . 1031 . . 19 PHE CD2 . 18632 2 272 . 1 1 31 31 PHE CE1 C 13 130.788 0.076 . 3 . . 1159 . . 19 PHE CE1 . 18632 2 273 . 1 1 31 31 PHE CE2 C 13 130.788 0.076 . 3 . . 1159 . . 19 PHE CE2 . 18632 2 274 . 1 1 31 31 PHE CZ C 13 127.868 0.151 . 1 . . 1156 . . 19 PHE CZ . 18632 2 275 . 1 1 31 31 PHE N N 15 120.802 0.005 . 1 . . 245 . . 19 PHE N . 18632 2 276 . 1 1 32 32 ASP H H 1 8.798 0.011 . 1 . . 1608 . . 20 ASP H . 18632 2 277 . 1 1 32 32 ASP HA H 1 4.052 0.001 . 1 . . 360 . . 20 ASP HA . 18632 2 278 . 1 1 32 32 ASP HB2 H 1 2.603 0.001 . 1 . . 361 . . 20 ASP HB2 . 18632 2 279 . 1 1 32 32 ASP HB3 H 1 2.603 0.001 . 1 . . 362 . . 20 ASP HB3 . 18632 2 280 . 1 1 32 32 ASP CA C 13 58.599 0.015 . 1 . . 1703 . . 20 ASP CA . 18632 2 281 . 1 1 32 32 ASP CB C 13 42.477 0.011 . 1 . . 1704 . . 20 ASP CB . 18632 2 282 . 1 1 32 32 ASP N N 15 118.233 0.005 . 1 . . 1609 . . 20 ASP N . 18632 2 283 . 1 1 33 33 GLU H H 1 8.303 0.009 . 1 . . 1616 . . 21 GLU H . 18632 2 284 . 1 1 33 33 GLU HA H 1 3.824 0.004 . 1 . . 363 . . 21 GLU HA . 18632 2 285 . 1 1 33 33 GLU HB2 H 1 2.027 0.003 . 2 . . 365 . . 21 GLU HB2 . 18632 2 286 . 1 1 33 33 GLU HB3 H 1 1.945 0.001 . 2 . . 364 . . 21 GLU HB3 . 18632 2 287 . 1 1 33 33 GLU HG2 H 1 2.508 0.001 . 2 . . 698 . . 21 GLU HG2 . 18632 2 288 . 1 1 33 33 GLU HG3 H 1 2.404 0.002 . 2 . . 697 . . 21 GLU HG3 . 18632 2 289 . 1 1 33 33 GLU CA C 13 60.015 0.023 . 1 . . 1344 . . 21 GLU CA . 18632 2 290 . 1 1 33 33 GLU CB C 13 28.228 0.014 . 1 . . 1343 . . 21 GLU CB . 18632 2 291 . 1 1 33 33 GLU CG C 13 37.248 0.039 . 1 . . 699 . . 21 GLU CG . 18632 2 292 . 1 1 33 33 GLU N N 15 116.230 0.005 . 1 . . 110 . . 21 GLU N . 18632 2 293 . 1 1 34 34 TYR H H 1 7.743 0.004 . 1 . . 23 . . 22 TYR H . 18632 2 294 . 1 1 34 34 TYR HA H 1 3.990 0.002 . 1 . . 369 . . 22 TYR HA . 18632 2 295 . 1 1 34 34 TYR HB2 H 1 3.244 0.012 . 2 . . 700 . . 22 TYR HB2 . 18632 2 296 . 1 1 34 34 TYR HB3 H 1 2.880 0.006 . 2 . . 370 . . 22 TYR HB3 . 18632 2 297 . 1 1 34 34 TYR HD1 H 1 7.420 0.003 . 3 . . 1634 . . 22 TYR HD1 . 18632 2 298 . 1 1 34 34 TYR HD2 H 1 7.420 0.003 . 3 . . 1634 . . 22 TYR HD2 . 18632 2 299 . 1 1 34 34 TYR CA C 13 62.022 0.045 . 1 . . 1346 . . 22 TYR CA . 18632 2 300 . 1 1 34 34 TYR CB C 13 38.954 0.049 . 1 . . 1345 . . 22 TYR CB . 18632 2 301 . 1 1 34 34 TYR CD1 C 13 131.306 0.033 . 3 . . 1635 . . 22 TYR CD1 . 18632 2 302 . 1 1 34 34 TYR CD2 C 13 131.306 0.033 . 3 . . 1635 . . 22 TYR CD2 . 18632 2 303 . 1 1 34 34 TYR N N 15 123.061 0.005 . 1 . . 24 . . 22 TYR N . 18632 2 304 . 1 1 35 35 LEU H H 1 8.402 0.002 . 1 . . 1630 . . 23 LEU H . 18632 2 305 . 1 1 35 35 LEU HA H 1 3.581 0.004 . 1 . . 307 . . 23 LEU HA . 18632 2 306 . 1 1 35 35 LEU HB2 H 1 0.963 0.003 . 2 . . 368 . . 23 LEU HB2 . 18632 2 307 . 1 1 35 35 LEU HB3 H 1 1.849 0.006 . 2 . . 1240 . . 23 LEU HB3 . 18632 2 308 . 1 1 35 35 LEU HG H 1 1.170 0.008 . 1 . . 655 . . 23 LEU HG . 18632 2 309 . 1 1 35 35 LEU HD11 H 1 0.137 0.004 . 2 . . 657 . . 23 LEU HD11 . 18632 2 310 . 1 1 35 35 LEU HD12 H 1 0.137 0.004 . 2 . . 657 . . 23 LEU HD12 . 18632 2 311 . 1 1 35 35 LEU HD13 H 1 0.137 0.004 . 2 . . 657 . . 23 LEU HD13 . 18632 2 312 . 1 1 35 35 LEU HD21 H 1 0.442 0.002 . 2 . . 653 . . 23 LEU HD21 . 18632 2 313 . 1 1 35 35 LEU HD22 H 1 0.442 0.002 . 2 . . 653 . . 23 LEU HD22 . 18632 2 314 . 1 1 35 35 LEU HD23 H 1 0.442 0.002 . 2 . . 653 . . 23 LEU HD23 . 18632 2 315 . 1 1 35 35 LEU CA C 13 57.492 0.028 . 1 . . 1348 . . 23 LEU CA . 18632 2 316 . 1 1 35 35 LEU CB C 13 42.057 0.044 . 1 . . 1347 . . 23 LEU CB . 18632 2 317 . 1 1 35 35 LEU CG C 13 26.213 0.028 . 1 . . 654 . . 23 LEU CG . 18632 2 318 . 1 1 35 35 LEU CD1 C 13 26.234 0.031 . 2 . . 656 . . 23 LEU CD1 . 18632 2 319 . 1 1 35 35 LEU CD2 C 13 22.286 0.028 . 2 . . 652 . . 23 LEU CD2 . 18632 2 320 . 1 1 35 35 LEU N N 15 119.728 0.005 . 1 . . 1631 . . 23 LEU N . 18632 2 321 . 1 1 36 36 LYS H H 1 8.350 0.001 . 1 . . 1544 . . 24 LYS H . 18632 2 322 . 1 1 36 36 LYS HA H 1 3.965 0.002 . 1 . . 304 . . 24 LYS HA . 18632 2 323 . 1 1 36 36 LYS HB2 H 1 1.758 0.002 . 2 . . 306 . . 24 LYS HB2 . 18632 2 324 . 1 1 36 36 LYS HB3 H 1 1.872 0.001 . 2 . . 305 . . 24 LYS HB3 . 18632 2 325 . 1 1 36 36 LYS HG2 H 1 1.235 0.001 . 2 . . 703 . . 24 LYS HG2 . 18632 2 326 . 1 1 36 36 LYS HG3 H 1 1.503 0.001 . 2 . . 704 . . 24 LYS HG3 . 18632 2 327 . 1 1 36 36 LYS HD2 H 1 1.622 0.001 . 1 . . 705 . . 24 LYS HD2 . 18632 2 328 . 1 1 36 36 LYS HD3 H 1 1.622 0.001 . 1 . . 706 . . 24 LYS HD3 . 18632 2 329 . 1 1 36 36 LYS HE2 H 1 2.885 0.001 . 1 . . 701 . . 24 LYS HE2 . 18632 2 330 . 1 1 36 36 LYS HE3 H 1 2.885 0.001 . 1 . . 702 . . 24 LYS HE3 . 18632 2 331 . 1 1 36 36 LYS CA C 13 59.900 0.055 . 1 . . 1546 . . 24 LYS CA . 18632 2 332 . 1 1 36 36 LYS CB C 13 32.726 0.068 . 1 . . 1543 . . 24 LYS CB . 18632 2 333 . 1 1 36 36 LYS CG C 13 25.487 0.028 . 1 . . 709 . . 24 LYS CG . 18632 2 334 . 1 1 36 36 LYS CD C 13 29.956 0.034 . 1 . . 708 . . 24 LYS CD . 18632 2 335 . 1 1 36 36 LYS CE C 13 41.786 0.005 . 1 . . 707 . . 24 LYS CE . 18632 2 336 . 1 1 36 36 LYS N N 15 118.958 0.005 . 1 . . 1545 . . 24 LYS N . 18632 2 337 . 1 1 37 37 ALA H H 1 7.972 0.004 . 1 . . 221 . . 25 ALA H . 18632 2 338 . 1 1 37 37 ALA HA H 1 4.110 0.002 . 1 . . 366 . . 25 ALA HA . 18632 2 339 . 1 1 37 37 ALA HB1 H 1 1.594 0.002 . 1 . . 367 . . 25 ALA HB1 . 18632 2 340 . 1 1 37 37 ALA HB2 H 1 1.594 0.002 . 1 . . 367 . . 25 ALA HB2 . 18632 2 341 . 1 1 37 37 ALA HB3 H 1 1.594 0.002 . 1 . . 367 . . 25 ALA HB3 . 18632 2 342 . 1 1 37 37 ALA CA C 13 55.105 0.013 . 1 . . 1542 . . 25 ALA CA . 18632 2 343 . 1 1 37 37 ALA CB C 13 17.550 0.031 . 1 . . 1691 . . 25 ALA CB . 18632 2 344 . 1 1 37 37 ALA N N 15 125.415 0.005 . 1 . . 222 . . 25 ALA N . 18632 2 345 . 1 1 38 38 ARG H H 1 8.046 0.001 . 1 . . 1540 . . 26 ARG H . 18632 2 346 . 1 1 38 38 ARG HA H 1 3.581 0.002 . 1 . . 393 . . 26 ARG HA . 18632 2 347 . 1 1 38 38 ARG HB2 H 1 1.521 0.001 . 2 . . 395 . . 26 ARG HB2 . 18632 2 348 . 1 1 38 38 ARG HB3 H 1 1.186 0.006 . 2 . . 394 . . 26 ARG HB3 . 18632 2 349 . 1 1 38 38 ARG HG2 H 1 1.255 0.004 . 2 . . 710 . . 26 ARG HG2 . 18632 2 350 . 1 1 38 38 ARG HG3 H 1 0.877 0.003 . 2 . . 688 . . 26 ARG HG3 . 18632 2 351 . 1 1 38 38 ARG HD2 H 1 1.929 0.002 . 1 . . 712 . . 26 ARG HD2 . 18632 2 352 . 1 1 38 38 ARG HD3 H 1 1.929 0.002 . 1 . . 711 . . 26 ARG HD3 . 18632 2 353 . 1 1 38 38 ARG HE H 1 5.616 0.001 . 1 . . 1267 . . 26 ARG HE . 18632 2 354 . 1 1 38 38 ARG CA C 13 54.490 0.043 . 1 . . 1689 . . 26 ARG CA . 18632 2 355 . 1 1 38 38 ARG CB C 13 31.926 0.032 . 1 . . 1690 . . 26 ARG CB . 18632 2 356 . 1 1 38 38 ARG CG C 13 27.673 0.046 . 1 . . 689 . . 26 ARG CG . 18632 2 357 . 1 1 38 38 ARG CD C 13 42.843 0.029 . 1 . . 713 . . 26 ARG CD . 18632 2 358 . 1 1 38 38 ARG N N 15 118.278 0.005 . 1 . . 1541 . . 26 ARG N . 18632 2 359 . 1 1 38 38 ARG NE N 15 82.144 0.005 . 1 . . 1268 . . 26 ARG NE . 18632 2 360 . 1 1 39 39 GLY H H 1 7.500 0.006 . 1 . . 1687 . . 27 GLY H . 18632 2 361 . 1 1 39 39 GLY HA2 H 1 3.524 0.001 . 2 . . 373 . . 27 GLY HA2 . 18632 2 362 . 1 1 39 39 GLY HA3 H 1 4.010 0.003 . 2 . . 374 . . 27 GLY HA3 . 18632 2 363 . 1 1 39 39 GLY CA C 13 45.055 0.033 . 1 . . 1538 . . 27 GLY CA . 18632 2 364 . 1 1 39 39 GLY N N 15 105.724 0.005 . 1 . . 1688 . . 27 GLY N . 18632 2 365 . 1 1 40 40 TYR H H 1 7.601 0.001 . 1 . . 234 . . 28 TYR H . 18632 2 366 . 1 1 40 40 TYR HA H 1 4.296 0.002 . 1 . . 375 . . 28 TYR HA . 18632 2 367 . 1 1 40 40 TYR HB2 H 1 2.333 0.003 . 2 . . 376 . . 28 TYR HB2 . 18632 2 368 . 1 1 40 40 TYR HB3 H 1 2.654 0.02 . 2 . . 714 . . 28 TYR HB3 . 18632 2 369 . 1 1 40 40 TYR HD1 H 1 6.982 0.003 . 3 . . 984 . . 28 TYR HD1 . 18632 2 370 . 1 1 40 40 TYR HD2 H 1 6.982 0.003 . 3 . . 984 . . 28 TYR HD2 . 18632 2 371 . 1 1 40 40 TYR HE1 H 1 6.490 0.003 . 3 . . 1013 . . 28 TYR HE1 . 18632 2 372 . 1 1 40 40 TYR HE2 H 1 6.490 0.003 . 3 . . 1013 . . 28 TYR HE2 . 18632 2 373 . 1 1 40 40 TYR CA C 13 59.359 0.047 . 1 . . 1539 . . 28 TYR CA . 18632 2 374 . 1 1 40 40 TYR CB C 13 39.080 0.016 . 1 . . 265 . . 28 TYR CB . 18632 2 375 . 1 1 40 40 TYR CD1 C 13 132.603 0.061 . 3 . . 1012 . . 28 TYR CD1 . 18632 2 376 . 1 1 40 40 TYR CD2 C 13 132.603 0.061 . 3 . . 1012 . . 28 TYR CD2 . 18632 2 377 . 1 1 40 40 TYR CE1 C 13 117.385 0.061 . 3 . . 1014 . . 28 TYR CE1 . 18632 2 378 . 1 1 40 40 TYR CE2 C 13 117.385 0.061 . 3 . . 1014 . . 28 TYR CE2 . 18632 2 379 . 1 1 40 40 TYR N N 15 119.450 0.005 . 1 . . 235 . . 28 TYR N . 18632 2 380 . 1 1 41 41 GLY H H 1 9.048 0.006 . 1 . . 1536 . . 29 GLY H . 18632 2 381 . 1 1 41 41 GLY HA2 H 1 4.233 0.002 . 2 . . 882 . . 29 GLY HA2 . 18632 2 382 . 1 1 41 41 GLY HA3 H 1 3.984 0.003 . 2 . . 881 . . 29 GLY HA3 . 18632 2 383 . 1 1 41 41 GLY CA C 13 44.253 0.008 . 1 . . 883 . . 29 GLY CA . 18632 2 384 . 1 1 41 41 GLY N N 15 112.362 0.005 . 1 . . 1537 . . 29 GLY N . 18632 2 385 . 1 1 42 42 TRP HA H 1 3.799 0.003 . 1 . . 377 . . 30 TRP HA . 18632 2 386 . 1 1 42 42 TRP HB2 H 1 3.295 0.004 . 2 . . 378 . . 30 TRP HB2 . 18632 2 387 . 1 1 42 42 TRP HB3 H 1 3.430 0.001 . 2 . . 379 . . 30 TRP HB3 . 18632 2 388 . 1 1 42 42 TRP HD1 H 1 7.217 0.004 . 1 . . 992 . . 30 TRP HD1 . 18632 2 389 . 1 1 42 42 TRP HE1 H 1 10.168 0.001 . 1 . . 70 . . 30 TRP HE1 . 18632 2 390 . 1 1 42 42 TRP HE3 H 1 7.441 0.004 . 1 . . 1250 . . 30 TRP HE3 . 18632 2 391 . 1 1 42 42 TRP HZ2 H 1 7.411 0.003 . 1 . . 991 . . 30 TRP HZ2 . 18632 2 392 . 1 1 42 42 TRP HZ3 H 1 7.104 0.001 . 1 . . 1036 . . 30 TRP HZ3 . 18632 2 393 . 1 1 42 42 TRP HH2 H 1 7.179 0.001 . 1 . . 998 . . 30 TRP HH2 . 18632 2 394 . 1 1 42 42 TRP CA C 13 63.350 0.02 . 1 . . 310 . . 30 TRP CA . 18632 2 395 . 1 1 42 42 TRP CB C 13 29.385 0.063 . 1 . . 309 . . 30 TRP CB . 18632 2 396 . 1 1 42 42 TRP CD1 C 13 126.915 0.077 . 1 . . 995 . . 30 TRP CD1 . 18632 2 397 . 1 1 42 42 TRP CE3 C 13 120.491 0.054 . 1 . . 1249 . . 30 TRP CE3 . 18632 2 398 . 1 1 42 42 TRP CZ2 C 13 114.920 0.051 . 1 . . 997 . . 30 TRP CZ2 . 18632 2 399 . 1 1 42 42 TRP CZ3 C 13 121.924 0.05 . 1 . . 1037 . . 30 TRP CZ3 . 18632 2 400 . 1 1 42 42 TRP CH2 C 13 124.685 0.082 . 1 . . 1001 . . 30 TRP CH2 . 18632 2 401 . 1 1 42 42 TRP NE1 N 15 130.038 0.005 . 1 . . 71 . . 30 TRP NE1 . 18632 2 402 . 1 1 43 43 ILE H H 1 8.233 0.001 . 1 . . 178 . . 31 ILE H . 18632 2 403 . 1 1 43 43 ILE HA H 1 3.437 0.002 . 1 . . 380 . . 31 ILE HA . 18632 2 404 . 1 1 43 43 ILE HB H 1 1.810 0.002 . 1 . . 381 . . 31 ILE HB . 18632 2 405 . 1 1 43 43 ILE HG12 H 1 1.544 0.003 . 2 . . 620 . . 31 ILE HG12 . 18632 2 406 . 1 1 43 43 ILE HG13 H 1 1.139 0.003 . 2 . . 621 . . 31 ILE HG13 . 18632 2 407 . 1 1 43 43 ILE HG21 H 1 0.838 0.003 . 1 . . 623 . . 31 ILE HG21 . 18632 2 408 . 1 1 43 43 ILE HG22 H 1 0.838 0.003 . 1 . . 623 . . 31 ILE HG22 . 18632 2 409 . 1 1 43 43 ILE HG23 H 1 0.838 0.003 . 1 . . 623 . . 31 ILE HG23 . 18632 2 410 . 1 1 43 43 ILE HD11 H 1 0.900 0.001 . 1 . . 622 . . 31 ILE HD11 . 18632 2 411 . 1 1 43 43 ILE HD12 H 1 0.900 0.001 . 1 . . 622 . . 31 ILE HD12 . 18632 2 412 . 1 1 43 43 ILE HD13 H 1 0.900 0.001 . 1 . . 622 . . 31 ILE HD13 . 18632 2 413 . 1 1 43 43 ILE CA C 13 65.003 0.076 . 1 . . 267 . . 31 ILE CA . 18632 2 414 . 1 1 43 43 ILE CB C 13 37.410 0.015 . 1 . . 268 . . 31 ILE CB . 18632 2 415 . 1 1 43 43 ILE CG1 C 13 28.792 0.056 . 1 . . 626 . . 31 ILE CG1 . 18632 2 416 . 1 1 43 43 ILE CG2 C 13 16.799 0.016 . 1 . . 624 . . 31 ILE CG2 . 18632 2 417 . 1 1 43 43 ILE CD1 C 13 12.618 0.024 . 1 . . 625 . . 31 ILE CD1 . 18632 2 418 . 1 1 43 43 ILE N N 15 117.673 0.005 . 1 . . 179 . . 31 ILE N . 18632 2 419 . 1 1 44 44 MET H H 1 7.808 0.004 . 1 . . 155 . . 32 MET H . 18632 2 420 . 1 1 44 44 MET HA H 1 4.411 0.002 . 1 . . 382 . . 32 MET HA . 18632 2 421 . 1 1 44 44 MET HB2 H 1 1.897 0.002 . 2 . . 383 . . 32 MET HB2 . 18632 2 422 . 1 1 44 44 MET HB3 H 1 2.148 0.002 . 2 . . 384 . . 32 MET HB3 . 18632 2 423 . 1 1 44 44 MET HG2 H 1 2.755 0.003 . 2 . . 725 . . 32 MET HG2 . 18632 2 424 . 1 1 44 44 MET HG3 H 1 2.602 0.006 . 2 . . 724 . . 32 MET HG3 . 18632 2 425 . 1 1 44 44 MET HE1 H 1 2.001 0.002 . 1 . . 1241 . . 32 MET HE1 . 18632 2 426 . 1 1 44 44 MET HE2 H 1 2.001 0.002 . 1 . . 1241 . . 32 MET HE2 . 18632 2 427 . 1 1 44 44 MET HE3 H 1 2.001 0.002 . 1 . . 1241 . . 32 MET HE3 . 18632 2 428 . 1 1 44 44 MET CA C 13 56.199 0.045 . 1 . . 1698 . . 32 MET CA . 18632 2 429 . 1 1 44 44 MET CB C 13 31.186 0.031 . 1 . . 1534 . . 32 MET CB . 18632 2 430 . 1 1 44 44 MET CG C 13 32.554 0.029 . 1 . . 726 . . 32 MET CG . 18632 2 431 . 1 1 44 44 MET CE C 13 16.052 0.05 . 1 . . 1242 . . 32 MET CE . 18632 2 432 . 1 1 44 44 MET N N 15 118.311 0.005 . 1 . . 156 . . 32 MET N . 18632 2 433 . 1 1 45 45 ARG H H 1 8.705 0.006 . 1 . . 242 . . 33 ARG H . 18632 2 434 . 1 1 45 45 ARG HA H 1 3.569 0.003 . 1 . . 385 . . 33 ARG HA . 18632 2 435 . 1 1 45 45 ARG HB2 H 1 0.896 0.003 . 2 . . 730 . . 33 ARG HB2 . 18632 2 436 . 1 1 45 45 ARG HB3 H 1 1.953 0.001 . 2 . . 727 . . 33 ARG HB3 . 18632 2 437 . 1 1 45 45 ARG HG2 H 1 1.400 0.006 . 2 . . 729 . . 33 ARG HG2 . 18632 2 438 . 1 1 45 45 ARG HG3 H 1 1.785 0.001 . 2 . . 728 . . 33 ARG HG3 . 18632 2 439 . 1 1 45 45 ARG HD2 H 1 3.193 0.004 . 2 . . 732 . . 33 ARG HD2 . 18632 2 440 . 1 1 45 45 ARG HD3 H 1 2.838 0.004 . 2 . . 731 . . 33 ARG HD3 . 18632 2 441 . 1 1 45 45 ARG CA C 13 61.377 0.042 . 1 . . 1535 . . 33 ARG CA . 18632 2 442 . 1 1 45 45 ARG CB C 13 28.855 0.028 . 1 . . 1528 . . 33 ARG CB . 18632 2 443 . 1 1 45 45 ARG CG C 13 29.219 0.032 . 1 . . 1075 . . 33 ARG CG . 18632 2 444 . 1 1 45 45 ARG CD C 13 44.261 0.03 . 1 . . 733 . . 33 ARG CD . 18632 2 445 . 1 1 45 45 ARG N N 15 117.297 0.005 . 1 . . 243 . . 33 ARG N . 18632 2 446 . 1 1 46 46 GLN H H 1 7.428 0.006 . 1 . . 90 . . 34 GLN H . 18632 2 447 . 1 1 46 46 GLN HA H 1 3.680 0.002 . 1 . . 386 . . 34 GLN HA . 18632 2 448 . 1 1 46 46 GLN HB2 H 1 1.870 0.001 . 2 . . 387 . . 34 GLN HB2 . 18632 2 449 . 1 1 46 46 GLN HB3 H 1 1.803 0.001 . 2 . . 1659 . . 34 GLN HB3 . 18632 2 450 . 1 1 46 46 GLN HG2 H 1 1.634 0.01 . 2 . . 715 . . 34 GLN HG2 . 18632 2 451 . 1 1 46 46 GLN HG3 H 1 1.703 0.006 . 2 . . 716 . . 34 GLN HG3 . 18632 2 452 . 1 1 46 46 GLN HE21 H 1 6.715 0.001 . 1 . . 76 . . 34 GLN HE21 . 18632 2 453 . 1 1 46 46 GLN HE22 H 1 6.473 0.001 . 1 . . 223 . . 34 GLN HE22 . 18632 2 454 . 1 1 46 46 GLN CA C 13 58.457 0.036 . 1 . . 1531 . . 34 GLN CA . 18632 2 455 . 1 1 46 46 GLN CB C 13 27.951 0.045 . 1 . . 1532 . . 34 GLN CB . 18632 2 456 . 1 1 46 46 GLN CG C 13 32.756 0.022 . 1 . . 1057 . . 34 GLN CG . 18632 2 457 . 1 1 46 46 GLN N N 15 115.951 0.005 . 1 . . 91 . . 34 GLN N . 18632 2 458 . 1 1 46 46 GLN NE2 N 15 112.055 0.006 . 1 . . 77 . . 34 GLN NE2 . 18632 2 459 . 1 1 47 47 VAL H H 1 7.261 0.017 . 1 . . 1529 . . 35 VAL H . 18632 2 460 . 1 1 47 47 VAL HA H 1 3.428 0.002 . 1 . . 388 . . 35 VAL HA . 18632 2 461 . 1 1 47 47 VAL HB H 1 2.204 0.002 . 1 . . 389 . . 35 VAL HB . 18632 2 462 . 1 1 47 47 VAL HG11 H 1 0.802 0.001 . 2 . . 650 . . 35 VAL HG11 . 18632 2 463 . 1 1 47 47 VAL HG12 H 1 0.802 0.001 . 2 . . 650 . . 35 VAL HG12 . 18632 2 464 . 1 1 47 47 VAL HG13 H 1 0.802 0.001 . 2 . . 650 . . 35 VAL HG13 . 18632 2 465 . 1 1 47 47 VAL HG21 H 1 1.022 0.003 . 2 . . 649 . . 35 VAL HG21 . 18632 2 466 . 1 1 47 47 VAL HG22 H 1 1.022 0.003 . 2 . . 649 . . 35 VAL HG22 . 18632 2 467 . 1 1 47 47 VAL HG23 H 1 1.022 0.003 . 2 . . 649 . . 35 VAL HG23 . 18632 2 468 . 1 1 47 47 VAL CA C 13 65.882 0.009 . 1 . . 272 . . 35 VAL CA . 18632 2 469 . 1 1 47 47 VAL CB C 13 32.187 0.035 . 1 . . 1533 . . 35 VAL CB . 18632 2 470 . 1 1 47 47 VAL CG1 C 13 20.843 0.005 . 2 . . 651 . . 35 VAL CG1 . 18632 2 471 . 1 1 47 47 VAL CG2 C 13 22.286 0.029 . 2 . . 648 . . 35 VAL CG2 . 18632 2 472 . 1 1 47 47 VAL N N 15 117.592 0.005 . 1 . . 1530 . . 35 VAL N . 18632 2 473 . 1 1 48 48 ILE H H 1 8.121 0.004 . 1 . . 167 . . 36 ILE H . 18632 2 474 . 1 1 48 48 ILE HA H 1 3.434 0.002 . 1 . . 415 . . 36 ILE HA . 18632 2 475 . 1 1 48 48 ILE HB H 1 1.369 0.001 . 1 . . 416 . . 36 ILE HB . 18632 2 476 . 1 1 48 48 ILE HG12 H 1 1.668 0.007 . 2 . . 905 . . 36 ILE HG12 . 18632 2 477 . 1 1 48 48 ILE HG13 H 1 0.687 0.001 . 2 . . 902 . . 36 ILE HG13 . 18632 2 478 . 1 1 48 48 ILE HG21 H 1 0.835 0.003 . 1 . . 903 . . 36 ILE HG21 . 18632 2 479 . 1 1 48 48 ILE HG22 H 1 0.835 0.003 . 1 . . 903 . . 36 ILE HG22 . 18632 2 480 . 1 1 48 48 ILE HG23 H 1 0.835 0.003 . 1 . . 903 . . 36 ILE HG23 . 18632 2 481 . 1 1 48 48 ILE HD11 H 1 -0.033 0.001 . 1 . . 900 . . 36 ILE HD11 . 18632 2 482 . 1 1 48 48 ILE HD12 H 1 -0.033 0.001 . 1 . . 900 . . 36 ILE HD12 . 18632 2 483 . 1 1 48 48 ILE HD13 H 1 -0.033 0.001 . 1 . . 900 . . 36 ILE HD13 . 18632 2 484 . 1 1 48 48 ILE CA C 13 65.494 0.04 . 1 . . 278 . . 36 ILE CA . 18632 2 485 . 1 1 48 48 ILE CB C 13 38.481 0.025 . 1 . . 277 . . 36 ILE CB . 18632 2 486 . 1 1 48 48 ILE CG1 C 13 29.847 0.027 . 1 . . 906 . . 36 ILE CG1 . 18632 2 487 . 1 1 48 48 ILE CG2 C 13 18.894 0.02 . 1 . . 904 . . 36 ILE CG2 . 18632 2 488 . 1 1 48 48 ILE CD1 C 13 14.209 0.021 . 1 . . 901 . . 36 ILE CD1 . 18632 2 489 . 1 1 48 48 ILE N N 15 117.538 0.005 . 1 . . 168 . . 36 ILE N . 18632 2 490 . 1 1 49 49 LYS H H 1 8.338 0.001 . 1 . . 137 . . 37 LYS H . 18632 2 491 . 1 1 49 49 LYS HA H 1 4.066 0.003 . 1 . . 390 . . 37 LYS HA . 18632 2 492 . 1 1 49 49 LYS HB2 H 1 1.893 0.002 . 2 . . 392 . . 37 LYS HB2 . 18632 2 493 . 1 1 49 49 LYS HB3 H 1 1.724 0.002 . 2 . . 391 . . 37 LYS HB3 . 18632 2 494 . 1 1 49 49 LYS HG2 H 1 1.493 0.001 . 2 . . 1092 . . 37 LYS HG2 . 18632 2 495 . 1 1 49 49 LYS HG3 H 1 1.615 0.003 . 2 . . 1087 . . 37 LYS HG3 . 18632 2 496 . 1 1 49 49 LYS HD2 H 1 1.729 0.004 . 2 . . 1089 . . 37 LYS HD2 . 18632 2 497 . 1 1 49 49 LYS HD3 H 1 1.488 0.001 . 2 . . 1090 . . 37 LYS HD3 . 18632 2 498 . 1 1 49 49 LYS HE2 H 1 2.868 0.001 . 2 . . 1091 . . 37 LYS HE2 . 18632 2 499 . 1 1 49 49 LYS HE3 H 1 2.699 0.006 . 2 . . 1088 . . 37 LYS HE3 . 18632 2 500 . 1 1 49 49 LYS CA C 13 59.842 0.028 . 1 . . 274 . . 37 LYS CA . 18632 2 501 . 1 1 49 49 LYS CB C 13 32.078 0.021 . 1 . . 301 . . 37 LYS CB . 18632 2 502 . 1 1 49 49 LYS CG C 13 25.620 0.029 . 1 . . 1084 . . 37 LYS CG . 18632 2 503 . 1 1 49 49 LYS CD C 13 29.305 0.035 . 1 . . 1085 . . 37 LYS CD . 18632 2 504 . 1 1 49 49 LYS CE C 13 41.483 0.06 . 1 . . 1086 . . 37 LYS CE . 18632 2 505 . 1 1 49 49 LYS N N 15 117.381 0.005 . 1 . . 138 . . 37 LYS N . 18632 2 506 . 1 1 50 50 LEU H H 1 7.328 0.007 . 1 . . 145 . . 38 LEU H . 18632 2 507 . 1 1 50 50 LEU HA H 1 4.278 0.002 . 1 . . 396 . . 38 LEU HA . 18632 2 508 . 1 1 50 50 LEU HB2 H 1 1.755 0.004 . 2 . . 397 . . 38 LEU HB2 . 18632 2 509 . 1 1 50 50 LEU HB3 H 1 1.566 0.001 . 2 . . 398 . . 38 LEU HB3 . 18632 2 510 . 1 1 50 50 LEU HG H 1 1.754 0.001 . 1 . . 736 . . 38 LEU HG . 18632 2 511 . 1 1 50 50 LEU HD11 H 1 0.820 0.001 . 2 . . 734 . . 38 LEU HD11 . 18632 2 512 . 1 1 50 50 LEU HD12 H 1 0.820 0.001 . 2 . . 734 . . 38 LEU HD12 . 18632 2 513 . 1 1 50 50 LEU HD13 H 1 0.820 0.001 . 2 . . 734 . . 38 LEU HD13 . 18632 2 514 . 1 1 50 50 LEU HD21 H 1 0.846 0.003 . 2 . . 735 . . 38 LEU HD21 . 18632 2 515 . 1 1 50 50 LEU HD22 H 1 0.846 0.003 . 2 . . 735 . . 38 LEU HD22 . 18632 2 516 . 1 1 50 50 LEU HD23 H 1 0.846 0.003 . 2 . . 735 . . 38 LEU HD23 . 18632 2 517 . 1 1 50 50 LEU CA C 13 55.007 0.028 . 1 . . 300 . . 38 LEU CA . 18632 2 518 . 1 1 50 50 LEU CB C 13 42.033 0.036 . 1 . . 1527 . . 38 LEU CB . 18632 2 519 . 1 1 50 50 LEU CG C 13 27.287 0.004 . 1 . . 737 . . 38 LEU CG . 18632 2 520 . 1 1 50 50 LEU CD1 C 13 24.885 0.087 . 2 . . 738 . . 38 LEU CD1 . 18632 2 521 . 1 1 50 50 LEU CD2 C 13 22.709 0.017 . 2 . . 739 . . 38 LEU CD2 . 18632 2 522 . 1 1 50 50 LEU N N 15 116.090 0.005 . 1 . . 146 . . 38 LEU N . 18632 2 523 . 1 1 51 51 ALA H H 1 7.028 0.006 . 1 . . 232 . . 39 ALA H . 18632 2 524 . 1 1 51 51 ALA HA H 1 4.105 0.003 . 1 . . 399 . . 39 ALA HA . 18632 2 525 . 1 1 51 51 ALA HB1 H 1 1.398 0.004 . 1 . . 400 . . 39 ALA HB1 . 18632 2 526 . 1 1 51 51 ALA HB2 H 1 1.398 0.004 . 1 . . 400 . . 39 ALA HB2 . 18632 2 527 . 1 1 51 51 ALA HB3 H 1 1.398 0.004 . 1 . . 400 . . 39 ALA HB3 . 18632 2 528 . 1 1 51 51 ALA CA C 13 52.892 0.028 . 1 . . 1526 . . 39 ALA CA . 18632 2 529 . 1 1 51 51 ALA CB C 13 18.089 0.128 . 1 . . 1525 . . 39 ALA CB . 18632 2 530 . 1 1 51 51 ALA N N 15 122.415 0.005 . 1 . . 233 . . 39 ALA N . 18632 2 531 . 1 1 52 52 GLY H H 1 8.359 0.006 . 1 . . 98 . . 40 GLY H . 18632 2 532 . 1 1 52 52 GLY HA2 H 1 4.262 0.006 . 2 . . 402 . . 40 GLY HA2 . 18632 2 533 . 1 1 52 52 GLY HA3 H 1 3.674 0.002 . 2 . . 401 . . 40 GLY HA3 . 18632 2 534 . 1 1 52 52 GLY CA C 13 45.156 0.019 . 1 . . 302 . . 40 GLY CA . 18632 2 535 . 1 1 52 52 GLY N N 15 112.046 0.005 . 1 . . 99 . . 40 GLY N . 18632 2 536 . 1 1 53 53 VAL H H 1 7.131 0.001 . 1 . . 80 . . 41 VAL H . 18632 2 537 . 1 1 53 53 VAL HA H 1 4.853 0.001 . 1 . . 1637 . . 41 VAL HA . 18632 2 538 . 1 1 53 53 VAL HB H 1 2.178 0.001 . 1 . . 403 . . 41 VAL HB . 18632 2 539 . 1 1 53 53 VAL HG11 H 1 0.953 0.006 . 2 . . 740 . . 41 VAL HG11 . 18632 2 540 . 1 1 53 53 VAL HG12 H 1 0.953 0.006 . 2 . . 740 . . 41 VAL HG12 . 18632 2 541 . 1 1 53 53 VAL HG13 H 1 0.953 0.006 . 2 . . 740 . . 41 VAL HG13 . 18632 2 542 . 1 1 53 53 VAL HG21 H 1 1.067 0.004 . 2 . . 741 . . 41 VAL HG21 . 18632 2 543 . 1 1 53 53 VAL HG22 H 1 1.067 0.004 . 2 . . 741 . . 41 VAL HG22 . 18632 2 544 . 1 1 53 53 VAL HG23 H 1 1.067 0.004 . 2 . . 741 . . 41 VAL HG23 . 18632 2 545 . 1 1 53 53 VAL CA C 13 62.231 0.124 . 1 . . 286 . . 41 VAL CA . 18632 2 546 . 1 1 53 53 VAL CB C 13 36.997 0.031 . 1 . . 259 . . 41 VAL CB . 18632 2 547 . 1 1 53 53 VAL CG1 C 13 21.805 0.022 . 2 . . 743 . . 41 VAL CG1 . 18632 2 548 . 1 1 53 53 VAL CG2 C 13 21.662 0.012 . 2 . . 742 . . 41 VAL CG2 . 18632 2 549 . 1 1 53 53 VAL N N 15 118.657 0.005 . 1 . . 81 . . 41 VAL N . 18632 2 550 . 1 1 54 54 THR H H 1 9.420 0.015 . 1 . . 182 . . 42 THR H . 18632 2 551 . 1 1 54 54 THR HA H 1 5.277 0.002 . 1 . . 404 . . 42 THR HA . 18632 2 552 . 1 1 54 54 THR HB H 1 4.097 0.002 . 1 . . 405 . . 42 THR HB . 18632 2 553 . 1 1 54 54 THR HG21 H 1 1.069 0.001 . 1 . . 744 . . 42 THR HG21 . 18632 2 554 . 1 1 54 54 THR HG22 H 1 1.069 0.001 . 1 . . 744 . . 42 THR HG22 . 18632 2 555 . 1 1 54 54 THR HG23 H 1 1.069 0.001 . 1 . . 744 . . 42 THR HG23 . 18632 2 556 . 1 1 54 54 THR CA C 13 62.022 0.022 . 1 . . 1523 . . 42 THR CA . 18632 2 557 . 1 1 54 54 THR CB C 13 71.589 0.034 . 1 . . 1524 . . 42 THR CB . 18632 2 558 . 1 1 54 54 THR CG2 C 13 22.180 0.011 . 1 . . 745 . . 42 THR CG2 . 18632 2 559 . 1 1 54 54 THR N N 15 126.017 0.005 . 1 . . 183 . . 42 THR N . 18632 2 560 . 1 1 55 55 LYS H H 1 9.516 0.006 . 1 . . 108 . . 43 LYS H . 18632 2 561 . 1 1 55 55 LYS HA H 1 5.428 0.006 . 1 . . 406 . . 43 LYS HA . 18632 2 562 . 1 1 55 55 LYS HB2 H 1 1.388 0.001 . 1 . . 407 . . 43 LYS HB2 . 18632 2 563 . 1 1 55 55 LYS HB3 H 1 1.388 0.001 . 1 . . 408 . . 43 LYS HB3 . 18632 2 564 . 1 1 55 55 LYS HG2 H 1 1.867 0.009 . 2 . . 929 . . 43 LYS HG2 . 18632 2 565 . 1 1 55 55 LYS HG3 H 1 0.912 0.003 . 2 . . 928 . . 43 LYS HG3 . 18632 2 566 . 1 1 55 55 LYS HD2 H 1 0.604 0.006 . 2 . . 934 . . 43 LYS HD2 . 18632 2 567 . 1 1 55 55 LYS HD3 H 1 1.389 0.004 . 2 . . 938 . . 43 LYS HD3 . 18632 2 568 . 1 1 55 55 LYS HE2 H 1 2.587 0.007 . 2 . . 937 . . 43 LYS HE2 . 18632 2 569 . 1 1 55 55 LYS HE3 H 1 3.282 0.007 . 2 . . 935 . . 43 LYS HE3 . 18632 2 570 . 1 1 55 55 LYS CA C 13 54.438 0.066 . 1 . . 1375 . . 43 LYS CA . 18632 2 571 . 1 1 55 55 LYS CB C 13 36.904 0.008 . 1 . . 1374 . . 43 LYS CB . 18632 2 572 . 1 1 55 55 LYS CG C 13 26.532 0.032 . 1 . . 927 . . 43 LYS CG . 18632 2 573 . 1 1 55 55 LYS CD C 13 30.052 0.042 . 1 . . 936 . . 43 LYS CD . 18632 2 574 . 1 1 55 55 LYS CE C 13 43.552 0.041 . 1 . . 939 . . 43 LYS CE . 18632 2 575 . 1 1 55 55 LYS N N 15 125.450 0.005 . 1 . . 109 . . 43 LYS N . 18632 2 576 . 1 1 56 56 LYS H H 1 8.828 0.009 . 1 . . 1372 . . 44 LYS H . 18632 2 577 . 1 1 56 56 LYS HA H 1 5.660 0.004 . 1 . . 409 . . 44 LYS HA . 18632 2 578 . 1 1 56 56 LYS HB2 H 1 1.460 0.003 . 2 . . 411 . . 44 LYS HB2 . 18632 2 579 . 1 1 56 56 LYS HB3 H 1 1.657 0.001 . 2 . . 410 . . 44 LYS HB3 . 18632 2 580 . 1 1 56 56 LYS HG2 H 1 1.544 0.001 . 2 . . 1096 . . 44 LYS HG2 . 18632 2 581 . 1 1 56 56 LYS HG3 H 1 1.197 0.002 . 2 . . 1097 . . 44 LYS HG3 . 18632 2 582 . 1 1 56 56 LYS HD3 H 1 1.487 0.003 . 1 . . 1098 . . 44 LYS HD3 . 18632 2 583 . 1 1 56 56 LYS HE3 H 1 2.721 0.001 . 1 . . 1099 . . 44 LYS HE3 . 18632 2 584 . 1 1 56 56 LYS CA C 13 54.926 0.041 . 1 . . 1371 . . 44 LYS CA . 18632 2 585 . 1 1 56 56 LYS CB C 13 36.653 0.013 . 1 . . 1370 . . 44 LYS CB . 18632 2 586 . 1 1 56 56 LYS CG C 13 25.714 0.026 . 1 . . 1093 . . 44 LYS CG . 18632 2 587 . 1 1 56 56 LYS CD C 13 29.893 0.022 . 1 . . 1094 . . 44 LYS CD . 18632 2 588 . 1 1 56 56 LYS CE C 13 41.904 0.061 . 1 . . 1095 . . 44 LYS CE . 18632 2 589 . 1 1 56 56 LYS N N 15 119.945 0.005 . 1 . . 1373 . . 44 LYS N . 18632 2 590 . 1 1 57 57 PHE H H 1 8.942 0.01 . 1 . . 66 . . 45 PHE H . 18632 2 591 . 1 1 57 57 PHE HA H 1 5.312 0.003 . 1 . . 417 . . 45 PHE HA . 18632 2 592 . 1 1 57 57 PHE HB2 H 1 2.649 0.001 . 2 . . 418 . . 45 PHE HB2 . 18632 2 593 . 1 1 57 57 PHE HB3 H 1 3.827 0.006 . 2 . . 1660 . . 45 PHE HB3 . 18632 2 594 . 1 1 57 57 PHE HD1 H 1 7.021 0.002 . 3 . . 1053 . . 45 PHE HD1 . 18632 2 595 . 1 1 57 57 PHE HD2 H 1 7.021 0.002 . 3 . . 1053 . . 45 PHE HD2 . 18632 2 596 . 1 1 57 57 PHE HE1 H 1 6.564 0.003 . 3 . . 1217 . . 45 PHE HE1 . 18632 2 597 . 1 1 57 57 PHE HE2 H 1 6.564 0.003 . 3 . . 1217 . . 45 PHE HE2 . 18632 2 598 . 1 1 57 57 PHE HZ H 1 6.251 0.003 . 1 . . 1038 . . 45 PHE HZ . 18632 2 599 . 1 1 57 57 PHE CA C 13 57.351 0.108 . 1 . . 1369 . . 45 PHE CA . 18632 2 600 . 1 1 57 57 PHE CB C 13 43.607 0.035 . 1 . . 1368 . . 45 PHE CB . 18632 2 601 . 1 1 57 57 PHE CD1 C 13 131.067 0.075 . 3 . . 1054 . . 45 PHE CD1 . 18632 2 602 . 1 1 57 57 PHE CD2 C 13 131.067 0.075 . 3 . . 1054 . . 45 PHE CD2 . 18632 2 603 . 1 1 57 57 PHE CE1 C 13 130.897 0.13 . 3 . . 1218 . . 45 PHE CE1 . 18632 2 604 . 1 1 57 57 PHE CE2 C 13 130.897 0.13 . 3 . . 1218 . . 45 PHE CE2 . 18632 2 605 . 1 1 57 57 PHE CZ C 13 128.901 0.026 . 1 . . 1039 . . 45 PHE CZ . 18632 2 606 . 1 1 57 57 PHE N N 15 119.884 0.005 . 1 . . 67 . . 45 PHE N . 18632 2 607 . 1 1 58 58 ARG H H 1 8.734 0.001 . 1 . . 1366 . . 46 ARG H . 18632 2 608 . 1 1 58 58 ARG HA H 1 5.035 0.001 . 1 . . 412 . . 46 ARG HA . 18632 2 609 . 1 1 58 58 ARG HB2 H 1 2.015 0.007 . 2 . . 414 . . 46 ARG HB2 . 18632 2 610 . 1 1 58 58 ARG HB3 H 1 1.778 0.001 . 2 . . 413 . . 46 ARG HB3 . 18632 2 611 . 1 1 58 58 ARG HG2 H 1 1.428 0.003 . 1 . . 659 . . 46 ARG HG2 . 18632 2 612 . 1 1 58 58 ARG HG3 H 1 1.428 0.003 . 1 . . 1076 . . 46 ARG HG3 . 18632 2 613 . 1 1 58 58 ARG HD2 H 1 3.239 0.003 . 1 . . 1077 . . 46 ARG HD2 . 18632 2 614 . 1 1 58 58 ARG HD3 H 1 3.239 0.003 . 1 . . 658 . . 46 ARG HD3 . 18632 2 615 . 1 1 58 58 ARG CA C 13 54.598 0.021 . 1 . . 1365 . . 46 ARG CA . 18632 2 616 . 1 1 58 58 ARG CB C 13 33.575 0.042 . 1 . . 1302 . . 46 ARG CB . 18632 2 617 . 1 1 58 58 ARG CG C 13 26.544 0.059 . 1 . . 660 . . 46 ARG CG . 18632 2 618 . 1 1 58 58 ARG CD C 13 43.095 0.023 . 1 . . 661 . . 46 ARG CD . 18632 2 619 . 1 1 58 58 ARG N N 15 117.286 0.005 . 1 . . 1367 . . 46 ARG N . 18632 2 620 . 1 1 59 59 ASN H H 1 8.643 0.01 . 1 . . 133 . . 47 ASN H . 18632 2 621 . 1 1 59 59 ASN HA H 1 4.384 0.004 . 1 . . 419 . . 47 ASN HA . 18632 2 622 . 1 1 59 59 ASN HB2 H 1 2.385 0.007 . 2 . . 420 . . 47 ASN HB2 . 18632 2 623 . 1 1 59 59 ASN HB3 H 1 2.783 0.002 . 2 . . 421 . . 47 ASN HB3 . 18632 2 624 . 1 1 59 59 ASN HD21 H 1 7.779 0.001 . 1 . . 12 . . 47 ASN HD21 . 18632 2 625 . 1 1 59 59 ASN HD22 H 1 7.095 0.001 . 1 . . 10 . . 47 ASN HD22 . 18632 2 626 . 1 1 59 59 ASN CA C 13 55.660 0.026 . 1 . . 1364 . . 47 ASN CA . 18632 2 627 . 1 1 59 59 ASN CB C 13 38.865 0.036 . 1 . . 1301 . . 47 ASN CB . 18632 2 628 . 1 1 59 59 ASN N N 15 119.772 0.005 . 1 . . 134 . . 47 ASN N . 18632 2 629 . 1 1 59 59 ASN ND2 N 15 113.045 0.018 . 1 . . 256 . . 47 ASN ND2 . 18632 2 630 . 1 1 60 60 ALA H H 1 8.226 0.001 . 1 . . 206 . . 48 ALA H . 18632 2 631 . 1 1 60 60 ALA HA H 1 3.775 0.003 . 1 . . 422 . . 48 ALA HA . 18632 2 632 . 1 1 60 60 ALA HB1 H 1 1.028 0.004 . 1 . . 423 . . 48 ALA HB1 . 18632 2 633 . 1 1 60 60 ALA HB2 H 1 1.028 0.004 . 1 . . 423 . . 48 ALA HB2 . 18632 2 634 . 1 1 60 60 ALA HB3 H 1 1.028 0.004 . 1 . . 423 . . 48 ALA HB3 . 18632 2 635 . 1 1 60 60 ALA CA C 13 52.986 0.023 . 1 . . 1362 . . 48 ALA CA . 18632 2 636 . 1 1 60 60 ALA CB C 13 17.913 0.029 . 1 . . 1363 . . 48 ALA CB . 18632 2 637 . 1 1 60 60 ALA N N 15 125.975 0.005 . 1 . . 207 . . 48 ALA N . 18632 2 638 . 1 1 61 61 ALA H H 1 9.844 0.008 . 1 . . 30 . . 49 ALA H . 18632 2 639 . 1 1 61 61 ALA HA H 1 3.995 0.002 . 1 . . 424 . . 49 ALA HA . 18632 2 640 . 1 1 61 61 ALA HB1 H 1 1.382 0.001 . 1 . . 425 . . 49 ALA HB1 . 18632 2 641 . 1 1 61 61 ALA HB2 H 1 1.382 0.001 . 1 . . 425 . . 49 ALA HB2 . 18632 2 642 . 1 1 61 61 ALA HB3 H 1 1.382 0.001 . 1 . . 425 . . 49 ALA HB3 . 18632 2 643 . 1 1 61 61 ALA CA C 13 54.487 0.061 . 1 . . 1360 . . 49 ALA CA . 18632 2 644 . 1 1 61 61 ALA CB C 13 17.961 0.005 . 1 . . 1361 . . 49 ALA CB . 18632 2 645 . 1 1 61 61 ALA N N 15 131.254 0.005 . 1 . . 1619 . . 49 ALA N . 18632 2 646 . 1 1 62 62 SER H H 1 8.491 0.009 . 1 . . 175 . . 50 SER H . 18632 2 647 . 1 1 62 62 SER HA H 1 4.027 0.003 . 1 . . 426 . . 50 SER HA . 18632 2 648 . 1 1 62 62 SER HB2 H 1 3.927 0.004 . 2 . . 428 . . 50 SER HB2 . 18632 2 649 . 1 1 62 62 SER HB3 H 1 3.814 0.002 . 2 . . 427 . . 50 SER HB3 . 18632 2 650 . 1 1 62 62 SER CA C 13 59.314 0.022 . 1 . . 1359 . . 50 SER CA . 18632 2 651 . 1 1 62 62 SER CB C 13 63.116 0.058 . 1 . . 1358 . . 50 SER CB . 18632 2 652 . 1 1 62 62 SER N N 15 113.149 0.005 . 1 . . 11 . . 50 SER N . 18632 2 653 . 1 1 63 63 GLY H H 1 7.843 0.001 . 1 . . 31 . . 51 GLY H . 18632 2 654 . 1 1 63 63 GLY HA2 H 1 4.086 0.003 . 2 . . 430 . . 51 GLY HA2 . 18632 2 655 . 1 1 63 63 GLY HA3 H 1 3.661 0.01 . 2 . . 429 . . 51 GLY HA3 . 18632 2 656 . 1 1 63 63 GLY CA C 13 45.093 0.05 . 1 . . 1355 . . 51 GLY CA . 18632 2 657 . 1 1 63 63 GLY N N 15 109.553 0.005 . 1 . . 32 . . 51 GLY N . 18632 2 658 . 1 1 64 64 LYS H H 1 7.399 0.007 . 1 . . 143 . . 52 LYS H . 18632 2 659 . 1 1 64 64 LYS HA H 1 4.199 0.003 . 1 . . 886 . . 52 LYS HA . 18632 2 660 . 1 1 64 64 LYS HB2 H 1 1.090 0.004 . 2 . . 887 . . 52 LYS HB2 . 18632 2 661 . 1 1 64 64 LYS HB3 H 1 1.577 0.001 . 2 . . 888 . . 52 LYS HB3 . 18632 2 662 . 1 1 64 64 LYS HG2 H 1 1.328 0.001 . 1 . . 889 . . 52 LYS HG2 . 18632 2 663 . 1 1 64 64 LYS HG3 H 1 1.328 0.001 . 1 . . 933 . . 52 LYS HG3 . 18632 2 664 . 1 1 64 64 LYS HD2 H 1 1.547 0.001 . 2 . . 1105 . . 52 LYS HD2 . 18632 2 665 . 1 1 64 64 LYS HD3 H 1 1.426 0.001 . 2 . . 1106 . . 52 LYS HD3 . 18632 2 666 . 1 1 64 64 LYS HE2 H 1 2.817 0.001 . 1 . . 1107 . . 52 LYS HE2 . 18632 2 667 . 1 1 64 64 LYS HE3 H 1 2.817 0.001 . 1 . . 1108 . . 52 LYS HE3 . 18632 2 668 . 1 1 64 64 LYS CA C 13 55.085 0.026 . 1 . . 1356 . . 52 LYS CA . 18632 2 669 . 1 1 64 64 LYS CB C 13 32.744 0.041 . 1 . . 1357 . . 52 LYS CB . 18632 2 670 . 1 1 64 64 LYS CG C 13 25.794 0.064 . 1 . . 1103 . . 52 LYS CG . 18632 2 671 . 1 1 64 64 LYS CD C 13 29.482 0.019 . 1 . . 1102 . . 52 LYS CD . 18632 2 672 . 1 1 64 64 LYS CE C 13 42.183 0.128 . 1 . . 1104 . . 52 LYS CE . 18632 2 673 . 1 1 64 64 LYS N N 15 122.403 0.005 . 1 . . 144 . . 52 LYS N . 18632 2 674 . 1 1 65 65 PRO HA H 1 4.206 0.001 . 1 . . 431 . . 53 PRO HA . 18632 2 675 . 1 1 65 65 PRO HB2 H 1 2.135 0.001 . 2 . . 433 . . 53 PRO HB2 . 18632 2 676 . 1 1 65 65 PRO HB3 H 1 1.737 0.003 . 2 . . 432 . . 53 PRO HB3 . 18632 2 677 . 1 1 65 65 PRO HG2 H 1 1.957 0.004 . 1 . . 947 . . 53 PRO HG2 . 18632 2 678 . 1 1 65 65 PRO HG3 H 1 1.957 0.004 . 1 . . 946 . . 53 PRO HG3 . 18632 2 679 . 1 1 65 65 PRO HD2 H 1 3.524 0.001 . 2 . . 948 . . 53 PRO HD2 . 18632 2 680 . 1 1 65 65 PRO HD3 H 1 3.821 0.002 . 2 . . 949 . . 53 PRO HD3 . 18632 2 681 . 1 1 65 65 PRO CA C 13 62.870 0.028 . 1 . . 1354 . . 53 PRO CA . 18632 2 682 . 1 1 65 65 PRO CB C 13 31.935 0.038 . 1 . . 1353 . . 53 PRO CB . 18632 2 683 . 1 1 65 65 PRO CG C 13 27.380 0.006 . 1 . . 950 . . 53 PRO CG . 18632 2 684 . 1 1 65 65 PRO CD C 13 50.760 0.032 . 1 . . 951 . . 53 PRO CD . 18632 2 685 . 1 1 66 66 ASP H H 1 8.424 0.004 . 1 . . 74 . . 54 ASP H . 18632 2 686 . 1 1 66 66 ASP HA H 1 4.137 0.003 . 1 . . 434 . . 54 ASP HA . 18632 2 687 . 1 1 66 66 ASP HB2 H 1 2.887 0.001 . 2 . . 746 . . 54 ASP HB2 . 18632 2 688 . 1 1 66 66 ASP HB3 H 1 2.801 0.001 . 2 . . 435 . . 54 ASP HB3 . 18632 2 689 . 1 1 66 66 ASP CA C 13 55.342 0.03 . 1 . . 1351 . . 54 ASP CA . 18632 2 690 . 1 1 66 66 ASP CB C 13 39.205 0.04 . 1 . . 1352 . . 54 ASP CB . 18632 2 691 . 1 1 66 66 ASP N N 15 116.027 0.005 . 1 . . 75 . . 54 ASP N . 18632 2 692 . 1 1 67 67 ARG H H 1 6.556 0.006 . 1 . . 33 . . 55 ARG H . 18632 2 693 . 1 1 67 67 ARG HA H 1 4.855 0.001 . 1 . . 436 . . 55 ARG HA . 18632 2 694 . 1 1 67 67 ARG HB2 H 1 0.918 0.006 . 2 . . 438 . . 55 ARG HB2 . 18632 2 695 . 1 1 67 67 ARG HB3 H 1 1.008 0.001 . 2 . . 437 . . 55 ARG HB3 . 18632 2 696 . 1 1 67 67 ARG HG2 H 1 1.137 0.003 . 2 . . 1079 . . 55 ARG HG2 . 18632 2 697 . 1 1 67 67 ARG HG3 H 1 1.341 0.003 . 2 . . 1082 . . 55 ARG HG3 . 18632 2 698 . 1 1 67 67 ARG HD2 H 1 2.650 0.007 . 2 . . 1080 . . 55 ARG HD2 . 18632 2 699 . 1 1 67 67 ARG HD3 H 1 2.805 0.001 . 2 . . 1081 . . 55 ARG HD3 . 18632 2 700 . 1 1 67 67 ARG CA C 13 53.631 0.005 . 1 . . 1350 . . 55 ARG CA . 18632 2 701 . 1 1 67 67 ARG CB C 13 33.476 0.039 . 1 . . 1349 . . 55 ARG CB . 18632 2 702 . 1 1 67 67 ARG CG C 13 28.913 0.034 . 1 . . 1078 . . 55 ARG CG . 18632 2 703 . 1 1 67 67 ARG CD C 13 43.020 0.145 . 1 . . 1083 . . 55 ARG CD . 18632 2 704 . 1 1 67 67 ARG N N 15 113.502 0.005 . 1 . . 34 . . 55 ARG N . 18632 2 705 . 1 1 68 68 TYR H H 1 8.706 0.013 . 1 . . 151 . . 56 TYR H . 18632 2 706 . 1 1 68 68 TYR HA H 1 4.412 0.009 . 1 . . 439 . . 56 TYR HA . 18632 2 707 . 1 1 68 68 TYR HB2 H 1 -0.494 0.001 . 2 . . 1237 . . 56 TYR HB2 . 18632 2 708 . 1 1 68 68 TYR HB3 H 1 2.066 0.006 . 2 . . 747 . . 56 TYR HB3 . 18632 2 709 . 1 1 68 68 TYR CA C 13 58.484 0.043 . 1 . . 1507 . . 56 TYR CA . 18632 2 710 . 1 1 68 68 TYR CB C 13 42.326 0.072 . 1 . . 1508 . . 56 TYR CB . 18632 2 711 . 1 1 68 68 TYR N N 15 120.802 0.005 . 1 . . 152 . . 56 TYR N . 18632 2 712 . 1 1 69 69 ASP H H 1 8.268 0.013 . 1 . . 106 . . 57 ASP H . 18632 2 713 . 1 1 69 69 ASP HA H 1 5.743 0.007 . 1 . . 440 . . 57 ASP HA . 18632 2 714 . 1 1 69 69 ASP HB2 H 1 2.767 0.002 . 2 . . 442 . . 57 ASP HB2 . 18632 2 715 . 1 1 69 69 ASP HB3 H 1 2.421 0.003 . 2 . . 441 . . 57 ASP HB3 . 18632 2 716 . 1 1 69 69 ASP CA C 13 51.678 0.036 . 1 . . 1505 . . 57 ASP CA . 18632 2 717 . 1 1 69 69 ASP CB C 13 43.821 0.024 . 1 . . 1504 . . 57 ASP CB . 18632 2 718 . 1 1 69 69 ASP N N 15 112.599 0.005 . 1 . . 107 . . 57 ASP N . 18632 2 719 . 1 1 70 70 MET H H 1 9.493 0.006 . 1 . . 149 . . 58 MET H . 18632 2 720 . 1 1 70 70 MET HA H 1 5.549 0.004 . 1 . . 443 . . 58 MET HA . 18632 2 721 . 1 1 70 70 MET HB2 H 1 2.129 0.001 . 2 . . 444 . . 58 MET HB2 . 18632 2 722 . 1 1 70 70 MET HB3 H 1 1.811 0.01 . 2 . . 751 . . 58 MET HB3 . 18632 2 723 . 1 1 70 70 MET HG2 H 1 1.950 0.003 . 2 . . 445 . . 58 MET HG2 . 18632 2 724 . 1 1 70 70 MET HG3 H 1 1.652 0.007 . 2 . . 752 . . 58 MET HG3 . 18632 2 725 . 1 1 70 70 MET CA C 13 54.514 0.024 . 1 . . 1501 . . 58 MET CA . 18632 2 726 . 1 1 70 70 MET CB C 13 37.606 0.08 . 1 . . 1500 . . 58 MET CB . 18632 2 727 . 1 1 70 70 MET CG C 13 33.087 0.026 . 1 . . 753 . . 58 MET CG . 18632 2 728 . 1 1 70 70 MET N N 15 119.625 0.005 . 1 . . 150 . . 58 MET N . 18632 2 729 . 1 1 71 71 GLU H H 1 9.035 0.003 . 1 . . 186 . . 59 GLU H . 18632 2 730 . 1 1 71 71 GLU HA H 1 4.818 0.001 . 1 . . 1706 . . 59 GLU HA . 18632 2 731 . 1 1 71 71 GLU HB2 H 1 1.977 0.001 . 2 . . 1182 . . 59 GLU HB2 . 18632 2 732 . 1 1 71 71 GLU HB3 H 1 1.476 0.009 . 2 . . 1705 . . 59 GLU HB3 . 18632 2 733 . 1 1 71 71 GLU HG2 H 1 1.751 0.001 . 1 . . 1183 . . 59 GLU HG2 . 18632 2 734 . 1 1 71 71 GLU HG3 H 1 1.751 0.001 . 1 . . 1184 . . 59 GLU HG3 . 18632 2 735 . 1 1 71 71 GLU CA C 13 55.202 0.005 . 1 . . 1707 . . 59 GLU CA . 18632 2 736 . 1 1 71 71 GLU CB C 13 34.473 0.037 . 1 . . 1499 . . 59 GLU CB . 18632 2 737 . 1 1 71 71 GLU CG C 13 37.253 0.019 . 1 . . 1181 . . 59 GLU CG . 18632 2 738 . 1 1 71 71 GLU N N 15 123.637 0.005 . 1 . . 187 . . 59 GLU N . 18632 2 739 . 1 1 72 72 ASN H H 1 7.530 0.003 . 1 . . 1502 . . 60 ASN H . 18632 2 740 . 1 1 72 72 ASN HA H 1 5.175 0.002 . 1 . . 446 . . 60 ASN HA . 18632 2 741 . 1 1 72 72 ASN HB2 H 1 3.142 0.004 . 2 . . 448 . . 60 ASN HB2 . 18632 2 742 . 1 1 72 72 ASN HB3 H 1 2.059 0.006 . 2 . . 447 . . 60 ASN HB3 . 18632 2 743 . 1 1 72 72 ASN HD21 H 1 8.430 0.001 . 1 . . 1708 . . 60 ASN HD21 . 18632 2 744 . 1 1 72 72 ASN HD22 H 1 6.373 0.01 . 1 . . 1265 . . 60 ASN HD22 . 18632 2 745 . 1 1 72 72 ASN CA C 13 53.118 0.002 . 1 . . 263 . . 60 ASN CA . 18632 2 746 . 1 1 72 72 ASN CB C 13 41.696 0.068 . 1 . . 279 . . 60 ASN CB . 18632 2 747 . 1 1 72 72 ASN N N 15 119.704 0.005 . 1 . . 1503 . . 60 ASN N . 18632 2 748 . 1 1 72 72 ASN ND2 N 15 115.385 0.005 . 1 . . 1266 . . 60 ASN ND2 . 18632 2 749 . 1 1 73 73 LEU H H 1 9.274 0.01 . 1 . . 56 . . 61 LEU H . 18632 2 750 . 1 1 73 73 LEU HA H 1 5.401 0.001 . 1 . . 451 . . 61 LEU HA . 18632 2 751 . 1 1 73 73 LEU HB2 H 1 1.459 0.002 . 2 . . 449 . . 61 LEU HB2 . 18632 2 752 . 1 1 73 73 LEU HB3 H 1 1.808 0.002 . 2 . . 450 . . 61 LEU HB3 . 18632 2 753 . 1 1 73 73 LEU HG H 1 1.467 0.004 . 1 . . 1131 . . 61 LEU HG . 18632 2 754 . 1 1 73 73 LEU HD11 H 1 0.827 0.006 . 2 . . 755 . . 61 LEU HD11 . 18632 2 755 . 1 1 73 73 LEU HD12 H 1 0.827 0.006 . 2 . . 755 . . 61 LEU HD12 . 18632 2 756 . 1 1 73 73 LEU HD13 H 1 0.827 0.006 . 2 . . 755 . . 61 LEU HD13 . 18632 2 757 . 1 1 73 73 LEU HD21 H 1 0.774 0.002 . 2 . . 754 . . 61 LEU HD21 . 18632 2 758 . 1 1 73 73 LEU HD22 H 1 0.774 0.002 . 2 . . 754 . . 61 LEU HD22 . 18632 2 759 . 1 1 73 73 LEU HD23 H 1 0.774 0.002 . 2 . . 754 . . 61 LEU HD23 . 18632 2 760 . 1 1 73 73 LEU CA C 13 53.056 0.03 . 1 . . 282 . . 61 LEU CA . 18632 2 761 . 1 1 73 73 LEU CB C 13 41.480 0.041 . 1 . . 281 . . 61 LEU CB . 18632 2 762 . 1 1 73 73 LEU CG C 13 26.925 0.059 . 1 . . 1130 . . 61 LEU CG . 18632 2 763 . 1 1 73 73 LEU CD1 C 13 24.005 0.051 . 2 . . 757 . . 61 LEU CD1 . 18632 2 764 . 1 1 73 73 LEU CD2 C 13 25.863 0.057 . 2 . . 756 . . 61 LEU CD2 . 18632 2 765 . 1 1 73 73 LEU N N 15 123.105 0.005 . 1 . . 57 . . 61 LEU N . 18632 2 766 . 1 1 74 74 THR H H 1 8.716 0.001 . 1 . . 224 . . 62 THR H . 18632 2 767 . 1 1 74 74 THR HA H 1 6.013 0.003 . 1 . . 891 . . 62 THR HA . 18632 2 768 . 1 1 74 74 THR HB H 1 4.579 0.001 . 1 . . 890 . . 62 THR HB . 18632 2 769 . 1 1 74 74 THR HG1 H 1 6.741 0.001 . 1 . . 1291 . . 62 THR HG1 . 18632 2 770 . 1 1 74 74 THR HG21 H 1 1.366 0.002 . 1 . . 892 . . 62 THR HG21 . 18632 2 771 . 1 1 74 74 THR HG22 H 1 1.366 0.002 . 1 . . 892 . . 62 THR HG22 . 18632 2 772 . 1 1 74 74 THR HG23 H 1 1.366 0.002 . 1 . . 892 . . 62 THR HG23 . 18632 2 773 . 1 1 74 74 THR CA C 13 59.415 0.041 . 1 . . 271 . . 62 THR CA . 18632 2 774 . 1 1 74 74 THR CB C 13 72.733 0.009 . 1 . . 280 . . 62 THR CB . 18632 2 775 . 1 1 74 74 THR CG2 C 13 21.835 0.034 . 1 . . 893 . . 62 THR CG2 . 18632 2 776 . 1 1 74 74 THR N N 15 117.383 0.005 . 1 . . 225 . . 62 THR N . 18632 2 777 . 1 1 75 75 THR H H 1 8.019 0.004 . 1 . . 159 . . 63 THR H . 18632 2 778 . 1 1 75 75 THR HA H 1 4.126 0.002 . 1 . . 453 . . 63 THR HA . 18632 2 779 . 1 1 75 75 THR HB H 1 4.370 0.001 . 1 . . 452 . . 63 THR HB . 18632 2 780 . 1 1 75 75 THR HG21 H 1 1.372 0.002 . 1 . . 884 . . 63 THR HG21 . 18632 2 781 . 1 1 75 75 THR HG22 H 1 1.372 0.002 . 1 . . 884 . . 63 THR HG22 . 18632 2 782 . 1 1 75 75 THR HG23 H 1 1.372 0.002 . 1 . . 884 . . 63 THR HG23 . 18632 2 783 . 1 1 75 75 THR CA C 13 64.206 0.024 . 1 . . 303 . . 63 THR CA . 18632 2 784 . 1 1 75 75 THR CB C 13 68.624 0.021 . 1 . . 283 . . 63 THR CB . 18632 2 785 . 1 1 75 75 THR CG2 C 13 23.194 0.054 . 1 . . 885 . . 63 THR CG2 . 18632 2 786 . 1 1 75 75 THR N N 15 109.196 0.005 . 1 . . 160 . . 63 THR N . 18632 2 787 . 1 1 76 76 LYS H H 1 7.567 0.011 . 1 . . 41 . . 64 LYS H . 18632 2 788 . 1 1 76 76 LYS HA H 1 4.528 0.007 . 1 . . 454 . . 64 LYS HA . 18632 2 789 . 1 1 76 76 LYS HB2 H 1 1.433 0.001 . 2 . . 455 . . 64 LYS HB2 . 18632 2 790 . 1 1 76 76 LYS HB3 H 1 1.708 0.006 . 2 . . 456 . . 64 LYS HB3 . 18632 2 791 . 1 1 76 76 LYS HG2 H 1 1.261 0.001 . 1 . . 759 . . 64 LYS HG2 . 18632 2 792 . 1 1 76 76 LYS HG3 H 1 1.261 0.001 . 1 . . 758 . . 64 LYS HG3 . 18632 2 793 . 1 1 76 76 LYS HD2 H 1 1.606 0.003 . 1 . . 764 . . 64 LYS HD2 . 18632 2 794 . 1 1 76 76 LYS HD3 H 1 1.606 0.003 . 1 . . 763 . . 64 LYS HD3 . 18632 2 795 . 1 1 76 76 LYS HE2 H 1 2.815 0.002 . 2 . . 761 . . 64 LYS HE2 . 18632 2 796 . 1 1 76 76 LYS HE3 H 1 2.930 0.001 . 2 . . 762 . . 64 LYS HE3 . 18632 2 797 . 1 1 76 76 LYS CA C 13 55.075 0.024 . 1 . . 1681 . . 64 LYS CA . 18632 2 798 . 1 1 76 76 LYS CB C 13 34.788 0.032 . 1 . . 1682 . . 64 LYS CB . 18632 2 799 . 1 1 76 76 LYS CG C 13 23.835 0.043 . 1 . . 760 . . 64 LYS CG . 18632 2 800 . 1 1 76 76 LYS CD C 13 27.672 0.074 . 1 . . 1109 . . 64 LYS CD . 18632 2 801 . 1 1 76 76 LYS CE C 13 41.824 0.018 . 1 . . 1110 . . 64 LYS CE . 18632 2 802 . 1 1 76 76 LYS N N 15 117.274 0.005 . 1 . . 42 . . 64 LYS N . 18632 2 803 . 1 1 77 77 LYS H H 1 7.015 0.01 . 1 . . 1506 . . 65 LYS H . 18632 2 804 . 1 1 77 77 LYS HA H 1 4.311 0.002 . 1 . . 457 . . 65 LYS HA . 18632 2 805 . 1 1 77 77 LYS HB2 H 1 1.448 0.004 . 2 . . 458 . . 65 LYS HB2 . 18632 2 806 . 1 1 77 77 LYS HB3 H 1 1.991 0.002 . 2 . . 459 . . 65 LYS HB3 . 18632 2 807 . 1 1 77 77 LYS HG2 H 1 1.271 0.004 . 2 . . 1115 . . 65 LYS HG2 . 18632 2 808 . 1 1 77 77 LYS HG3 H 1 1.694 0.001 . 2 . . 1113 . . 65 LYS HG3 . 18632 2 809 . 1 1 77 77 LYS HD2 H 1 1.633 0.002 . 2 . . 1185 . . 65 LYS HD2 . 18632 2 810 . 1 1 77 77 LYS HD3 H 1 1.820 0.004 . 2 . . 1116 . . 65 LYS HD3 . 18632 2 811 . 1 1 77 77 LYS HE2 H 1 2.996 0.001 . 2 . . 1186 . . 65 LYS HE2 . 18632 2 812 . 1 1 77 77 LYS HE3 H 1 2.807 0.003 . 2 . . 1187 . . 65 LYS HE3 . 18632 2 813 . 1 1 77 77 LYS CA C 13 56.553 0.021 . 1 . . 1498 . . 65 LYS CA . 18632 2 814 . 1 1 77 77 LYS CB C 13 34.788 0.035 . 1 . . 1497 . . 65 LYS CB . 18632 2 815 . 1 1 77 77 LYS CG C 13 24.777 0.026 . 1 . . 1111 . . 65 LYS CG . 18632 2 816 . 1 1 77 77 LYS CD C 13 29.101 0.045 . 1 . . 1114 . . 65 LYS CD . 18632 2 817 . 1 1 77 77 LYS CE C 13 42.623 0.02 . 1 . . 1112 . . 65 LYS CE . 18632 2 818 . 1 1 77 77 LYS N N 15 119.677 0.005 . 1 . . 29 . . 65 LYS N . 18632 2 819 . 1 1 78 78 ASP H H 1 8.608 0.009 . 1 . . 248 . . 66 ASP H . 18632 2 820 . 1 1 78 78 ASP HA H 1 5.990 0.003 . 1 . . 460 . . 66 ASP HA . 18632 2 821 . 1 1 78 78 ASP HB2 H 1 2.446 0.003 . 2 . . 461 . . 66 ASP HB2 . 18632 2 822 . 1 1 78 78 ASP HB3 H 1 2.875 0.009 . 2 . . 462 . . 66 ASP HB3 . 18632 2 823 . 1 1 78 78 ASP CA C 13 52.795 0.037 . 1 . . 1496 . . 66 ASP CA . 18632 2 824 . 1 1 78 78 ASP CB C 13 43.828 0.035 . 1 . . 1495 . . 66 ASP CB . 18632 2 825 . 1 1 78 78 ASP N N 15 127.295 0.005 . 1 . . 249 . . 66 ASP N . 18632 2 826 . 1 1 79 79 THR H H 1 9.418 0.018 . 1 . . 1493 . . 67 THR H . 18632 2 827 . 1 1 79 79 THR HA H 1 4.507 0.015 . 1 . . 895 . . 67 THR HA . 18632 2 828 . 1 1 79 79 THR HB H 1 4.027 0.006 . 1 . . 894 . . 67 THR HB . 18632 2 829 . 1 1 79 79 THR HG1 H 1 4.291 0.001 . 1 . . 1714 . . 67 THR HG1 . 18632 2 830 . 1 1 79 79 THR HG21 H 1 1.005 0.002 . 1 . . 896 . . 67 THR HG21 . 18632 2 831 . 1 1 79 79 THR HG22 H 1 1.005 0.002 . 1 . . 896 . . 67 THR HG22 . 18632 2 832 . 1 1 79 79 THR HG23 H 1 1.005 0.002 . 1 . . 896 . . 67 THR HG23 . 18632 2 833 . 1 1 79 79 THR CA C 13 60.533 0.063 . 1 . . 1491 . . 67 THR CA . 18632 2 834 . 1 1 79 79 THR CB C 13 71.456 0.031 . 1 . . 1492 . . 67 THR CB . 18632 2 835 . 1 1 79 79 THR CG2 C 13 22.057 0.047 . 1 . . 897 . . 67 THR CG2 . 18632 2 836 . 1 1 79 79 THR N N 15 110.585 0.005 . 1 . . 1494 . . 67 THR N . 18632 2 837 . 1 1 80 80 HIS H H 1 8.089 0.008 . 1 . . 1489 . . 68 HIS H . 18632 2 838 . 1 1 80 80 HIS HA H 1 4.906 0.001 . 1 . . 463 . . 68 HIS HA . 18632 2 839 . 1 1 80 80 HIS HB3 H 1 3.083 0.009 . 1 . . 464 . . 68 HIS HB3 . 18632 2 840 . 1 1 80 80 HIS HD2 H 1 6.493 0.001 . 1 . . 1005 . . 68 HIS HD2 . 18632 2 841 . 1 1 80 80 HIS CA C 13 53.981 0.005 . 1 . . 1487 . . 68 HIS CA . 18632 2 842 . 1 1 80 80 HIS CB C 13 30.951 0.018 . 1 . . 1488 . . 68 HIS CB . 18632 2 843 . 1 1 80 80 HIS CD2 C 13 121.979 0.005 . 1 . . 1048 . . 68 HIS CD2 . 18632 2 844 . 1 1 80 80 HIS N N 15 121.423 0.005 . 1 . . 1490 . . 68 HIS N . 18632 2 845 . 1 1 81 81 HIS H H 1 9.441 0.018 . 1 . . 1485 . . 69 HIS H . 18632 2 846 . 1 1 81 81 HIS HA H 1 5.429 0.003 . 1 . . 465 . . 69 HIS HA . 18632 2 847 . 1 1 81 81 HIS HB2 H 1 3.546 0.004 . 2 . . 765 . . 69 HIS HB2 . 18632 2 848 . 1 1 81 81 HIS HB3 H 1 3.394 0.003 . 2 . . 466 . . 69 HIS HB3 . 18632 2 849 . 1 1 81 81 HIS HD1 H 1 13.456 0.002 . 1 . . 96 . . 69 HIS HD1 . 18632 2 850 . 1 1 81 81 HIS HD2 H 1 7.378 0.008 . 1 . . 1051 . . 69 HIS HD2 . 18632 2 851 . 1 1 81 81 HIS HE1 H 1 7.937 0.004 . 1 . . 1174 . . 69 HIS HE1 . 18632 2 852 . 1 1 81 81 HIS CA C 13 53.564 0.07 . 1 . . 1484 . . 69 HIS CA . 18632 2 853 . 1 1 81 81 HIS CB C 13 29.766 0.101 . 1 . . 1483 . . 69 HIS CB . 18632 2 854 . 1 1 81 81 HIS CD2 C 13 130.229 0.006 . 1 . . 1052 . . 69 HIS CD2 . 18632 2 855 . 1 1 81 81 HIS CE1 C 13 140.543 0.019 . 1 . . 1175 . . 69 HIS CE1 . 18632 2 856 . 1 1 81 81 HIS N N 15 125.775 0.005 . 1 . . 1486 . . 69 HIS N . 18632 2 857 . 1 1 81 81 HIS ND1 N 15 168.951 0.005 . 1 . . 97 . . 69 HIS ND1 . 18632 2 858 . 1 1 82 82 LYS H H 1 9.085 0.006 . 1 . . 250 . . 70 LYS H . 18632 2 859 . 1 1 82 82 LYS HA H 1 5.102 0.001 . 1 . . 467 . . 70 LYS HA . 18632 2 860 . 1 1 82 82 LYS HB3 H 1 1.539 0.003 . 1 . . 468 . . 70 LYS HB3 . 18632 2 861 . 1 1 82 82 LYS HG2 H 1 1.042 0.006 . 1 . . 766 . . 70 LYS HG2 . 18632 2 862 . 1 1 82 82 LYS HD3 H 1 1.391 0.003 . 1 . . 770 . . 70 LYS HD3 . 18632 2 863 . 1 1 82 82 LYS HE3 H 1 2.474 0.006 . 1 . . 768 . . 70 LYS HE3 . 18632 2 864 . 1 1 82 82 LYS CA C 13 55.424 0.02 . 1 . . 1482 . . 70 LYS CA . 18632 2 865 . 1 1 82 82 LYS CB C 13 35.493 0.02 . 1 . . 1481 . . 70 LYS CB . 18632 2 866 . 1 1 82 82 LYS CG C 13 24.833 0.031 . 1 . . 767 . . 70 LYS CG . 18632 2 867 . 1 1 82 82 LYS CD C 13 29.192 0.007 . 1 . . 771 . . 70 LYS CD . 18632 2 868 . 1 1 82 82 LYS CE C 13 41.380 0.047 . 1 . . 769 . . 70 LYS CE . 18632 2 869 . 1 1 82 82 LYS N N 15 125.663 0.005 . 1 . . 251 . . 70 LYS N . 18632 2 870 . 1 1 83 83 ASP H H 1 8.980 0.001 . 1 . . 52 . . 71 ASP H . 18632 2 871 . 1 1 83 83 ASP HA H 1 3.905 0.001 . 1 . . 469 . . 71 ASP HA . 18632 2 872 . 1 1 83 83 ASP HB2 H 1 3.009 0.002 . 2 . . 471 . . 71 ASP HB2 . 18632 2 873 . 1 1 83 83 ASP HB3 H 1 2.557 0.001 . 2 . . 470 . . 71 ASP HB3 . 18632 2 874 . 1 1 83 83 ASP CA C 13 55.776 0.028 . 1 . . 1480 . . 71 ASP CA . 18632 2 875 . 1 1 83 83 ASP CB C 13 39.930 0.074 . 1 . . 1479 . . 71 ASP CB . 18632 2 876 . 1 1 83 83 ASP N N 15 121.215 0.005 . 1 . . 53 . . 71 ASP N . 18632 2 877 . 1 1 84 84 TRP H H 1 8.861 0.006 . 1 . . 123 . . 72 TRP H . 18632 2 878 . 1 1 84 84 TRP HA H 1 5.061 0.007 . 1 . . 472 . . 72 TRP HA . 18632 2 879 . 1 1 84 84 TRP HB2 H 1 3.729 0.006 . 2 . . 474 . . 72 TRP HB2 . 18632 2 880 . 1 1 84 84 TRP HB3 H 1 2.327 0.003 . 2 . . 473 . . 72 TRP HB3 . 18632 2 881 . 1 1 84 84 TRP HD1 H 1 6.368 0.004 . 1 . . 990 . . 72 TRP HD1 . 18632 2 882 . 1 1 84 84 TRP HE1 H 1 7.964 0.008 . 1 . . 1004 . . 72 TRP HE1 . 18632 2 883 . 1 1 84 84 TRP HZ2 H 1 6.513 0.003 . 1 . . 1008 . . 72 TRP HZ2 . 18632 2 884 . 1 1 84 84 TRP HZ3 H 1 6.185 0.004 . 1 . . 1044 . . 72 TRP HZ3 . 18632 2 885 . 1 1 84 84 TRP CA C 13 54.258 0.005 . 1 . . 1477 . . 72 TRP CA . 18632 2 886 . 1 1 84 84 TRP CB C 13 32.427 0.049 . 1 . . 1478 . . 72 TRP CB . 18632 2 887 . 1 1 84 84 TRP CD1 C 13 127.912 0.079 . 1 . . 1003 . . 72 TRP CD1 . 18632 2 888 . 1 1 84 84 TRP CZ2 C 13 112.955 0.037 . 1 . . 1007 . . 72 TRP CZ2 . 18632 2 889 . 1 1 84 84 TRP CZ3 C 13 122.385 0.09 . 1 . . 1045 . . 72 TRP CZ3 . 18632 2 890 . 1 1 84 84 TRP N N 15 118.919 0.005 . 1 . . 214 . . 72 TRP N . 18632 2 891 . 1 1 84 84 TRP NE1 N 15 123.624 0.005 . 1 . . 124 . . 72 TRP NE1 . 18632 2 892 . 1 1 85 85 ALA H H 1 9.118 0.006 . 1 . . 84 . . 73 ALA H . 18632 2 893 . 1 1 85 85 ALA HA H 1 5.218 0.001 . 1 . . 1828 . . 73 ALA HA . 18632 2 894 . 1 1 85 85 ALA HB1 H 1 1.476 0.002 . 1 . . 1829 . . 73 ALA HB1 . 18632 2 895 . 1 1 85 85 ALA HB2 H 1 1.476 0.002 . 1 . . 1829 . . 73 ALA HB2 . 18632 2 896 . 1 1 85 85 ALA HB3 H 1 1.476 0.002 . 1 . . 1829 . . 73 ALA HB3 . 18632 2 897 . 1 1 85 85 ALA CA C 13 49.416 0.005 . 1 . . 1475 . . 73 ALA CA . 18632 2 898 . 1 1 85 85 ALA CB C 13 22.313 0.018 . 1 . . 1476 . . 73 ALA CB . 18632 2 899 . 1 1 85 85 ALA N N 15 120.644 0.005 . 1 . . 85 . . 73 ALA N . 18632 2 900 . 1 1 86 86 LEU H H 1 9.654 0.009 . 1 . . 21 . . 74 LEU H . 18632 2 901 . 1 1 86 86 LEU HA H 1 4.648 0.001 . 1 . . 1830 . . 74 LEU HA . 18632 2 902 . 1 1 86 86 LEU HB2 H 1 1.896 0.004 . 2 . . 476 . . 74 LEU HB2 . 18632 2 903 . 1 1 86 86 LEU HB3 H 1 1.547 0.001 . 2 . . 475 . . 74 LEU HB3 . 18632 2 904 . 1 1 86 86 LEU HG H 1 1.900 0.003 . 1 . . 1135 . . 74 LEU HG . 18632 2 905 . 1 1 86 86 LEU HD11 H 1 0.730 0.016 . 2 . . 1061 . . 74 LEU HD11 . 18632 2 906 . 1 1 86 86 LEU HD12 H 1 0.730 0.016 . 2 . . 1061 . . 74 LEU HD12 . 18632 2 907 . 1 1 86 86 LEU HD13 H 1 0.730 0.016 . 2 . . 1061 . . 74 LEU HD13 . 18632 2 908 . 1 1 86 86 LEU HD21 H 1 0.792 0.016 . 2 . . 1133 . . 74 LEU HD21 . 18632 2 909 . 1 1 86 86 LEU HD22 H 1 0.792 0.016 . 2 . . 1133 . . 74 LEU HD22 . 18632 2 910 . 1 1 86 86 LEU HD23 H 1 0.792 0.016 . 2 . . 1133 . . 74 LEU HD23 . 18632 2 911 . 1 1 86 86 LEU CA C 13 56.020 0.011 . 1 . . 1474 . . 74 LEU CA . 18632 2 912 . 1 1 86 86 LEU CB C 13 41.258 0.067 . 1 . . 1473 . . 74 LEU CB . 18632 2 913 . 1 1 86 86 LEU CG C 13 27.430 0.024 . 1 . . 1134 . . 74 LEU CG . 18632 2 914 . 1 1 86 86 LEU CD1 C 13 26.042 0.032 . 2 . . 1062 . . 74 LEU CD1 . 18632 2 915 . 1 1 86 86 LEU CD2 C 13 24.046 0.031 . 2 . . 1132 . . 74 LEU CD2 . 18632 2 916 . 1 1 86 86 LEU N N 15 124.511 0.005 . 1 . . 22 . . 74 LEU N . 18632 2 917 . 1 1 87 87 GLY H H 1 10.077 0.001 . 1 . . 230 . . 75 GLY H . 18632 2 918 . 1 1 87 87 GLY HA2 H 1 3.514 0.003 . 2 . . 477 . . 75 GLY HA2 . 18632 2 919 . 1 1 87 87 GLY HA3 H 1 4.250 0.003 . 2 . . 478 . . 75 GLY HA3 . 18632 2 920 . 1 1 87 87 GLY CA C 13 45.473 0.039 . 1 . . 1472 . . 75 GLY CA . 18632 2 921 . 1 1 87 87 GLY N N 15 110.788 0.005 . 1 . . 231 . . 75 GLY N . 18632 2 922 . 1 1 88 88 GLU H H 1 7.840 0.001 . 1 . . 58 . . 76 GLU H . 18632 2 923 . 1 1 88 88 GLU HA H 1 4.797 0.001 . 1 . . 617 . . 76 GLU HA . 18632 2 924 . 1 1 88 88 GLU HB2 H 1 1.962 0.002 . 2 . . 618 . . 76 GLU HB2 . 18632 2 925 . 1 1 88 88 GLU HB3 H 1 2.571 0.002 . 2 . . 619 . . 76 GLU HB3 . 18632 2 926 . 1 1 88 88 GLU HG2 H 1 2.346 0.001 . 2 . . 956 . . 76 GLU HG2 . 18632 2 927 . 1 1 88 88 GLU HG3 H 1 2.200 0.001 . 2 . . 957 . . 76 GLU HG3 . 18632 2 928 . 1 1 88 88 GLU CA C 13 55.181 0.005 . 1 . . 1471 . . 76 GLU CA . 18632 2 929 . 1 1 88 88 GLU CB C 13 32.127 0.025 . 1 . . 1470 . . 76 GLU CB . 18632 2 930 . 1 1 88 88 GLU CG C 13 36.941 0.002 . 1 . . 958 . . 76 GLU CG . 18632 2 931 . 1 1 88 88 GLU N N 15 121.280 0.005 . 1 . . 59 . . 76 GLU N . 18632 2 932 . 1 1 89 89 GLU H H 1 8.893 0.006 . 1 . . 139 . . 77 GLU H . 18632 2 933 . 1 1 89 89 GLU HA H 1 4.756 0.001 . 1 . . 479 . . 77 GLU HA . 18632 2 934 . 1 1 89 89 GLU HB2 H 1 1.838 0.002 . 2 . . 1655 . . 77 GLU HB2 . 18632 2 935 . 1 1 89 89 GLU HB3 H 1 1.906 0.001 . 2 . . 1656 . . 77 GLU HB3 . 18632 2 936 . 1 1 89 89 GLU HG2 H 1 1.848 0.004 . 2 . . 952 . . 77 GLU HG2 . 18632 2 937 . 1 1 89 89 GLU HG3 H 1 1.721 0.001 . 2 . . 1189 . . 77 GLU HG3 . 18632 2 938 . 1 1 89 89 GLU CA C 13 57.165 0.013 . 1 . . 1468 . . 77 GLU CA . 18632 2 939 . 1 1 89 89 GLU CB C 13 31.907 0.042 . 1 . . 1469 . . 77 GLU CB . 18632 2 940 . 1 1 89 89 GLU CG C 13 37.849 0.018 . 1 . . 1188 . . 77 GLU CG . 18632 2 941 . 1 1 89 89 GLU N N 15 134.430 0.005 . 1 . . 140 . . 77 GLU N . 18632 2 942 . 1 1 90 90 PHE H H 1 8.994 0.004 . 1 . . 171 . . 78 PHE H . 18632 2 943 . 1 1 90 90 PHE HA H 1 5.127 0.006 . 1 . . 1822 . . 78 PHE HA . 18632 2 944 . 1 1 90 90 PHE HB2 H 1 3.282 0.007 . 1 . . 480 . . 78 PHE HB2 . 18632 2 945 . 1 1 90 90 PHE HB3 H 1 3.282 0.007 . 1 . . 1823 . . 78 PHE HB3 . 18632 2 946 . 1 1 90 90 PHE HD1 H 1 7.352 0.003 . 3 . . 983 . . 78 PHE HD1 . 18632 2 947 . 1 1 90 90 PHE HD2 H 1 7.352 0.003 . 3 . . 983 . . 78 PHE HD2 . 18632 2 948 . 1 1 90 90 PHE HE1 H 1 7.062 0.004 . 3 . . 1163 . . 78 PHE HE1 . 18632 2 949 . 1 1 90 90 PHE HE2 H 1 7.062 0.004 . 3 . . 1163 . . 78 PHE HE2 . 18632 2 950 . 1 1 90 90 PHE HZ H 1 6.616 0.004 . 1 . . 1034 . . 78 PHE HZ . 18632 2 951 . 1 1 90 90 PHE CA C 13 55.698 0.022 . 1 . . 1466 . . 78 PHE CA . 18632 2 952 . 1 1 90 90 PHE CB C 13 41.848 0.042 . 1 . . 1467 . . 78 PHE CB . 18632 2 953 . 1 1 90 90 PHE CD1 C 13 133.397 0.031 . 3 . . 1033 . . 78 PHE CD1 . 18632 2 954 . 1 1 90 90 PHE CD2 C 13 133.397 0.031 . 3 . . 1033 . . 78 PHE CD2 . 18632 2 955 . 1 1 90 90 PHE CE1 C 13 130.700 0.103 . 3 . . 1162 . . 78 PHE CE1 . 18632 2 956 . 1 1 90 90 PHE CE2 C 13 130.700 0.103 . 3 . . 1162 . . 78 PHE CE2 . 18632 2 957 . 1 1 90 90 PHE CZ C 13 128.485 0.132 . 1 . . 1035 . . 78 PHE CZ . 18632 2 958 . 1 1 90 90 PHE N N 15 125.048 0.005 . 1 . . 172 . . 78 PHE N . 18632 2 959 . 1 1 91 91 GLN H H 1 8.812 0.001 . 1 . . 45 . . 79 GLN H . 18632 2 960 . 1 1 91 91 GLN HA H 1 5.513 0.004 . 1 . . 481 . . 79 GLN HA . 18632 2 961 . 1 1 91 91 GLN HB2 H 1 1.904 0.001 . 2 . . 1190 . . 79 GLN HB2 . 18632 2 962 . 1 1 91 91 GLN HB3 H 1 1.959 0.001 . 2 . . 1191 . . 79 GLN HB3 . 18632 2 963 . 1 1 91 91 GLN HG2 H 1 1.971 0.002 . 2 . . 748 . . 79 GLN HG2 . 18632 2 964 . 1 1 91 91 GLN HG3 H 1 2.466 0.004 . 2 . . 750 . . 79 GLN HG3 . 18632 2 965 . 1 1 91 91 GLN HE21 H 1 6.890 0.006 . 1 . . 15 . . 79 GLN HE21 . 18632 2 966 . 1 1 91 91 GLN HE22 H 1 8.045 0.001 . 1 . . 13 . . 79 GLN HE22 . 18632 2 967 . 1 1 91 91 GLN CA C 13 53.895 0.04 . 1 . . 1464 . . 79 GLN CA . 18632 2 968 . 1 1 91 91 GLN CB C 13 31.092 0.028 . 1 . . 1465 . . 79 GLN CB . 18632 2 969 . 1 1 91 91 GLN CG C 13 34.455 0.046 . 1 . . 749 . . 79 GLN CG . 18632 2 970 . 1 1 91 91 GLN N N 15 121.019 0.005 . 1 . . 46 . . 79 GLN N . 18632 2 971 . 1 1 91 91 GLN NE2 N 15 112.684 0.004 . 1 . . 14 . . 79 GLN NE2 . 18632 2 972 . 1 1 92 92 ASP H H 1 9.091 0.007 . 1 . . 1463 . . 80 ASP H . 18632 2 973 . 1 1 92 92 ASP HA H 1 5.187 0.001 . 1 . . 482 . . 80 ASP HA . 18632 2 974 . 1 1 92 92 ASP HB2 H 1 2.601 0.001 . 2 . . 483 . . 80 ASP HB2 . 18632 2 975 . 1 1 92 92 ASP HB3 H 1 3.237 0.006 . 2 . . 484 . . 80 ASP HB3 . 18632 2 976 . 1 1 92 92 ASP CA C 13 52.708 0.035 . 1 . . 1460 . . 80 ASP CA . 18632 2 977 . 1 1 92 92 ASP CB C 13 45.771 0.065 . 1 . . 1461 . . 80 ASP CB . 18632 2 978 . 1 1 92 92 ASP N N 15 124.025 0.005 . 1 . . 1462 . . 80 ASP N . 18632 2 979 . 1 1 93 93 GLU H H 1 8.348 0.008 . 1 . . 49 . . 81 GLU H . 18632 2 980 . 1 1 93 93 GLU HA H 1 4.342 0.013 . 1 . . 1824 . . 81 GLU HA . 18632 2 981 . 1 1 93 93 GLU HB2 H 1 1.907 0.001 . 1 . . 485 . . 81 GLU HB2 . 18632 2 982 . 1 1 93 93 GLU HB3 H 1 1.907 0.001 . 1 . . 1825 . . 81 GLU HB3 . 18632 2 983 . 1 1 93 93 GLU HG2 H 1 1.958 0.003 . 2 . . 954 . . 81 GLU HG2 . 18632 2 984 . 1 1 93 93 GLU HG3 H 1 2.550 0.002 . 2 . . 953 . . 81 GLU HG3 . 18632 2 985 . 1 1 93 93 GLU CA C 13 56.425 0.05 . 1 . . 1459 . . 81 GLU CA . 18632 2 986 . 1 1 93 93 GLU CB C 13 30.584 0.007 . 1 . . 1458 . . 81 GLU CB . 18632 2 987 . 1 1 93 93 GLU CG C 13 36.953 0.016 . 1 . . 955 . . 81 GLU CG . 18632 2 988 . 1 1 93 93 GLU N N 15 121.388 0.005 . 1 . . 50 . . 81 GLU N . 18632 2 989 . 1 1 94 94 ALA H H 1 8.219 0.009 . 1 . . 135 . . 82 ALA H . 18632 2 990 . 1 1 94 94 ALA HA H 1 4.649 0.003 . 1 . . 1827 . . 82 ALA HA . 18632 2 991 . 1 1 94 94 ALA HB1 H 1 0.821 0.001 . 1 . . 1826 . . 82 ALA HB1 . 18632 2 992 . 1 1 94 94 ALA HB2 H 1 0.821 0.001 . 1 . . 1826 . . 82 ALA HB2 . 18632 2 993 . 1 1 94 94 ALA HB3 H 1 0.821 0.001 . 1 . . 1826 . . 82 ALA HB3 . 18632 2 994 . 1 1 94 94 ALA CA C 13 50.480 0.003 . 1 . . 1456 . . 82 ALA CA . 18632 2 995 . 1 1 94 94 ALA CB C 13 19.803 0.021 . 1 . . 1457 . . 82 ALA CB . 18632 2 996 . 1 1 94 94 ALA N N 15 129.726 0.005 . 1 . . 136 . . 82 ALA N . 18632 2 997 . 1 1 95 95 LEU H H 1 9.246 0.009 . 1 . . 1454 . . 83 LEU H . 18632 2 998 . 1 1 95 95 LEU HA H 1 3.660 0.004 . 1 . . 486 . . 83 LEU HA . 18632 2 999 . 1 1 95 95 LEU HB2 H 1 1.722 0.001 . 2 . . 784 . . 83 LEU HB2 . 18632 2 1000 . 1 1 95 95 LEU HB3 H 1 1.240 0.007 . 2 . . 487 . . 83 LEU HB3 . 18632 2 1001 . 1 1 95 95 LEU HG H 1 1.817 0.004 . 1 . . 1151 . . 83 LEU HG . 18632 2 1002 . 1 1 95 95 LEU HD11 H 1 0.794 0.014 . 2 . . 1147 . . 83 LEU HD11 . 18632 2 1003 . 1 1 95 95 LEU HD12 H 1 0.794 0.014 . 2 . . 1147 . . 83 LEU HD12 . 18632 2 1004 . 1 1 95 95 LEU HD13 H 1 0.794 0.014 . 2 . . 1147 . . 83 LEU HD13 . 18632 2 1005 . 1 1 95 95 LEU HD21 H 1 0.822 0.004 . 2 . . 783 . . 83 LEU HD21 . 18632 2 1006 . 1 1 95 95 LEU HD22 H 1 0.822 0.004 . 2 . . 783 . . 83 LEU HD22 . 18632 2 1007 . 1 1 95 95 LEU HD23 H 1 0.822 0.004 . 2 . . 783 . . 83 LEU HD23 . 18632 2 1008 . 1 1 95 95 LEU CA C 13 57.516 0.032 . 1 . . 1453 . . 83 LEU CA . 18632 2 1009 . 1 1 95 95 LEU CB C 13 42.739 0.034 . 1 . . 1452 . . 83 LEU CB . 18632 2 1010 . 1 1 95 95 LEU CG C 13 27.413 0.014 . 1 . . 1150 . . 83 LEU CG . 18632 2 1011 . 1 1 95 95 LEU CD1 C 13 24.832 0.098 . 2 . . 1148 . . 83 LEU CD1 . 18632 2 1012 . 1 1 95 95 LEU CD2 C 13 26.103 0.035 . 2 . . 1149 . . 83 LEU CD2 . 18632 2 1013 . 1 1 95 95 LEU N N 15 120.565 0.005 . 1 . . 1455 . . 83 LEU N . 18632 2 1014 . 1 1 96 96 ASP H H 1 7.135 0.006 . 1 . . 1450 . . 84 ASP H . 18632 2 1015 . 1 1 96 96 ASP HA H 1 4.223 0.002 . 1 . . 488 . . 84 ASP HA . 18632 2 1016 . 1 1 96 96 ASP HB2 H 1 2.492 0.001 . 2 . . 489 . . 84 ASP HB2 . 18632 2 1017 . 1 1 96 96 ASP HB3 H 1 3.158 0.001 . 2 . . 490 . . 84 ASP HB3 . 18632 2 1018 . 1 1 96 96 ASP CA C 13 53.394 0.041 . 1 . . 1449 . . 84 ASP CA . 18632 2 1019 . 1 1 96 96 ASP CB C 13 39.727 0.027 . 1 . . 1448 . . 84 ASP CB . 18632 2 1020 . 1 1 96 96 ASP N N 15 113.285 0.005 . 1 . . 1451 . . 84 ASP N . 18632 2 1021 . 1 1 97 97 SER H H 1 8.293 0.001 . 1 . . 194 . . 85 SER H . 18632 2 1022 . 1 1 97 97 SER HA H 1 4.272 0.003 . 1 . . 491 . . 85 SER HA . 18632 2 1023 . 1 1 97 97 SER HB2 H 1 4.119 0.003 . 2 . . 1194 . . 85 SER HB2 . 18632 2 1024 . 1 1 97 97 SER HB3 H 1 4.411 0.001 . 2 . . 1192 . . 85 SER HB3 . 18632 2 1025 . 1 1 97 97 SER CA C 13 60.957 0.005 . 1 . . 1680 . . 85 SER CA . 18632 2 1026 . 1 1 97 97 SER CB C 13 60.890 0.03 . 1 . . 1193 . . 85 SER CB . 18632 2 1027 . 1 1 97 97 SER N N 15 107.417 0.005 . 1 . . 195 . . 85 SER N . 18632 2 1028 . 1 1 98 98 THR H H 1 8.268 0.009 . 1 . . 238 . . 86 THR H . 18632 2 1029 . 1 1 98 98 THR HA H 1 4.900 0.002 . 1 . . 492 . . 86 THR HA . 18632 2 1030 . 1 1 98 98 THR HB H 1 4.330 0.003 . 1 . . 493 . . 86 THR HB . 18632 2 1031 . 1 1 98 98 THR HG21 H 1 1.064 0.003 . 1 . . 772 . . 86 THR HG21 . 18632 2 1032 . 1 1 98 98 THR HG22 H 1 1.064 0.003 . 1 . . 772 . . 86 THR HG22 . 18632 2 1033 . 1 1 98 98 THR HG23 H 1 1.064 0.003 . 1 . . 772 . . 86 THR HG23 . 18632 2 1034 . 1 1 98 98 THR CA C 13 59.930 0.141 . 1 . . 1447 . . 86 THR CA . 18632 2 1035 . 1 1 98 98 THR CB C 13 71.775 0.011 . 1 . . 1446 . . 86 THR CB . 18632 2 1036 . 1 1 98 98 THR CG2 C 13 21.651 0.027 . 1 . . 773 . . 86 THR CG2 . 18632 2 1037 . 1 1 98 98 THR N N 15 112.715 0.005 . 1 . . 239 . . 86 THR N . 18632 2 1038 . 1 1 99 99 GLN H H 1 8.572 0.006 . 1 . . 100 . . 87 GLN H . 18632 2 1039 . 1 1 99 99 GLN HA H 1 4.544 0.002 . 1 . . 494 . . 87 GLN HA . 18632 2 1040 . 1 1 99 99 GLN HB2 H 1 1.924 0.007 . 2 . . 496 . . 87 GLN HB2 . 18632 2 1041 . 1 1 99 99 GLN HB3 H 1 2.022 0.006 . 2 . . 495 . . 87 GLN HB3 . 18632 2 1042 . 1 1 99 99 GLN HG2 H 1 2.394 0.001 . 1 . . 1059 . . 87 GLN HG2 . 18632 2 1043 . 1 1 99 99 GLN HG3 H 1 2.394 0.001 . 1 . . 1060 . . 87 GLN HG3 . 18632 2 1044 . 1 1 99 99 GLN HE21 H 1 7.898 0.007 . 1 . . 5 . . 87 GLN HE21 . 18632 2 1045 . 1 1 99 99 GLN HE22 H 1 7.027 0.007 . 1 . . 7 . . 87 GLN HE22 . 18632 2 1046 . 1 1 99 99 GLN CA C 13 54.967 0.019 . 1 . . 1445 . . 87 GLN CA . 18632 2 1047 . 1 1 99 99 GLN CB C 13 29.230 0.04 . 1 . . 1444 . . 87 GLN CB . 18632 2 1048 . 1 1 99 99 GLN CG C 13 33.540 0.04 . 1 . . 1064 . . 87 GLN CG . 18632 2 1049 . 1 1 99 99 GLN N N 15 115.364 0.005 . 1 . . 101 . . 87 GLN N . 18632 2 1050 . 1 1 99 99 GLN NE2 N 15 114.226 0.005 . 1 . . 6 . . 87 GLN NE2 . 18632 2 1051 . 1 1 100 100 HIS H H 1 9.412 0.013 . 1 . . 153 . . 88 HIS H . 18632 2 1052 . 1 1 100 100 HIS HA H 1 5.451 0.002 . 1 . . 499 . . 88 HIS HA . 18632 2 1053 . 1 1 100 100 HIS HB2 H 1 2.777 0.003 . 2 . . 498 . . 88 HIS HB2 . 18632 2 1054 . 1 1 100 100 HIS HB3 H 1 2.777 0.003 . 2 . . 497 . . 88 HIS HB3 . 18632 2 1055 . 1 1 100 100 HIS HD2 H 1 7.045 0.003 . 1 . . 1046 . . 88 HIS HD2 . 18632 2 1056 . 1 1 100 100 HIS HE1 H 1 8.300 0.001 . 1 . . 1172 . . 88 HIS HE1 . 18632 2 1057 . 1 1 100 100 HIS CA C 13 52.852 0.015 . 1 . . 1298 . . 88 HIS CA . 18632 2 1058 . 1 1 100 100 HIS CB C 13 35.343 0.042 . 1 . . 1297 . . 88 HIS CB . 18632 2 1059 . 1 1 100 100 HIS CD2 C 13 116.065 0.105 . 1 . . 1047 . . 88 HIS CD2 . 18632 2 1060 . 1 1 100 100 HIS CE1 C 13 134.669 0.02 . 1 . . 1173 . . 88 HIS CE1 . 18632 2 1061 . 1 1 100 100 HIS N N 15 122.997 0.005 . 1 . . 154 . . 88 HIS N . 18632 2 1062 . 1 1 101 101 LYS H H 1 9.373 0.012 . 1 . . 25 . . 89 LYS H . 18632 2 1063 . 1 1 101 101 LYS HA H 1 4.722 0.008 . 1 . . 500 . . 89 LYS HA . 18632 2 1064 . 1 1 101 101 LYS HB2 H 1 1.583 0.001 . 2 . . 502 . . 89 LYS HB2 . 18632 2 1065 . 1 1 101 101 LYS HB3 H 1 1.393 0.007 . 2 . . 501 . . 89 LYS HB3 . 18632 2 1066 . 1 1 101 101 LYS HG2 H 1 1.230 0.003 . 2 . . 1024 . . 89 LYS HG2 . 18632 2 1067 . 1 1 101 101 LYS HG3 H 1 1.137 0.003 . 2 . . 1023 . . 89 LYS HG3 . 18632 2 1068 . 1 1 101 101 LYS HE2 H 1 2.813 0.001 . 1 . . 1026 . . 89 LYS HE2 . 18632 2 1069 . 1 1 101 101 LYS HE3 H 1 2.813 0.001 . 1 . . 1025 . . 89 LYS HE3 . 18632 2 1070 . 1 1 101 101 LYS CA C 13 55.304 0.12 . 1 . . 1299 . . 89 LYS CA . 18632 2 1071 . 1 1 101 101 LYS CB C 13 32.550 0.024 . 1 . . 1300 . . 89 LYS CB . 18632 2 1072 . 1 1 101 101 LYS CG C 13 25.228 0.031 . 1 . . 1117 . . 89 LYS CG . 18632 2 1073 . 1 1 101 101 LYS CD C 13 29.264 0.014 . 1 . . 1118 . . 89 LYS CD . 18632 2 1074 . 1 1 101 101 LYS CE C 13 41.942 0.054 . 1 . . 1119 . . 89 LYS CE . 18632 2 1075 . 1 1 101 101 LYS N N 15 119.927 0.005 . 1 . . 26 . . 89 LYS N . 18632 2 1076 . 1 1 102 102 ILE H H 1 8.946 0.001 . 1 . . 1 . . 90 ILE H . 18632 2 1077 . 1 1 102 102 ILE HA H 1 4.604 0.003 . 1 . . 503 . . 90 ILE HA . 18632 2 1078 . 1 1 102 102 ILE HB H 1 -0.232 0.003 . 1 . . 504 . . 90 ILE HB . 18632 2 1079 . 1 1 102 102 ILE HG12 H 1 0.856 0.002 . 2 . . 779 . . 90 ILE HG12 . 18632 2 1080 . 1 1 102 102 ILE HG13 H 1 -0.733 0.004 . 2 . . 780 . . 90 ILE HG13 . 18632 2 1081 . 1 1 102 102 ILE HG21 H 1 -0.481 0.003 . 1 . . 774 . . 90 ILE HG21 . 18632 2 1082 . 1 1 102 102 ILE HG22 H 1 -0.481 0.003 . 1 . . 774 . . 90 ILE HG22 . 18632 2 1083 . 1 1 102 102 ILE HG23 H 1 -0.481 0.003 . 1 . . 774 . . 90 ILE HG23 . 18632 2 1084 . 1 1 102 102 ILE HD11 H 1 0.076 0.001 . 1 . . 776 . . 90 ILE HD11 . 18632 2 1085 . 1 1 102 102 ILE HD12 H 1 0.076 0.001 . 1 . . 776 . . 90 ILE HD12 . 18632 2 1086 . 1 1 102 102 ILE HD13 H 1 0.076 0.001 . 1 . . 776 . . 90 ILE HD13 . 18632 2 1087 . 1 1 102 102 ILE CA C 13 58.975 0.005 . 1 . . 1522 . . 90 ILE CA . 18632 2 1088 . 1 1 102 102 ILE CB C 13 39.557 0.06 . 1 . . 1521 . . 90 ILE CB . 18632 2 1089 . 1 1 102 102 ILE CG1 C 13 27.392 0.027 . 1 . . 778 . . 90 ILE CG1 . 18632 2 1090 . 1 1 102 102 ILE CG2 C 13 16.630 0.029 . 1 . . 775 . . 90 ILE CG2 . 18632 2 1091 . 1 1 102 102 ILE CD1 C 13 13.766 0.031 . 1 . . 777 . . 90 ILE CD1 . 18632 2 1092 . 1 1 102 102 ILE N N 15 128.670 0.005 . 1 . . 2 . . 90 ILE N . 18632 2 1093 . 1 1 103 103 THR H H 1 7.810 0.004 . 1 . . 212 . . 91 THR H . 18632 2 1094 . 1 1 103 103 THR HA H 1 4.297 0.006 . 1 . . 505 . . 91 THR HA . 18632 2 1095 . 1 1 103 103 THR HB H 1 3.524 0.003 . 1 . . 506 . . 91 THR HB . 18632 2 1096 . 1 1 103 103 THR HG21 H 1 0.873 0.004 . 1 . . 781 . . 91 THR HG21 . 18632 2 1097 . 1 1 103 103 THR HG22 H 1 0.873 0.004 . 1 . . 781 . . 91 THR HG22 . 18632 2 1098 . 1 1 103 103 THR HG23 H 1 0.873 0.004 . 1 . . 781 . . 91 THR HG23 . 18632 2 1099 . 1 1 103 103 THR CA C 13 61.816 0.087 . 1 . . 1519 . . 91 THR CA . 18632 2 1100 . 1 1 103 103 THR CB C 13 71.634 0.013 . 1 . . 1520 . . 91 THR CB . 18632 2 1101 . 1 1 103 103 THR CG2 C 13 20.661 0.005 . 1 . . 782 . . 91 THR CG2 . 18632 2 1102 . 1 1 103 103 THR N N 15 116.915 0.005 . 1 . . 213 . . 91 THR N . 18632 2 1103 . 1 1 104 104 PHE H H 1 10.134 0.004 . 1 . . 86 . . 92 PHE H . 18632 2 1104 . 1 1 104 104 PHE HA H 1 5.677 0.002 . 1 . . 507 . . 92 PHE HA . 18632 2 1105 . 1 1 104 104 PHE HB2 H 1 2.369 0.003 . 1 . . 509 . . 92 PHE HB2 . 18632 2 1106 . 1 1 104 104 PHE HB3 H 1 2.369 0.003 . 1 . . 508 . . 92 PHE HB3 . 18632 2 1107 . 1 1 104 104 PHE HD1 H 1 6.380 0.006 . 3 . . 1009 . . 92 PHE HD1 . 18632 2 1108 . 1 1 104 104 PHE HD2 H 1 6.380 0.006 . 3 . . 1009 . . 92 PHE HD2 . 18632 2 1109 . 1 1 104 104 PHE CA C 13 56.997 0.061 . 1 . . 1518 . . 92 PHE CA . 18632 2 1110 . 1 1 104 104 PHE CB C 13 41.758 0.044 . 1 . . 1517 . . 92 PHE CB . 18632 2 1111 . 1 1 104 104 PHE CD1 C 13 130.755 0.074 . 3 . . 1010 . . 92 PHE CD1 . 18632 2 1112 . 1 1 104 104 PHE CD2 C 13 130.755 0.074 . 3 . . 1010 . . 92 PHE CD2 . 18632 2 1113 . 1 1 104 104 PHE N N 15 132.886 0.005 . 1 . . 87 . . 92 PHE N . 18632 2 1114 . 1 1 105 105 ASP H H 1 9.182 0.006 . 1 . . 198 . . 93 ASP H . 18632 2 1115 . 1 1 105 105 ASP HA H 1 4.869 0.002 . 1 . . 512 . . 93 ASP HA . 18632 2 1116 . 1 1 105 105 ASP HB2 H 1 2.460 0.004 . 2 . . 511 . . 93 ASP HB2 . 18632 2 1117 . 1 1 105 105 ASP HB3 H 1 2.265 0.003 . 2 . . 510 . . 93 ASP HB3 . 18632 2 1118 . 1 1 105 105 ASP CA C 13 53.193 0.005 . 1 . . 1516 . . 93 ASP CA . 18632 2 1119 . 1 1 105 105 ASP CB C 13 44.660 0.041 . 1 . . 1515 . . 93 ASP CB . 18632 2 1120 . 1 1 105 105 ASP N N 15 121.700 0.005 . 1 . . 199 . . 93 ASP N . 18632 2 1121 . 1 1 106 106 LEU H H 1 9.033 0.007 . 1 . . 200 . . 94 LEU H . 18632 2 1122 . 1 1 106 106 LEU HA H 1 5.112 0.008 . 1 . . 513 . . 94 LEU HA . 18632 2 1123 . 1 1 106 106 LEU HB2 H 1 1.239 0.003 . 2 . . 514 . . 94 LEU HB2 . 18632 2 1124 . 1 1 106 106 LEU HB3 H 1 1.692 0.001 . 2 . . 515 . . 94 LEU HB3 . 18632 2 1125 . 1 1 106 106 LEU HG H 1 1.505 0.004 . 1 . . 785 . . 94 LEU HG . 18632 2 1126 . 1 1 106 106 LEU HD11 H 1 0.839 0.003 . 2 . . 1145 . . 94 LEU HD11 . 18632 2 1127 . 1 1 106 106 LEU HD12 H 1 0.839 0.003 . 2 . . 1145 . . 94 LEU HD12 . 18632 2 1128 . 1 1 106 106 LEU HD13 H 1 0.839 0.003 . 2 . . 1145 . . 94 LEU HD13 . 18632 2 1129 . 1 1 106 106 LEU HD21 H 1 0.795 0.004 . 2 . . 1146 . . 94 LEU HD21 . 18632 2 1130 . 1 1 106 106 LEU HD22 H 1 0.795 0.004 . 2 . . 1146 . . 94 LEU HD22 . 18632 2 1131 . 1 1 106 106 LEU HD23 H 1 0.795 0.004 . 2 . . 1146 . . 94 LEU HD23 . 18632 2 1132 . 1 1 106 106 LEU CA C 13 53.016 0.039 . 1 . . 1514 . . 94 LEU CA . 18632 2 1133 . 1 1 106 106 LEU CB C 13 43.119 0.055 . 1 . . 1513 . . 94 LEU CB . 18632 2 1134 . 1 1 106 106 LEU CG C 13 26.765 0.007 . 1 . . 1142 . . 94 LEU CG . 18632 2 1135 . 1 1 106 106 LEU CD1 C 13 25.573 0.049 . 2 . . 1144 . . 94 LEU CD1 . 18632 2 1136 . 1 1 106 106 LEU CD2 C 13 24.488 0.044 . 2 . . 1143 . . 94 LEU CD2 . 18632 2 1137 . 1 1 106 106 LEU N N 15 122.149 0.005 . 1 . . 201 . . 94 LEU N . 18632 2 1138 . 1 1 107 107 LYS H H 1 8.372 0.001 . 1 . . 219 . . 95 LYS H . 18632 2 1139 . 1 1 107 107 LYS HA H 1 4.083 0.003 . 1 . . 516 . . 95 LYS HA . 18632 2 1140 . 1 1 107 107 LYS HB2 H 1 1.797 0.003 . 2 . . 518 . . 95 LYS HB2 . 18632 2 1141 . 1 1 107 107 LYS HB3 H 1 1.544 0.006 . 2 . . 517 . . 95 LYS HB3 . 18632 2 1142 . 1 1 107 107 LYS HG2 H 1 1.441 0.001 . 2 . . 787 . . 95 LYS HG2 . 18632 2 1143 . 1 1 107 107 LYS HG3 H 1 1.353 0.003 . 2 . . 786 . . 95 LYS HG3 . 18632 2 1144 . 1 1 107 107 LYS HD2 H 1 1.537 0.001 . 1 . . 1027 . . 95 LYS HD2 . 18632 2 1145 . 1 1 107 107 LYS HD3 H 1 1.537 0.001 . 1 . . 1029 . . 95 LYS HD3 . 18632 2 1146 . 1 1 107 107 LYS HE2 H 1 2.909 0.001 . 1 . . 789 . . 95 LYS HE2 . 18632 2 1147 . 1 1 107 107 LYS HE3 H 1 2.909 0.001 . 1 . . 788 . . 95 LYS HE3 . 18632 2 1148 . 1 1 107 107 LYS CA C 13 58.457 0.052 . 1 . . 1509 . . 95 LYS CA . 18632 2 1149 . 1 1 107 107 LYS CB C 13 34.150 0.061 . 1 . . 1510 . . 95 LYS CB . 18632 2 1150 . 1 1 107 107 LYS CG C 13 24.853 0.019 . 1 . . 790 . . 95 LYS CG . 18632 2 1151 . 1 1 107 107 LYS CD C 13 29.607 0.02 . 1 . . 1028 . . 95 LYS CD . 18632 2 1152 . 1 1 107 107 LYS CE C 13 41.857 0.033 . 1 . . 1195 . . 95 LYS CE . 18632 2 1153 . 1 1 107 107 LYS N N 15 128.104 0.005 . 1 . . 220 . . 95 LYS N . 18632 2 1154 . 1 1 108 108 ASP H H 1 8.436 0.001 . 1 . . 202 . . 96 ASP H . 18632 2 1155 . 1 1 108 108 ASP HA H 1 4.570 0.006 . 1 . . 853 . . 96 ASP HA . 18632 2 1156 . 1 1 108 108 ASP HB2 H 1 3.094 0.003 . 2 . . 855 . . 96 ASP HB2 . 18632 2 1157 . 1 1 108 108 ASP HB3 H 1 2.936 0.001 . 2 . . 854 . . 96 ASP HB3 . 18632 2 1158 . 1 1 108 108 ASP CA C 13 52.500 0.005 . 1 . . 1511 . . 96 ASP CA . 18632 2 1159 . 1 1 108 108 ASP CB C 13 40.059 0.027 . 1 . . 1512 . . 96 ASP CB . 18632 2 1160 . 1 1 108 108 ASP N N 15 115.798 0.005 . 1 . . 203 . . 96 ASP N . 18632 2 1161 . 1 1 109 109 PRO HA H 1 4.314 0.004 . 1 . . 519 . . 97 PRO HA . 18632 2 1162 . 1 1 109 109 PRO HB2 H 1 2.512 0.009 . 2 . . 521 . . 97 PRO HB2 . 18632 2 1163 . 1 1 109 109 PRO HB3 H 1 1.723 0.004 . 2 . . 520 . . 97 PRO HB3 . 18632 2 1164 . 1 1 109 109 PRO HG2 H 1 1.924 0.007 . 2 . . 980 . . 97 PRO HG2 . 18632 2 1165 . 1 1 109 109 PRO HG3 H 1 2.087 0.003 . 2 . . 981 . . 97 PRO HG3 . 18632 2 1166 . 1 1 109 109 PRO HD2 H 1 3.605 0.004 . 2 . . 1071 . . 97 PRO HD2 . 18632 2 1167 . 1 1 109 109 PRO HD3 H 1 3.805 0.002 . 2 . . 1073 . . 97 PRO HD3 . 18632 2 1168 . 1 1 109 109 PRO CA C 13 65.671 0.064 . 1 . . 1562 . . 97 PRO CA . 18632 2 1169 . 1 1 109 109 PRO CB C 13 32.369 0.004 . 1 . . 1561 . . 97 PRO CB . 18632 2 1170 . 1 1 109 109 PRO CG C 13 27.954 0.047 . 1 . . 982 . . 97 PRO CG . 18632 2 1171 . 1 1 109 109 PRO CD C 13 50.820 0.017 . 1 . . 1072 . . 97 PRO CD . 18632 2 1172 . 1 1 110 110 ASN H H 1 8.316 0.008 . 1 . . 35 . . 98 ASN H . 18632 2 1173 . 1 1 110 110 ASN HA H 1 5.025 0.007 . 1 . . 522 . . 98 ASN HA . 18632 2 1174 . 1 1 110 110 ASN HB2 H 1 3.013 0.004 . 2 . . 524 . . 98 ASN HB2 . 18632 2 1175 . 1 1 110 110 ASN HB3 H 1 2.700 0.003 . 2 . . 523 . . 98 ASN HB3 . 18632 2 1176 . 1 1 110 110 ASN HD21 H 1 7.796 0.001 . 1 . . 9 . . 98 ASN HD21 . 18632 2 1177 . 1 1 110 110 ASN HD22 H 1 7.080 0.001 . 1 . . 1063 . . 98 ASN HD22 . 18632 2 1178 . 1 1 110 110 ASN CA C 13 52.257 0.005 . 1 . . 1380 . . 98 ASN CA . 18632 2 1179 . 1 1 110 110 ASN CB C 13 41.746 0.032 . 1 . . 1381 . . 98 ASN CB . 18632 2 1180 . 1 1 110 110 ASN N N 15 110.374 0.005 . 1 . . 36 . . 98 ASN N . 18632 2 1181 . 1 1 110 110 ASN ND2 N 15 115.261 0.002 . 1 . . 8 . . 98 ASN ND2 . 18632 2 1182 . 1 1 111 111 THR H H 1 7.864 0.012 . 1 . . 47 . . 99 THR H . 18632 2 1183 . 1 1 111 111 THR HA H 1 5.135 0.001 . 1 . . 525 . . 99 THR HA . 18632 2 1184 . 1 1 111 111 THR HB H 1 3.814 0.004 . 1 . . 526 . . 99 THR HB . 18632 2 1185 . 1 1 111 111 THR HG21 H 1 1.006 0.001 . 1 . . 791 . . 99 THR HG21 . 18632 2 1186 . 1 1 111 111 THR HG22 H 1 1.006 0.001 . 1 . . 791 . . 99 THR HG22 . 18632 2 1187 . 1 1 111 111 THR HG23 H 1 1.006 0.001 . 1 . . 791 . . 99 THR HG23 . 18632 2 1188 . 1 1 111 111 THR CA C 13 62.721 0.034 . 1 . . 1382 . . 99 THR CA . 18632 2 1189 . 1 1 111 111 THR CB C 13 70.130 0.021 . 1 . . 1383 . . 99 THR CB . 18632 2 1190 . 1 1 111 111 THR CG2 C 13 20.669 0.027 . 1 . . 792 . . 99 THR CG2 . 18632 2 1191 . 1 1 111 111 THR N N 15 118.416 0.005 . 1 . . 48 . . 99 THR N . 18632 2 1192 . 1 1 112 112 LEU H H 1 8.585 0.007 . 1 . . 228 . . 100 LEU H . 18632 2 1193 . 1 1 112 112 LEU HA H 1 4.911 0.007 . 1 . . 527 . . 100 LEU HA . 18632 2 1194 . 1 1 112 112 LEU HB2 H 1 1.208 0.007 . 2 . . 529 . . 100 LEU HB2 . 18632 2 1195 . 1 1 112 112 LEU HB3 H 1 -0.068 0.001 . 2 . . 528 . . 100 LEU HB3 . 18632 2 1196 . 1 1 112 112 LEU HG H 1 1.321 0.003 . 1 . . 1141 . . 100 LEU HG . 18632 2 1197 . 1 1 112 112 LEU HD11 H 1 -0.034 0.002 . 2 . . 1137 . . 100 LEU HD11 . 18632 2 1198 . 1 1 112 112 LEU HD12 H 1 -0.034 0.002 . 2 . . 1137 . . 100 LEU HD12 . 18632 2 1199 . 1 1 112 112 LEU HD13 H 1 -0.034 0.002 . 2 . . 1137 . . 100 LEU HD13 . 18632 2 1200 . 1 1 112 112 LEU HD21 H 1 0.629 0.003 . 2 . . 1136 . . 100 LEU HD21 . 18632 2 1201 . 1 1 112 112 LEU HD22 H 1 0.629 0.003 . 2 . . 1136 . . 100 LEU HD22 . 18632 2 1202 . 1 1 112 112 LEU HD23 H 1 0.629 0.003 . 2 . . 1136 . . 100 LEU HD23 . 18632 2 1203 . 1 1 112 112 LEU CA C 13 53.185 0.013 . 1 . . 1379 . . 100 LEU CA . 18632 2 1204 . 1 1 112 112 LEU CB C 13 44.547 0.036 . 1 . . 1378 . . 100 LEU CB . 18632 2 1205 . 1 1 112 112 LEU CG C 13 26.969 0.078 . 1 . . 1140 . . 100 LEU CG . 18632 2 1206 . 1 1 112 112 LEU CD1 C 13 26.328 0.042 . 2 . . 1138 . . 100 LEU CD1 . 18632 2 1207 . 1 1 112 112 LEU CD2 C 13 23.676 0.017 . 2 . . 1139 . . 100 LEU CD2 . 18632 2 1208 . 1 1 112 112 LEU N N 15 132.325 0.005 . 1 . . 229 . . 100 LEU N . 18632 2 1209 . 1 1 113 113 THR H H 1 9.873 0.001 . 1 . . 27 . . 101 THR H . 18632 2 1210 . 1 1 113 113 THR HA H 1 5.538 0.006 . 1 . . 530 . . 101 THR HA . 18632 2 1211 . 1 1 113 113 THR HB H 1 4.111 0.002 . 1 . . 531 . . 101 THR HB . 18632 2 1212 . 1 1 113 113 THR HG21 H 1 1.087 0.003 . 1 . . 793 . . 101 THR HG21 . 18632 2 1213 . 1 1 113 113 THR HG22 H 1 1.087 0.003 . 1 . . 793 . . 101 THR HG22 . 18632 2 1214 . 1 1 113 113 THR HG23 H 1 1.087 0.003 . 1 . . 793 . . 101 THR HG23 . 18632 2 1215 . 1 1 113 113 THR CA C 13 59.285 0.027 . 1 . . 1377 . . 101 THR CA . 18632 2 1216 . 1 1 113 113 THR CB C 13 70.734 0.032 . 1 . . 1376 . . 101 THR CB . 18632 2 1217 . 1 1 113 113 THR CG2 C 13 22.266 0.033 . 1 . . 794 . . 101 THR CG2 . 18632 2 1218 . 1 1 113 113 THR N N 15 117.489 0.005 . 1 . . 28 . . 101 THR N . 18632 2 1219 . 1 1 114 114 GLU H H 1 8.725 0.004 . 1 . . 240 . . 102 GLU H . 18632 2 1220 . 1 1 114 114 GLU HA H 1 4.306 0.003 . 1 . . 534 . . 102 GLU HA . 18632 2 1221 . 1 1 114 114 GLU HB2 H 1 2.100 0.001 . 1 . . 535 . . 102 GLU HB2 . 18632 2 1222 . 1 1 114 114 GLU HB3 H 1 2.100 0.001 . 1 . . 536 . . 102 GLU HB3 . 18632 2 1223 . 1 1 114 114 GLU CA C 13 54.373 0.038 . 1 . . 1443 . . 102 GLU CA . 18632 2 1224 . 1 1 114 114 GLU CB C 13 34.339 0.017 . 1 . . 1442 . . 102 GLU CB . 18632 2 1225 . 1 1 114 114 GLU N N 15 124.900 0.005 . 1 . . 241 . . 102 GLU N . 18632 2 1226 . 1 1 115 115 THR H H 1 8.750 0.011 . 1 . . 215 . . 103 THR H . 18632 2 1227 . 1 1 115 115 THR HA H 1 4.907 0.004 . 1 . . 537 . . 103 THR HA . 18632 2 1228 . 1 1 115 115 THR HB H 1 3.658 0.004 . 1 . . 538 . . 103 THR HB . 18632 2 1229 . 1 1 115 115 THR HG21 H 1 0.947 0.001 . 1 . . 634 . . 103 THR HG21 . 18632 2 1230 . 1 1 115 115 THR HG22 H 1 0.947 0.001 . 1 . . 634 . . 103 THR HG22 . 18632 2 1231 . 1 1 115 115 THR HG23 H 1 0.947 0.001 . 1 . . 634 . . 103 THR HG23 . 18632 2 1232 . 1 1 115 115 THR CA C 13 62.739 0.005 . 1 . . 1441 . . 103 THR CA . 18632 2 1233 . 1 1 115 115 THR CB C 13 70.232 0.023 . 1 . . 1440 . . 103 THR CB . 18632 2 1234 . 1 1 115 115 THR CG2 C 13 20.924 0.026 . 1 . . 635 . . 103 THR CG2 . 18632 2 1235 . 1 1 115 115 THR N N 15 125.037 0.005 . 1 . . 216 . . 103 THR N . 18632 2 1236 . 1 1 116 116 HIS H H 1 9.423 0.008 . 1 . . 125 . . 104 HIS H . 18632 2 1237 . 1 1 116 116 HIS HA H 1 4.567 0.001 . 1 . . 539 . . 104 HIS HA . 18632 2 1238 . 1 1 116 116 HIS HB2 H 1 2.748 0.009 . 1 . . 541 . . 104 HIS HB2 . 18632 2 1239 . 1 1 116 116 HIS HB3 H 1 2.748 0.009 . 1 . . 540 . . 104 HIS HB3 . 18632 2 1240 . 1 1 116 116 HIS HD2 H 1 6.141 0.001 . 1 . . 989 . . 104 HIS HD2 . 18632 2 1241 . 1 1 116 116 HIS CA C 13 55.189 0.005 . 1 . . 1438 . . 104 HIS CA . 18632 2 1242 . 1 1 116 116 HIS CB C 13 31.612 0.015 . 1 . . 1439 . . 104 HIS CB . 18632 2 1243 . 1 1 116 116 HIS CD2 C 13 117.658 0.013 . 1 . . 1006 . . 104 HIS CD2 . 18632 2 1244 . 1 1 116 116 HIS N N 15 124.525 0.005 . 1 . . 126 . . 104 HIS N . 18632 2 1245 . 1 1 117 117 ILE H H 1 9.106 0.006 . 1 . . 1436 . . 105 ILE H . 18632 2 1246 . 1 1 117 117 ILE HA H 1 4.849 0.001 . 1 . . 543 . . 105 ILE HA . 18632 2 1247 . 1 1 117 117 ILE HB H 1 1.585 0.001 . 1 . . 542 . . 105 ILE HB . 18632 2 1248 . 1 1 117 117 ILE HG12 H 1 1.373 0.001 . 2 . . 633 . . 105 ILE HG12 . 18632 2 1249 . 1 1 117 117 ILE HG13 H 1 1.001 0.01 . 2 . . 632 . . 105 ILE HG13 . 18632 2 1250 . 1 1 117 117 ILE HG21 H 1 0.809 0.002 . 1 . . 627 . . 105 ILE HG21 . 18632 2 1251 . 1 1 117 117 ILE HG22 H 1 0.809 0.002 . 1 . . 627 . . 105 ILE HG22 . 18632 2 1252 . 1 1 117 117 ILE HG23 H 1 0.809 0.002 . 1 . . 627 . . 105 ILE HG23 . 18632 2 1253 . 1 1 117 117 ILE HD11 H 1 0.792 0.001 . 1 . . 630 . . 105 ILE HD11 . 18632 2 1254 . 1 1 117 117 ILE HD12 H 1 0.792 0.001 . 1 . . 630 . . 105 ILE HD12 . 18632 2 1255 . 1 1 117 117 ILE HD13 H 1 0.792 0.001 . 1 . . 630 . . 105 ILE HD13 . 18632 2 1256 . 1 1 117 117 ILE CA C 13 60.204 0.005 . 1 . . 1435 . . 105 ILE CA . 18632 2 1257 . 1 1 117 117 ILE CB C 13 40.970 0.045 . 1 . . 1434 . . 105 ILE CB . 18632 2 1258 . 1 1 117 117 ILE CG1 C 13 27.533 0.062 . 1 . . 631 . . 105 ILE CG1 . 18632 2 1259 . 1 1 117 117 ILE CG2 C 13 16.627 0.013 . 1 . . 628 . . 105 ILE CG2 . 18632 2 1260 . 1 1 117 117 ILE CD1 C 13 13.825 0.01 . 1 . . 629 . . 105 ILE CD1 . 18632 2 1261 . 1 1 117 117 ILE N N 15 125.480 0.005 . 1 . . 1437 . . 105 ILE N . 18632 2 1262 . 1 1 118 118 LYS H H 1 7.510 0.007 . 1 . . 226 . . 106 LYS H . 18632 2 1263 . 1 1 118 118 LYS HA H 1 3.832 0.003 . 1 . . 544 . . 106 LYS HA . 18632 2 1264 . 1 1 118 118 LYS HB2 H 1 1.793 0.001 . 2 . . 545 . . 106 LYS HB2 . 18632 2 1265 . 1 1 118 118 LYS HB3 H 1 2.029 0.004 . 2 . . 546 . . 106 LYS HB3 . 18632 2 1266 . 1 1 118 118 LYS HG2 H 1 1.332 0.001 . 2 . . 1124 . . 106 LYS HG2 . 18632 2 1267 . 1 1 118 118 LYS HG3 H 1 0.702 0.006 . 2 . . 1122 . . 106 LYS HG3 . 18632 2 1268 . 1 1 118 118 LYS HD2 H 1 1.604 0.001 . 2 . . 1127 . . 106 LYS HD2 . 18632 2 1269 . 1 1 118 118 LYS HD3 H 1 1.406 0.001 . 2 . . 1126 . . 106 LYS HD3 . 18632 2 1270 . 1 1 118 118 LYS HE2 H 1 2.716 0.004 . 2 . . 1125 . . 106 LYS HE2 . 18632 2 1271 . 1 1 118 118 LYS HE3 H 1 2.845 0.001 . 2 . . 1128 . . 106 LYS HE3 . 18632 2 1272 . 1 1 118 118 LYS CA C 13 58.561 0.036 . 1 . . 1432 . . 106 LYS CA . 18632 2 1273 . 1 1 118 118 LYS CB C 13 31.652 0.042 . 1 . . 1433 . . 106 LYS CB . 18632 2 1274 . 1 1 118 118 LYS CG C 13 25.906 0.047 . 1 . . 1120 . . 106 LYS CG . 18632 2 1275 . 1 1 118 118 LYS CD C 13 29.381 0.014 . 1 . . 1121 . . 106 LYS CD . 18632 2 1276 . 1 1 118 118 LYS CE C 13 42.484 0.04 . 1 . . 1123 . . 106 LYS CE . 18632 2 1277 . 1 1 118 118 LYS N N 15 127.208 0.005 . 1 . . 227 . . 106 LYS N . 18632 2 1278 . 1 1 119 119 VAL H H 1 7.934 0.006 . 1 . . 82 . . 107 VAL H . 18632 2 1279 . 1 1 119 119 VAL HA H 1 3.486 0.004 . 1 . . 547 . . 107 VAL HA . 18632 2 1280 . 1 1 119 119 VAL HB H 1 1.941 0.002 . 1 . . 548 . . 107 VAL HB . 18632 2 1281 . 1 1 119 119 VAL HG11 H 1 0.856 0.001 . 2 . . 637 . . 107 VAL HG11 . 18632 2 1282 . 1 1 119 119 VAL HG12 H 1 0.856 0.001 . 2 . . 637 . . 107 VAL HG12 . 18632 2 1283 . 1 1 119 119 VAL HG13 H 1 0.856 0.001 . 2 . . 637 . . 107 VAL HG13 . 18632 2 1284 . 1 1 119 119 VAL HG21 H 1 0.780 0.001 . 2 . . 636 . . 107 VAL HG21 . 18632 2 1285 . 1 1 119 119 VAL HG22 H 1 0.780 0.001 . 2 . . 636 . . 107 VAL HG22 . 18632 2 1286 . 1 1 119 119 VAL HG23 H 1 0.780 0.001 . 2 . . 636 . . 107 VAL HG23 . 18632 2 1287 . 1 1 119 119 VAL CA C 13 66.495 0.049 . 1 . . 1430 . . 107 VAL CA . 18632 2 1288 . 1 1 119 119 VAL CB C 13 31.308 0.005 . 1 . . 1431 . . 107 VAL CB . 18632 2 1289 . 1 1 119 119 VAL CG1 C 13 20.875 0.005 . 2 . . 639 . . 107 VAL CG1 . 18632 2 1290 . 1 1 119 119 VAL CG2 C 13 23.852 0.022 . 2 . . 638 . . 107 VAL CG2 . 18632 2 1291 . 1 1 119 119 VAL N N 15 125.826 0.005 . 1 . . 83 . . 107 VAL N . 18632 2 1292 . 1 1 120 120 ASP H H 1 8.818 0.006 . 1 . . 173 . . 108 ASP H . 18632 2 1293 . 1 1 120 120 ASP HA H 1 4.495 0.003 . 1 . . 858 . . 108 ASP HA . 18632 2 1294 . 1 1 120 120 ASP HB2 H 1 2.777 0.001 . 2 . . 857 . . 108 ASP HB2 . 18632 2 1295 . 1 1 120 120 ASP HB3 H 1 2.512 0.001 . 2 . . 856 . . 108 ASP HB3 . 18632 2 1296 . 1 1 120 120 ASP CA C 13 55.171 0.019 . 1 . . 1427 . . 108 ASP CA . 18632 2 1297 . 1 1 120 120 ASP CB C 13 40.907 0.011 . 1 . . 1429 . . 108 ASP CB . 18632 2 1298 . 1 1 120 120 ASP N N 15 115.395 0.005 . 1 . . 174 . . 108 ASP N . 18632 2 1299 . 1 1 121 121 ASP H H 1 6.715 0.001 . 1 . . 163 . . 109 ASP H . 18632 2 1300 . 1 1 121 121 ASP HA H 1 4.808 0.002 . 1 . . 931 . . 109 ASP HA . 18632 2 1301 . 1 1 121 121 ASP HB2 H 1 2.598 0.003 . 2 . . 930 . . 109 ASP HB2 . 18632 2 1302 . 1 1 121 121 ASP HB3 H 1 2.700 0.001 . 2 . . 932 . . 109 ASP HB3 . 18632 2 1303 . 1 1 121 121 ASP CA C 13 51.820 0.035 . 1 . . 1426 . . 109 ASP CA . 18632 2 1304 . 1 1 121 121 ASP CB C 13 40.680 0.072 . 1 . . 1428 . . 109 ASP CB . 18632 2 1305 . 1 1 121 121 ASP N N 15 112.572 0.005 . 1 . . 164 . . 109 ASP N . 18632 2 1306 . 1 1 122 122 PRO HA H 1 4.500 0.002 . 1 . . 549 . . 110 PRO HA . 18632 2 1307 . 1 1 122 122 PRO HB2 H 1 2.219 0.001 . 2 . . 551 . . 110 PRO HB2 . 18632 2 1308 . 1 1 122 122 PRO HB3 H 1 1.940 0.002 . 2 . . 550 . . 110 PRO HB3 . 18632 2 1309 . 1 1 122 122 PRO HG2 H 1 2.006 0.004 . 2 . . 944 . . 110 PRO HG2 . 18632 2 1310 . 1 1 122 122 PRO HG3 H 1 1.931 0.003 . 2 . . 940 . . 110 PRO HG3 . 18632 2 1311 . 1 1 122 122 PRO HD2 H 1 3.795 0.001 . 2 . . 942 . . 110 PRO HD2 . 18632 2 1312 . 1 1 122 122 PRO HD3 H 1 3.492 0.001 . 2 . . 941 . . 110 PRO HD3 . 18632 2 1313 . 1 1 122 122 PRO CA C 13 63.918 0.031 . 1 . . 1425 . . 110 PRO CA . 18632 2 1314 . 1 1 122 122 PRO CB C 13 31.677 0.065 . 1 . . 1424 . . 110 PRO CB . 18632 2 1315 . 1 1 122 122 PRO CG C 13 27.014 0.024 . 1 . . 943 . . 110 PRO CG . 18632 2 1316 . 1 1 122 122 PRO CD C 13 50.312 0.069 . 1 . . 945 . . 110 PRO CD . 18632 2 1317 . 1 1 123 123 THR H H 1 7.583 0.009 . 1 . . 62 . . 111 THR H . 18632 2 1318 . 1 1 123 123 THR HA H 1 4.314 0.003 . 1 . . 552 . . 111 THR HA . 18632 2 1319 . 1 1 123 123 THR HB H 1 4.348 0.001 . 1 . . 796 . . 111 THR HB . 18632 2 1320 . 1 1 123 123 THR HG21 H 1 1.213 0.001 . 1 . . 795 . . 111 THR HG21 . 18632 2 1321 . 1 1 123 123 THR HG22 H 1 1.213 0.001 . 1 . . 795 . . 111 THR HG22 . 18632 2 1322 . 1 1 123 123 THR HG23 H 1 1.213 0.001 . 1 . . 795 . . 111 THR HG23 . 18632 2 1323 . 1 1 123 123 THR CA C 13 62.638 0.008 . 1 . . 1423 . . 111 THR CA . 18632 2 1324 . 1 1 123 123 THR CB C 13 69.093 0.024 . 1 . . 1422 . . 111 THR CB . 18632 2 1325 . 1 1 123 123 THR CG2 C 13 21.748 0.003 . 1 . . 797 . . 111 THR CG2 . 18632 2 1326 . 1 1 123 123 THR N N 15 107.034 0.005 . 1 . . 63 . . 111 THR N . 18632 2 1327 . 1 1 124 124 ASP H H 1 8.463 0.003 . 1 . . 64 . . 112 ASP H . 18632 2 1328 . 1 1 124 124 ASP HA H 1 4.670 0.001 . 1 . . 553 . . 112 ASP HA . 18632 2 1329 . 1 1 124 124 ASP HB2 H 1 2.275 0.003 . 2 . . 554 . . 112 ASP HB2 . 18632 2 1330 . 1 1 124 124 ASP HB3 H 1 3.232 0.004 . 2 . . 555 . . 112 ASP HB3 . 18632 2 1331 . 1 1 124 124 ASP CA C 13 54.475 0.005 . 1 . . 1421 . . 112 ASP CA . 18632 2 1332 . 1 1 124 124 ASP CB C 13 41.127 0.078 . 1 . . 1420 . . 112 ASP CB . 18632 2 1333 . 1 1 124 124 ASP N N 15 127.109 0.005 . 1 . . 65 . . 112 ASP N . 18632 2 1334 . 1 1 125 125 VAL H H 1 7.178 0.001 . 1 . . 208 . . 113 VAL H . 18632 2 1335 . 1 1 125 125 VAL HA H 1 4.899 0.001 . 1 . . 556 . . 113 VAL HA . 18632 2 1336 . 1 1 125 125 VAL HB H 1 1.890 0.004 . 1 . . 557 . . 113 VAL HB . 18632 2 1337 . 1 1 125 125 VAL HG11 H 1 0.861 0.003 . 2 . . 641 . . 113 VAL HG11 . 18632 2 1338 . 1 1 125 125 VAL HG12 H 1 0.861 0.003 . 2 . . 641 . . 113 VAL HG12 . 18632 2 1339 . 1 1 125 125 VAL HG13 H 1 0.861 0.003 . 2 . . 641 . . 113 VAL HG13 . 18632 2 1340 . 1 1 125 125 VAL HG21 H 1 0.786 0.003 . 2 . . 640 . . 113 VAL HG21 . 18632 2 1341 . 1 1 125 125 VAL HG22 H 1 0.786 0.003 . 2 . . 640 . . 113 VAL HG22 . 18632 2 1342 . 1 1 125 125 VAL HG23 H 1 0.786 0.003 . 2 . . 640 . . 113 VAL HG23 . 18632 2 1343 . 1 1 125 125 VAL CA C 13 60.074 0.003 . 1 . . 1419 . . 113 VAL CA . 18632 2 1344 . 1 1 125 125 VAL CB C 13 34.661 0.028 . 1 . . 1418 . . 113 VAL CB . 18632 2 1345 . 1 1 125 125 VAL CG1 C 13 20.945 0.01 . 2 . . 642 . . 113 VAL CG1 . 18632 2 1346 . 1 1 125 125 VAL CG2 C 13 20.109 0.02 . 2 . . 643 . . 113 VAL CG2 . 18632 2 1347 . 1 1 125 125 VAL N N 15 123.584 0.005 . 1 . . 209 . . 113 VAL N . 18632 2 1348 . 1 1 126 126 GLU H H 1 8.746 0.001 . 1 . . 131 . . 114 GLU H . 18632 2 1349 . 1 1 126 126 GLU HA H 1 4.875 0.001 . 1 . . 558 . . 114 GLU HA . 18632 2 1350 . 1 1 126 126 GLU HB2 H 1 1.816 0.001 . 2 . . 559 . . 114 GLU HB2 . 18632 2 1351 . 1 1 126 126 GLU HB3 H 1 1.995 0.006 . 2 . . 560 . . 114 GLU HB3 . 18632 2 1352 . 1 1 126 126 GLU HG2 H 1 2.847 0.003 . 2 . . 964 . . 114 GLU HG2 . 18632 2 1353 . 1 1 126 126 GLU HG3 H 1 2.257 0.004 . 2 . . 966 . . 114 GLU HG3 . 18632 2 1354 . 1 1 126 126 GLU CA C 13 55.782 0.028 . 1 . . 1417 . . 114 GLU CA . 18632 2 1355 . 1 1 126 126 GLU CB C 13 33.684 0.062 . 1 . . 1416 . . 114 GLU CB . 18632 2 1356 . 1 1 126 126 GLU CG C 13 36.878 0.045 . 1 . . 965 . . 114 GLU CG . 18632 2 1357 . 1 1 126 126 GLU N N 15 127.367 0.005 . 1 . . 132 . . 114 GLU N . 18632 2 1358 . 1 1 127 127 THR H H 1 8.925 0.006 . 1 . . 119 . . 115 THR H . 18632 2 1359 . 1 1 127 127 THR HA H 1 4.879 0.001 . 1 . . 561 . . 115 THR HA . 18632 2 1360 . 1 1 127 127 THR HB H 1 3.825 0.002 . 1 . . 562 . . 115 THR HB . 18632 2 1361 . 1 1 127 127 THR HG21 H 1 1.129 0.003 . 1 . . 798 . . 115 THR HG21 . 18632 2 1362 . 1 1 127 127 THR HG22 H 1 1.129 0.003 . 1 . . 798 . . 115 THR HG22 . 18632 2 1363 . 1 1 127 127 THR HG23 H 1 1.129 0.003 . 1 . . 798 . . 115 THR HG23 . 18632 2 1364 . 1 1 127 127 THR CA C 13 62.122 0.006 . 1 . . 1415 . . 115 THR CA . 18632 2 1365 . 1 1 127 127 THR CB C 13 71.357 0.017 . 1 . . 1414 . . 115 THR CB . 18632 2 1366 . 1 1 127 127 THR CG2 C 13 22.789 0.015 . 1 . . 799 . . 115 THR CG2 . 18632 2 1367 . 1 1 127 127 THR N N 15 122.880 0.005 . 1 . . 120 . . 115 THR N . 18632 2 1368 . 1 1 128 128 TYR H H 1 9.144 0.008 . 1 . . 147 . . 116 TYR H . 18632 2 1369 . 1 1 128 128 TYR HA H 1 5.263 0.001 . 1 . . 372 . . 116 TYR HA . 18632 2 1370 . 1 1 128 128 TYR HB2 H 1 2.794 0.001 . 1 . . 371 . . 116 TYR HB2 . 18632 2 1371 . 1 1 128 128 TYR HB3 H 1 2.794 0.001 . 1 . . 1657 . . 116 TYR HB3 . 18632 2 1372 . 1 1 128 128 TYR HD1 H 1 6.949 0.002 . 3 . . 1055 . . 116 TYR HD1 . 18632 2 1373 . 1 1 128 128 TYR HD2 H 1 6.949 0.002 . 3 . . 1055 . . 116 TYR HD2 . 18632 2 1374 . 1 1 128 128 TYR HE1 H 1 6.373 0.003 . 3 . . 1042 . . 116 TYR HE1 . 18632 2 1375 . 1 1 128 128 TYR HE2 H 1 6.373 0.003 . 3 . . 1042 . . 116 TYR HE2 . 18632 2 1376 . 1 1 128 128 TYR CA C 13 52.826 0.012 . 1 . . 1412 . . 116 TYR CA . 18632 2 1377 . 1 1 128 128 TYR CB C 13 39.048 0.046 . 1 . . 1413 . . 116 TYR CB . 18632 2 1378 . 1 1 128 128 TYR CD1 C 13 131.937 0.025 . 3 . . 1056 . . 116 TYR CD1 . 18632 2 1379 . 1 1 128 128 TYR CD2 C 13 131.937 0.025 . 3 . . 1056 . . 116 TYR CD2 . 18632 2 1380 . 1 1 128 128 TYR CE1 C 13 117.517 0.098 . 3 . . 1043 . . 116 TYR CE1 . 18632 2 1381 . 1 1 128 128 TYR CE2 C 13 117.517 0.098 . 3 . . 1043 . . 116 TYR CE2 . 18632 2 1382 . 1 1 128 128 TYR N N 15 130.625 0.005 . 1 . . 148 . . 116 TYR N . 18632 2 1383 . 1 1 129 129 GLU H H 1 8.378 0.001 . 1 . . 1410 . . 117 GLU H . 18632 2 1384 . 1 1 129 129 GLU HA H 1 5.056 0.023 . 1 . . 563 . . 117 GLU HA . 18632 2 1385 . 1 1 129 129 GLU HB2 H 1 1.886 0.001 . 2 . . 565 . . 117 GLU HB2 . 18632 2 1386 . 1 1 129 129 GLU HB3 H 1 1.756 0.001 . 2 . . 564 . . 117 GLU HB3 . 18632 2 1387 . 1 1 129 129 GLU HG2 H 1 2.258 0.001 . 1 . . 801 . . 117 GLU HG2 . 18632 2 1388 . 1 1 129 129 GLU HG3 H 1 2.258 0.001 . 1 . . 800 . . 117 GLU HG3 . 18632 2 1389 . 1 1 129 129 GLU CA C 13 54.828 0.005 . 1 . . 1408 . . 117 GLU CA . 18632 2 1390 . 1 1 129 129 GLU CB C 13 33.535 0.005 . 1 . . 1409 . . 117 GLU CB . 18632 2 1391 . 1 1 129 129 GLU CG C 13 36.565 0.017 . 1 . . 802 . . 117 GLU CG . 18632 2 1392 . 1 1 129 129 GLU N N 15 119.493 0.005 . 1 . . 1411 . . 117 GLU N . 18632 2 1393 . 1 1 130 130 TYR H H 1 10.021 0.01 . 1 . . 39 . . 118 TYR H . 18632 2 1394 . 1 1 130 130 TYR HA H 1 5.747 0.006 . 1 . . 566 . . 118 TYR HA . 18632 2 1395 . 1 1 130 130 TYR HB2 H 1 2.895 0.001 . 2 . . 568 . . 118 TYR HB2 . 18632 2 1396 . 1 1 130 130 TYR HB3 H 1 2.666 0.002 . 2 . . 567 . . 118 TYR HB3 . 18632 2 1397 . 1 1 130 130 TYR HD1 H 1 6.774 0.003 . 3 . . 985 . . 118 TYR HD1 . 18632 2 1398 . 1 1 130 130 TYR HD2 H 1 6.774 0.003 . 3 . . 985 . . 118 TYR HD2 . 18632 2 1399 . 1 1 130 130 TYR HE1 H 1 7.101 0.004 . 3 . . 1018 . . 118 TYR HE1 . 18632 2 1400 . 1 1 130 130 TYR HE2 H 1 7.101 0.004 . 3 . . 1018 . . 118 TYR HE2 . 18632 2 1401 . 1 1 130 130 TYR HH H 1 10.289 0.003 . 1 . . 1289 . . 118 TYR HH . 18632 2 1402 . 1 1 130 130 TYR CA C 13 56.921 0.043 . 1 . . 1407 . . 118 TYR CA . 18632 2 1403 . 1 1 130 130 TYR CB C 13 41.224 0.038 . 1 . . 1406 . . 118 TYR CB . 18632 2 1404 . 1 1 130 130 TYR CD1 C 13 132.321 0.061 . 3 . . 1017 . . 118 TYR CD1 . 18632 2 1405 . 1 1 130 130 TYR CD2 C 13 132.321 0.061 . 3 . . 1017 . . 118 TYR CD2 . 18632 2 1406 . 1 1 130 130 TYR CE1 C 13 117.513 0.055 . 3 . . 1019 . . 118 TYR CE1 . 18632 2 1407 . 1 1 130 130 TYR CE2 C 13 117.513 0.055 . 3 . . 1019 . . 118 TYR CE2 . 18632 2 1408 . 1 1 130 130 TYR N N 15 122.137 0.005 . 1 . . 40 . . 118 TYR N . 18632 2 1409 . 1 1 131 131 ARG H H 1 8.859 0.004 . 1 . . 1404 . . 119 ARG H . 18632 2 1410 . 1 1 131 131 ARG HA H 1 5.173 0.001 . 1 . . 569 . . 119 ARG HA . 18632 2 1411 . 1 1 131 131 ARG HB2 H 1 1.679 0.006 . 2 . . 570 . . 119 ARG HB2 . 18632 2 1412 . 1 1 131 131 ARG HB3 H 1 1.942 0.001 . 2 . . 571 . . 119 ARG HB3 . 18632 2 1413 . 1 1 131 131 ARG HG2 H 1 1.973 0.001 . 2 . . 804 . . 119 ARG HG2 . 18632 2 1414 . 1 1 131 131 ARG HG3 H 1 1.525 0.003 . 2 . . 803 . . 119 ARG HG3 . 18632 2 1415 . 1 1 131 131 ARG HD2 H 1 3.065 0.003 . 2 . . 805 . . 119 ARG HD2 . 18632 2 1416 . 1 1 131 131 ARG HD3 H 1 3.135 0.004 . 2 . . 806 . . 119 ARG HD3 . 18632 2 1417 . 1 1 131 131 ARG CA C 13 54.366 0.005 . 1 . . 1401 . . 119 ARG CA . 18632 2 1418 . 1 1 131 131 ARG CB C 13 35.159 0.068 . 1 . . 1400 . . 119 ARG CB . 18632 2 1419 . 1 1 131 131 ARG CG C 13 27.849 0.054 . 1 . . 808 . . 119 ARG CG . 18632 2 1420 . 1 1 131 131 ARG CD C 13 43.449 0.054 . 1 . . 807 . . 119 ARG CD . 18632 2 1421 . 1 1 131 131 ARG N N 15 118.112 0.005 . 1 . . 1405 . . 119 ARG N . 18632 2 1422 . 1 1 132 132 ARG H H 1 9.443 0.001 . 1 . . 68 . . 120 ARG H . 18632 2 1423 . 1 1 132 132 ARG HA H 1 5.169 0.011 . 1 . . 572 . . 120 ARG HA . 18632 2 1424 . 1 1 132 132 ARG HB2 H 1 1.711 0.001 . 2 . . 574 . . 120 ARG HB2 . 18632 2 1425 . 1 1 132 132 ARG HB3 H 1 1.378 0.004 . 2 . . 573 . . 120 ARG HB3 . 18632 2 1426 . 1 1 132 132 ARG HG2 H 1 0.858 0.001 . 2 . . 962 . . 120 ARG HG2 . 18632 2 1427 . 1 1 132 132 ARG HG3 H 1 1.080 0.001 . 2 . . 1264 . . 120 ARG HG3 . 18632 2 1428 . 1 1 132 132 ARG HD2 H 1 3.149 0.001 . 2 . . 1262 . . 120 ARG HD2 . 18632 2 1429 . 1 1 132 132 ARG HD3 H 1 3.021 0.008 . 2 . . 1263 . . 120 ARG HD3 . 18632 2 1430 . 1 1 132 132 ARG HE H 1 6.629 0.001 . 1 . . 1617 . . 120 ARG HE . 18632 2 1431 . 1 1 132 132 ARG CA C 13 52.605 0.037 . 1 . . 1396 . . 120 ARG CA . 18632 2 1432 . 1 1 132 132 ARG CB C 13 29.721 0.034 . 1 . . 1397 . . 120 ARG CB . 18632 2 1433 . 1 1 132 132 ARG CG C 13 26.170 0.119 . 1 . . 963 . . 120 ARG CG . 18632 2 1434 . 1 1 132 132 ARG CD C 13 40.525 0.019 . 1 . . 1261 . . 120 ARG CD . 18632 2 1435 . 1 1 132 132 ARG N N 15 120.893 0.005 . 1 . . 69 . . 120 ARG N . 18632 2 1436 . 1 1 132 132 ARG NE N 15 79.736 0.005 . 1 . . 1618 . . 120 ARG NE . 18632 2 1437 . 1 1 133 133 ASP H H 1 8.587 0.001 . 1 . . 236 . . 121 ASP H . 18632 2 1438 . 1 1 133 133 ASP HA H 1 4.805 0.001 . 1 . . 862 . . 121 ASP HA . 18632 2 1439 . 1 1 133 133 ASP HB2 H 1 2.415 0.003 . 2 . . 864 . . 121 ASP HB2 . 18632 2 1440 . 1 1 133 133 ASP HB3 H 1 2.804 0.002 . 2 . . 863 . . 121 ASP HB3 . 18632 2 1441 . 1 1 133 133 ASP CA C 13 53.456 0.001 . 1 . . 1399 . . 121 ASP CA . 18632 2 1442 . 1 1 133 133 ASP CB C 13 43.143 0.025 . 1 . . 1398 . . 121 ASP CB . 18632 2 1443 . 1 1 133 133 ASP N N 15 124.287 0.005 . 1 . . 237 . . 121 ASP N . 18632 2 1444 . 1 1 134 134 GLY H H 1 9.006 0.001 . 1 . . 1614 . . 122 GLY H . 18632 2 1445 . 1 1 134 134 GLY HA2 H 1 3.808 0.001 . 2 . . 1070 . . 122 GLY HA2 . 18632 2 1446 . 1 1 134 134 GLY HA3 H 1 4.143 0.003 . 2 . . 1069 . . 122 GLY HA3 . 18632 2 1447 . 1 1 134 134 GLY CA C 13 47.053 0.016 . 1 . . 1629 . . 122 GLY CA . 18632 2 1448 . 1 1 134 134 GLY N N 15 116.081 0.005 . 1 . . 1615 . . 122 GLY N . 18632 2 1449 . 1 1 135 135 ASP HA H 1 4.674 0.001 . 1 . . 588 . . 123 ASP HA . 18632 2 1450 . 1 1 135 135 ASP HB2 H 1 2.959 0.001 . 2 . . 576 . . 123 ASP HB2 . 18632 2 1451 . 1 1 135 135 ASP HB3 H 1 2.267 0.002 . 2 . . 575 . . 123 ASP HB3 . 18632 2 1452 . 1 1 135 135 ASP CA C 13 55.397 0.01 . 1 . . 1392 . . 123 ASP CA . 18632 2 1453 . 1 1 135 135 ASP CB C 13 40.846 0.019 . 1 . . 1393 . . 123 ASP CB . 18632 2 1454 . 1 1 136 136 TYR H H 1 8.381 0.007 . 1 . . 60 . . 124 TYR H . 18632 2 1455 . 1 1 136 136 TYR HA H 1 5.407 0.001 . 1 . . 577 . . 124 TYR HA . 18632 2 1456 . 1 1 136 136 TYR HB2 H 1 2.880 0.006 . 2 . . 578 . . 124 TYR HB2 . 18632 2 1457 . 1 1 136 136 TYR HB3 H 1 3.287 0.001 . 2 . . 579 . . 124 TYR HB3 . 18632 2 1458 . 1 1 136 136 TYR HD1 H 1 7.137 0.003 . 3 . . 986 . . 124 TYR HD1 . 18632 2 1459 . 1 1 136 136 TYR HD2 H 1 7.137 0.003 . 3 . . 986 . . 124 TYR HD2 . 18632 2 1460 . 1 1 136 136 TYR HE1 H 1 6.864 0.004 . 3 . . 1020 . . 124 TYR HE1 . 18632 2 1461 . 1 1 136 136 TYR HE2 H 1 6.864 0.004 . 3 . . 1020 . . 124 TYR HE2 . 18632 2 1462 . 1 1 136 136 TYR CA C 13 58.104 0.068 . 1 . . 1390 . . 124 TYR CA . 18632 2 1463 . 1 1 136 136 TYR CB C 13 40.670 0.048 . 1 . . 1391 . . 124 TYR CB . 18632 2 1464 . 1 1 136 136 TYR CD1 C 13 133.129 0.044 . 3 . . 1022 . . 124 TYR CD1 . 18632 2 1465 . 1 1 136 136 TYR CD2 C 13 133.129 0.044 . 3 . . 1022 . . 124 TYR CD2 . 18632 2 1466 . 1 1 136 136 TYR CE1 C 13 117.964 0.105 . 3 . . 1021 . . 124 TYR CE1 . 18632 2 1467 . 1 1 136 136 TYR CE2 C 13 117.964 0.105 . 3 . . 1021 . . 124 TYR CE2 . 18632 2 1468 . 1 1 136 136 TYR N N 15 115.114 0.005 . 1 . . 61 . . 124 TYR N . 18632 2 1469 . 1 1 137 137 LEU H H 1 10.018 0.007 . 1 . . 180 . . 125 LEU H . 18632 2 1470 . 1 1 137 137 LEU HA H 1 4.765 0.002 . 1 . . 580 . . 125 LEU HA . 18632 2 1471 . 1 1 137 137 LEU HB2 H 1 0.419 0.003 . 2 . . 581 . . 125 LEU HB2 . 18632 2 1472 . 1 1 137 137 LEU HB3 H 1 1.694 0.006 . 2 . . 582 . . 125 LEU HB3 . 18632 2 1473 . 1 1 137 137 LEU HG H 1 1.301 0.002 . 1 . . 809 . . 125 LEU HG . 18632 2 1474 . 1 1 137 137 LEU HD11 H 1 0.233 0.006 . 2 . . 810 . . 125 LEU HD11 . 18632 2 1475 . 1 1 137 137 LEU HD12 H 1 0.233 0.006 . 2 . . 810 . . 125 LEU HD12 . 18632 2 1476 . 1 1 137 137 LEU HD13 H 1 0.233 0.006 . 2 . . 810 . . 125 LEU HD13 . 18632 2 1477 . 1 1 137 137 LEU HD21 H 1 0.497 0.003 . 2 . . 811 . . 125 LEU HD21 . 18632 2 1478 . 1 1 137 137 LEU HD22 H 1 0.497 0.003 . 2 . . 811 . . 125 LEU HD22 . 18632 2 1479 . 1 1 137 137 LEU HD23 H 1 0.497 0.003 . 2 . . 811 . . 125 LEU HD23 . 18632 2 1480 . 1 1 137 137 LEU CA C 13 54.349 0.012 . 1 . . 1389 . . 125 LEU CA . 18632 2 1481 . 1 1 137 137 LEU CB C 13 44.804 0.045 . 1 . . 1388 . . 125 LEU CB . 18632 2 1482 . 1 1 137 137 LEU CG C 13 26.781 0.016 . 1 . . 814 . . 125 LEU CG . 18632 2 1483 . 1 1 137 137 LEU CD1 C 13 25.498 0.059 . 2 . . 813 . . 125 LEU CD1 . 18632 2 1484 . 1 1 137 137 LEU CD2 C 13 23.560 0.029 . 2 . . 812 . . 125 LEU CD2 . 18632 2 1485 . 1 1 137 137 LEU N N 15 127.756 0.005 . 1 . . 181 . . 125 LEU N . 18632 2 1486 . 1 1 138 138 VAL H H 1 9.732 0.007 . 1 . . 37 . . 126 VAL H . 18632 2 1487 . 1 1 138 138 VAL HA H 1 4.775 0.009 . 1 . . 583 . . 126 VAL HA . 18632 2 1488 . 1 1 138 138 VAL HB H 1 1.863 0.003 . 1 . . 584 . . 126 VAL HB . 18632 2 1489 . 1 1 138 138 VAL HG11 H 1 0.826 0.002 . 2 . . 645 . . 126 VAL HG11 . 18632 2 1490 . 1 1 138 138 VAL HG12 H 1 0.826 0.002 . 2 . . 645 . . 126 VAL HG12 . 18632 2 1491 . 1 1 138 138 VAL HG13 H 1 0.826 0.002 . 2 . . 645 . . 126 VAL HG13 . 18632 2 1492 . 1 1 138 138 VAL HG21 H 1 0.315 0.003 . 2 . . 644 . . 126 VAL HG21 . 18632 2 1493 . 1 1 138 138 VAL HG22 H 1 0.315 0.003 . 2 . . 644 . . 126 VAL HG22 . 18632 2 1494 . 1 1 138 138 VAL HG23 H 1 0.315 0.003 . 2 . . 644 . . 126 VAL HG23 . 18632 2 1495 . 1 1 138 138 VAL CA C 13 61.165 0.005 . 1 . . 1385 . . 126 VAL CA . 18632 2 1496 . 1 1 138 138 VAL CB C 13 33.114 0.024 . 1 . . 1384 . . 126 VAL CB . 18632 2 1497 . 1 1 138 138 VAL CG1 C 13 21.709 0.015 . 2 . . 647 . . 126 VAL CG1 . 18632 2 1498 . 1 1 138 138 VAL CG2 C 13 20.450 0.026 . 2 . . 646 . . 126 VAL CG2 . 18632 2 1499 . 1 1 138 138 VAL N N 15 129.474 0.005 . 1 . . 38 . . 126 VAL N . 18632 2 1500 . 1 1 139 139 MET H H 1 9.426 0.01 . 1 . . 111 . . 127 MET H . 18632 2 1501 . 1 1 139 139 MET HA H 1 5.228 0.007 . 1 . . 585 . . 127 MET HA . 18632 2 1502 . 1 1 139 139 MET HB2 H 1 1.544 0.004 . 2 . . 586 . . 127 MET HB2 . 18632 2 1503 . 1 1 139 139 MET HB3 H 1 2.054 0.006 . 2 . . 587 . . 127 MET HB3 . 18632 2 1504 . 1 1 139 139 MET HG2 H 1 1.027 0.007 . 2 . . 959 . . 127 MET HG2 . 18632 2 1505 . 1 1 139 139 MET HG3 H 1 1.644 0.008 . 2 . . 960 . . 127 MET HG3 . 18632 2 1506 . 1 1 139 139 MET CA C 13 53.426 0.019 . 1 . . 1387 . . 127 MET CA . 18632 2 1507 . 1 1 139 139 MET CB C 13 37.014 0.054 . 1 . . 1386 . . 127 MET CB . 18632 2 1508 . 1 1 139 139 MET CG C 13 32.391 0.045 . 1 . . 961 . . 127 MET CG . 18632 2 1509 . 1 1 139 139 MET N N 15 129.988 0.005 . 1 . . 112 . . 127 MET N . 18632 2 1510 . 1 1 140 140 LYS H H 1 9.495 0.006 . 1 . . 157 . . 128 LYS H . 18632 2 1511 . 1 1 140 140 LYS HA H 1 5.433 0.006 . 1 . . 589 . . 128 LYS HA . 18632 2 1512 . 1 1 140 140 LYS HB2 H 1 1.610 0.006 . 2 . . 815 . . 128 LYS HB2 . 18632 2 1513 . 1 1 140 140 LYS HB3 H 1 1.695 0.006 . 2 . . 590 . . 128 LYS HB3 . 18632 2 1514 . 1 1 140 140 LYS HG2 H 1 1.428 0.001 . 2 . . 817 . . 128 LYS HG2 . 18632 2 1515 . 1 1 140 140 LYS HG3 H 1 1.204 0.006 . 2 . . 816 . . 128 LYS HG3 . 18632 2 1516 . 1 1 140 140 LYS HD2 H 1 1.540 0.001 . 1 . . 820 . . 128 LYS HD2 . 18632 2 1517 . 1 1 140 140 LYS HD3 H 1 1.540 0.001 . 1 . . 821 . . 128 LYS HD3 . 18632 2 1518 . 1 1 140 140 LYS HE2 H 1 2.813 0.001 . 1 . . 818 . . 128 LYS HE2 . 18632 2 1519 . 1 1 140 140 LYS HE3 H 1 2.813 0.001 . 1 . . 819 . . 128 LYS HE3 . 18632 2 1520 . 1 1 140 140 LYS CA C 13 54.557 0.029 . 1 . . 1583 . . 128 LYS CA . 18632 2 1521 . 1 1 140 140 LYS CB C 13 35.743 0.056 . 1 . . 1582 . . 128 LYS CB . 18632 2 1522 . 1 1 140 140 LYS CG C 13 24.944 0.041 . 1 . . 822 . . 128 LYS CG . 18632 2 1523 . 1 1 140 140 LYS CD C 13 29.698 0.047 . 1 . . 823 . . 128 LYS CD . 18632 2 1524 . 1 1 140 140 LYS N N 15 128.812 0.005 . 1 . . 158 . . 128 LYS N . 18632 2 1525 . 1 1 141 141 MET H H 1 8.428 0.01 . 1 . . 19 . . 129 MET H . 18632 2 1526 . 1 1 141 141 MET HA H 1 5.108 0.001 . 1 . . 591 . . 129 MET HA . 18632 2 1527 . 1 1 141 141 MET HB2 H 1 1.956 0.006 . 2 . . 592 . . 129 MET HB2 . 18632 2 1528 . 1 1 141 141 MET HB3 H 1 0.946 0.008 . 2 . . 824 . . 129 MET HB3 . 18632 2 1529 . 1 1 141 141 MET HG2 H 1 1.700 0.006 . 2 . . 825 . . 129 MET HG2 . 18632 2 1530 . 1 1 141 141 MET HG3 H 1 1.852 0.006 . 2 . . 826 . . 129 MET HG3 . 18632 2 1531 . 1 1 141 141 MET CA C 13 53.846 0.062 . 1 . . 1580 . . 129 MET CA . 18632 2 1532 . 1 1 141 141 MET CB C 13 35.608 0.038 . 1 . . 1581 . . 129 MET CB . 18632 2 1533 . 1 1 141 141 MET CG C 13 32.007 0.033 . 1 . . 827 . . 129 MET CG . 18632 2 1534 . 1 1 141 141 MET N N 15 124.542 0.005 . 1 . . 20 . . 129 MET N . 18632 2 1535 . 1 1 142 142 SER H H 1 10.182 0.01 . 1 . . 127 . . 130 SER H . 18632 2 1536 . 1 1 142 142 SER HA H 1 5.712 0.003 . 1 . . 593 . . 130 SER HA . 18632 2 1537 . 1 1 142 142 SER HB2 H 1 3.651 0.002 . 2 . . 594 . . 130 SER HB2 . 18632 2 1538 . 1 1 142 142 SER HB3 H 1 3.759 0.002 . 2 . . 595 . . 130 SER HB3 . 18632 2 1539 . 1 1 142 142 SER CA C 13 57.518 0.024 . 1 . . 1578 . . 130 SER CA . 18632 2 1540 . 1 1 142 142 SER CB C 13 65.704 0.038 . 1 . . 1579 . . 130 SER CB . 18632 2 1541 . 1 1 142 142 SER N N 15 117.225 0.005 . 1 . . 128 . . 130 SER N . 18632 2 1542 . 1 1 143 143 TRP H H 1 9.173 0.012 . 1 . . 204 . . 131 TRP H . 18632 2 1543 . 1 1 143 143 TRP HA H 1 4.959 0.001 . 1 . . 596 . . 131 TRP HA . 18632 2 1544 . 1 1 143 143 TRP HB2 H 1 2.815 0.013 . 2 . . 597 . . 131 TRP HB2 . 18632 2 1545 . 1 1 143 143 TRP HB3 H 1 3.378 0.004 . 2 . . 598 . . 131 TRP HB3 . 18632 2 1546 . 1 1 143 143 TRP HD1 H 1 6.539 0.001 . 1 . . 993 . . 131 TRP HD1 . 18632 2 1547 . 1 1 143 143 TRP HE1 H 1 10.072 0.001 . 1 . . 117 . . 131 TRP HE1 . 18632 2 1548 . 1 1 143 143 TRP HE3 H 1 7.988 0.003 . 1 . . 1049 . . 131 TRP HE3 . 18632 2 1549 . 1 1 143 143 TRP HZ2 H 1 7.414 0.001 . 1 . . 994 . . 131 TRP HZ2 . 18632 2 1550 . 1 1 143 143 TRP HZ3 H 1 7.337 0.003 . 1 . . 1040 . . 131 TRP HZ3 . 18632 2 1551 . 1 1 143 143 TRP HH2 H 1 7.215 0.003 . 1 . . 999 . . 131 TRP HH2 . 18632 2 1552 . 1 1 143 143 TRP CA C 13 56.985 0.044 . 1 . . 1576 . . 131 TRP CA . 18632 2 1553 . 1 1 143 143 TRP CB C 13 33.499 0.057 . 1 . . 1577 . . 131 TRP CB . 18632 2 1554 . 1 1 143 143 TRP CD1 C 13 125.479 0.07 . 1 . . 1002 . . 131 TRP CD1 . 18632 2 1555 . 1 1 143 143 TRP CE3 C 13 120.905 0.062 . 1 . . 1050 . . 131 TRP CE3 . 18632 2 1556 . 1 1 143 143 TRP CZ2 C 13 114.698 0.016 . 1 . . 996 . . 131 TRP CZ2 . 18632 2 1557 . 1 1 143 143 TRP CZ3 C 13 122.794 0.083 . 1 . . 1041 . . 131 TRP CZ3 . 18632 2 1558 . 1 1 143 143 TRP CH2 C 13 126.113 0.032 . 1 . . 1000 . . 131 TRP CH2 . 18632 2 1559 . 1 1 143 143 TRP N N 15 126.630 0.005 . 1 . . 205 . . 131 TRP N . 18632 2 1560 . 1 1 143 143 TRP NE1 N 15 127.403 0.005 . 1 . . 118 . . 131 TRP NE1 . 18632 2 1561 . 1 1 144 144 LYS H H 1 8.499 0.007 . 1 . . 217 . . 132 LYS H . 18632 2 1562 . 1 1 144 144 LYS HA H 1 3.461 0.004 . 1 . . 599 . . 132 LYS HA . 18632 2 1563 . 1 1 144 144 LYS HB2 H 1 1.821 0.003 . 2 . . 601 . . 132 LYS HB2 . 18632 2 1564 . 1 1 144 144 LYS HB3 H 1 1.569 0.001 . 2 . . 600 . . 132 LYS HB3 . 18632 2 1565 . 1 1 144 144 LYS HG2 H 1 0.612 0.002 . 1 . . 831 . . 132 LYS HG2 . 18632 2 1566 . 1 1 144 144 LYS HG3 H 1 0.612 0.002 . 1 . . 830 . . 132 LYS HG3 . 18632 2 1567 . 1 1 144 144 LYS HD2 H 1 1.493 0.001 . 1 . . 828 . . 132 LYS HD2 . 18632 2 1568 . 1 1 144 144 LYS HD3 H 1 1.493 0.001 . 1 . . 829 . . 132 LYS HD3 . 18632 2 1569 . 1 1 144 144 LYS HE2 H 1 2.749 0.002 . 2 . . 832 . . 132 LYS HE2 . 18632 2 1570 . 1 1 144 144 LYS HE3 H 1 2.859 0.002 . 2 . . 833 . . 132 LYS HE3 . 18632 2 1571 . 1 1 144 144 LYS CA C 13 57.037 0.017 . 1 . . 1575 . . 132 LYS CA . 18632 2 1572 . 1 1 144 144 LYS CB C 13 30.149 0.025 . 1 . . 1574 . . 132 LYS CB . 18632 2 1573 . 1 1 144 144 LYS CG C 13 25.010 0.024 . 1 . . 834 . . 132 LYS CG . 18632 2 1574 . 1 1 144 144 LYS CD C 13 29.166 0.005 . 1 . . 836 . . 132 LYS CD . 18632 2 1575 . 1 1 144 144 LYS CE C 13 42.372 0.021 . 1 . . 835 . . 132 LYS CE . 18632 2 1576 . 1 1 144 144 LYS N N 15 123.260 0.005 . 1 . . 218 . . 132 LYS N . 18632 2 1577 . 1 1 145 145 GLY H H 1 8.529 0.001 . 1 . . 161 . . 133 GLY H . 18632 2 1578 . 1 1 145 145 GLY HA2 H 1 3.504 0.004 . 2 . . 532 . . 133 GLY HA2 . 18632 2 1579 . 1 1 145 145 GLY HA3 H 1 4.110 0.004 . 2 . . 533 . . 133 GLY HA3 . 18632 2 1580 . 1 1 145 145 GLY CA C 13 45.234 0.044 . 1 . . 1573 . . 133 GLY CA . 18632 2 1581 . 1 1 145 145 GLY N N 15 103.590 0.005 . 1 . . 162 . . 133 GLY N . 18632 2 1582 . 1 1 146 146 VAL H H 1 8.168 0.003 . 1 . . 54 . . 134 VAL H . 18632 2 1583 . 1 1 146 146 VAL HA H 1 4.199 0.002 . 1 . . 898 . . 134 VAL HA . 18632 2 1584 . 1 1 146 146 VAL HB H 1 2.329 0.002 . 1 . . 899 . . 134 VAL HB . 18632 2 1585 . 1 1 146 146 VAL HG11 H 1 0.911 0.004 . 2 . . 1065 . . 134 VAL HG11 . 18632 2 1586 . 1 1 146 146 VAL HG12 H 1 0.911 0.004 . 2 . . 1065 . . 134 VAL HG12 . 18632 2 1587 . 1 1 146 146 VAL HG13 H 1 0.911 0.004 . 2 . . 1065 . . 134 VAL HG13 . 18632 2 1588 . 1 1 146 146 VAL HG21 H 1 0.947 0.003 . 2 . . 1067 . . 134 VAL HG21 . 18632 2 1589 . 1 1 146 146 VAL HG22 H 1 0.947 0.003 . 2 . . 1067 . . 134 VAL HG22 . 18632 2 1590 . 1 1 146 146 VAL HG23 H 1 0.947 0.003 . 2 . . 1067 . . 134 VAL HG23 . 18632 2 1591 . 1 1 146 146 VAL CA C 13 62.621 0.026 . 1 . . 1571 . . 134 VAL CA . 18632 2 1592 . 1 1 146 146 VAL CB C 13 32.555 0.027 . 1 . . 1572 . . 134 VAL CB . 18632 2 1593 . 1 1 146 146 VAL CG1 C 13 21.358 0.018 . 2 . . 1066 . . 134 VAL CG1 . 18632 2 1594 . 1 1 146 146 VAL CG2 C 13 21.107 0.026 . 2 . . 1068 . . 134 VAL CG2 . 18632 2 1595 . 1 1 146 146 VAL N N 15 124.658 0.005 . 1 . . 55 . . 134 VAL N . 18632 2 1596 . 1 1 147 147 SER H H 1 8.692 0.003 . 1 . . 254 . . 135 SER H . 18632 2 1597 . 1 1 147 147 SER HA H 1 5.894 0.002 . 1 . . 602 . . 135 SER HA . 18632 2 1598 . 1 1 147 147 SER HB2 H 1 3.808 0.001 . 2 . . 604 . . 135 SER HB2 . 18632 2 1599 . 1 1 147 147 SER HB3 H 1 3.756 0.002 . 2 . . 603 . . 135 SER HB3 . 18632 2 1600 . 1 1 147 147 SER CA C 13 56.753 0.052 . 1 . . 1569 . . 135 SER CA . 18632 2 1601 . 1 1 147 147 SER CB C 13 66.074 0.052 . 1 . . 1570 . . 135 SER CB . 18632 2 1602 . 1 1 147 147 SER N N 15 120.829 0.005 . 1 . . 255 . . 135 SER N . 18632 2 1603 . 1 1 148 148 THR H H 1 9.023 0.007 . 1 . . 115 . . 136 THR H . 18632 2 1604 . 1 1 148 148 THR HA H 1 5.090 0.002 . 1 . . 605 . . 136 THR HA . 18632 2 1605 . 1 1 148 148 THR HB H 1 4.142 0.004 . 1 . . 606 . . 136 THR HB . 18632 2 1606 . 1 1 148 148 THR HG1 H 1 4.394 0.001 . 1 . . 1628 . . 136 THR HG1 . 18632 2 1607 . 1 1 148 148 THR HG21 H 1 0.767 0.002 . 1 . . 837 . . 136 THR HG21 . 18632 2 1608 . 1 1 148 148 THR HG22 H 1 0.767 0.002 . 1 . . 837 . . 136 THR HG22 . 18632 2 1609 . 1 1 148 148 THR HG23 H 1 0.767 0.002 . 1 . . 837 . . 136 THR HG23 . 18632 2 1610 . 1 1 148 148 THR CA C 13 59.028 0.064 . 1 . . 1568 . . 136 THR CA . 18632 2 1611 . 1 1 148 148 THR CB C 13 70.551 0.029 . 1 . . 1567 . . 136 THR CB . 18632 2 1612 . 1 1 148 148 THR CG2 C 13 21.283 0.02 . 1 . . 838 . . 136 THR CG2 . 18632 2 1613 . 1 1 148 148 THR N N 15 119.106 0.005 . 1 . . 116 . . 136 THR N . 18632 2 1614 . 1 1 149 149 SER H H 1 7.415 0.007 . 1 . . 102 . . 137 SER H . 18632 2 1615 . 1 1 149 149 SER HA H 1 5.553 0.006 . 1 . . 860 . . 137 SER HA . 18632 2 1616 . 1 1 149 149 SER HB2 H 1 3.617 0.002 . 2 . . 861 . . 137 SER HB2 . 18632 2 1617 . 1 1 149 149 SER HB3 H 1 3.149 0.002 . 2 . . 859 . . 137 SER HB3 . 18632 2 1618 . 1 1 149 149 SER CA C 13 57.353 0.056 . 1 . . 1565 . . 137 SER CA . 18632 2 1619 . 1 1 149 149 SER CB C 13 66.373 0.024 . 1 . . 1566 . . 137 SER CB . 18632 2 1620 . 1 1 149 149 SER N N 15 120.238 0.005 . 1 . . 103 . . 137 SER N . 18632 2 1621 . 1 1 150 150 ARG H H 1 9.293 0.013 . 1 . . 1601 . . 138 ARG H . 18632 2 1622 . 1 1 150 150 ARG N N 15 121.982 0.005 . 1 . . 1602 . . 138 ARG N . 18632 2 1623 . 1 1 151 151 TYR HA H 1 4.749 0.001 . 1 . . 967 . . 139 TYR HA . 18632 2 1624 . 1 1 151 151 TYR HB2 H 1 2.816 0.002 . 2 . . 968 . . 139 TYR HB2 . 18632 2 1625 . 1 1 151 151 TYR HB3 H 1 2.498 0.003 . 2 . . 607 . . 139 TYR HB3 . 18632 2 1626 . 1 1 151 151 TYR HD1 H 1 6.530 0.003 . 3 . . 987 . . 139 TYR HD1 . 18632 2 1627 . 1 1 151 151 TYR HD2 H 1 6.530 0.003 . 3 . . 987 . . 139 TYR HD2 . 18632 2 1628 . 1 1 151 151 TYR HE1 H 1 6.475 0.002 . 3 . . 1015 . . 139 TYR HE1 . 18632 2 1629 . 1 1 151 151 TYR HE2 H 1 6.475 0.002 . 3 . . 1015 . . 139 TYR HE2 . 18632 2 1630 . 1 1 151 151 TYR CA C 13 58.352 0.004 . 1 . . 1563 . . 139 TYR CA . 18632 2 1631 . 1 1 151 151 TYR CB C 13 39.395 0.056 . 1 . . 1564 . . 139 TYR CB . 18632 2 1632 . 1 1 151 151 TYR CD1 C 13 132.627 0.032 . 3 . . 1011 . . 139 TYR CD1 . 18632 2 1633 . 1 1 151 151 TYR CD2 C 13 132.627 0.032 . 3 . . 1011 . . 139 TYR CD2 . 18632 2 1634 . 1 1 151 151 TYR CE1 C 13 118.211 0.038 . 3 . . 1016 . . 139 TYR CE1 . 18632 2 1635 . 1 1 151 151 TYR CE2 C 13 118.211 0.038 . 3 . . 1016 . . 139 TYR CE2 . 18632 2 1636 . 1 1 152 152 TYR H H 1 9.803 0.001 . 1 . . 88 . . 140 TYR H . 18632 2 1637 . 1 1 152 152 TYR HA H 1 5.138 0.004 . 1 . . 608 . . 140 TYR HA . 18632 2 1638 . 1 1 152 152 TYR HB2 H 1 2.635 0.003 . 2 . . 610 . . 140 TYR HB2 . 18632 2 1639 . 1 1 152 152 TYR HB3 H 1 3.468 0.004 . 2 . . 609 . . 140 TYR HB3 . 18632 2 1640 . 1 1 152 152 TYR HD1 H 1 7.126 0.004 . 3 . . 1153 . . 140 TYR HD1 . 18632 2 1641 . 1 1 152 152 TYR HD2 H 1 7.126 0.004 . 3 . . 1153 . . 140 TYR HD2 . 18632 2 1642 . 1 1 152 152 TYR HE1 H 1 6.528 0.004 . 3 . . 1154 . . 140 TYR HE1 . 18632 2 1643 . 1 1 152 152 TYR HE2 H 1 6.528 0.004 . 3 . . 1154 . . 140 TYR HE2 . 18632 2 1644 . 1 1 152 152 TYR CA C 13 55.662 0.003 . 1 . . 1560 . . 140 TYR CA . 18632 2 1645 . 1 1 152 152 TYR CB C 13 40.422 0.033 . 1 . . 1559 . . 140 TYR CB . 18632 2 1646 . 1 1 152 152 TYR CD1 C 13 133.121 0.049 . 3 . . 1152 . . 140 TYR CD1 . 18632 2 1647 . 1 1 152 152 TYR CD2 C 13 133.121 0.049 . 3 . . 1152 . . 140 TYR CD2 . 18632 2 1648 . 1 1 152 152 TYR CE1 C 13 118.714 0.029 . 3 . . 1155 . . 140 TYR CE1 . 18632 2 1649 . 1 1 152 152 TYR CE2 C 13 118.714 0.029 . 3 . . 1155 . . 140 TYR CE2 . 18632 2 1650 . 1 1 152 152 TYR N N 15 124.198 0.005 . 1 . . 89 . . 140 TYR N . 18632 2 1651 . 1 1 153 153 LYS H H 1 9.426 0.011 . 1 . . 196 . . 141 LYS H . 18632 2 1652 . 1 1 153 153 LYS HA H 1 4.125 0.001 . 1 . . 611 . . 141 LYS HA . 18632 2 1653 . 1 1 153 153 LYS HB2 H 1 1.944 0.003 . 2 . . 613 . . 141 LYS HB2 . 18632 2 1654 . 1 1 153 153 LYS HB3 H 1 1.708 0.002 . 2 . . 612 . . 141 LYS HB3 . 18632 2 1655 . 1 1 153 153 LYS HG2 H 1 0.822 0.003 . 2 . . 839 . . 141 LYS HG2 . 18632 2 1656 . 1 1 153 153 LYS HG3 H 1 1.511 0.001 . 2 . . 844 . . 141 LYS HG3 . 18632 2 1657 . 1 1 153 153 LYS HD2 H 1 1.466 0.001 . 2 . . 846 . . 141 LYS HD2 . 18632 2 1658 . 1 1 153 153 LYS HD3 H 1 1.545 0.003 . 2 . . 847 . . 141 LYS HD3 . 18632 2 1659 . 1 1 153 153 LYS HE2 H 1 2.915 0.002 . 1 . . 842 . . 141 LYS HE2 . 18632 2 1660 . 1 1 153 153 LYS HE3 H 1 2.915 0.002 . 1 . . 841 . . 141 LYS HE3 . 18632 2 1661 . 1 1 153 153 LYS CA C 13 56.137 0.038 . 1 . . 1558 . . 141 LYS CA . 18632 2 1662 . 1 1 153 153 LYS CB C 13 34.307 0.036 . 1 . . 1557 . . 141 LYS CB . 18632 2 1663 . 1 1 153 153 LYS CG C 13 24.647 0.062 . 1 . . 843 . . 141 LYS CG . 18632 2 1664 . 1 1 153 153 LYS CD C 13 28.346 0.051 . 1 . . 845 . . 141 LYS CD . 18632 2 1665 . 1 1 153 153 LYS CE C 13 42.392 0.029 . 1 . . 840 . . 141 LYS CE . 18632 2 1666 . 1 1 153 153 LYS N N 15 129.055 0.005 . 1 . . 197 . . 141 LYS N . 18632 2 1667 . 1 1 154 154 LYS H H 1 9.186 0.006 . 1 . . 188 . . 142 LYS H . 18632 2 1668 . 1 1 154 154 LYS HA H 1 4.208 0.002 . 1 . . 614 . . 142 LYS HA . 18632 2 1669 . 1 1 154 154 LYS HB2 H 1 1.588 0.002 . 2 . . 615 . . 142 LYS HB2 . 18632 2 1670 . 1 1 154 154 LYS HB3 H 1 1.830 0.002 . 2 . . 616 . . 142 LYS HB3 . 18632 2 1671 . 1 1 154 154 LYS HG2 H 1 0.761 0.004 . 1 . . 848 . . 142 LYS HG2 . 18632 2 1672 . 1 1 154 154 LYS HE2 H 1 3.019 0.001 . 2 . . 851 . . 142 LYS HE2 . 18632 2 1673 . 1 1 154 154 LYS HE3 H 1 2.943 0.001 . 2 . . 849 . . 142 LYS HE3 . 18632 2 1674 . 1 1 154 154 LYS CA C 13 58.638 0.037 . 1 . . 1556 . . 142 LYS CA . 18632 2 1675 . 1 1 154 154 LYS CB C 13 32.996 0.045 . 1 . . 1555 . . 142 LYS CB . 18632 2 1676 . 1 1 154 154 LYS CG C 13 24.992 0.075 . 1 . . 852 . . 142 LYS CG . 18632 2 1677 . 1 1 154 154 LYS CD C 13 29.171 0.005 . 1 . . 1129 . . 142 LYS CD . 18632 2 1678 . 1 1 154 154 LYS CE C 13 42.780 0.002 . 1 . . 850 . . 142 LYS CE . 18632 2 1679 . 1 1 154 154 LYS N N 15 133.290 0.005 . 1 . . 189 . . 142 LYS N . 18632 2 1680 . 1 1 155 155 GLN H H 1 8.656 0.008 . 1 . . 121 . . 143 GLN H . 18632 2 1681 . 1 1 155 155 GLN HA H 1 4.143 0.002 . 1 . . 874 . . 143 GLN HA . 18632 2 1682 . 1 1 155 155 GLN HB2 H 1 2.174 0.004 . 2 . . 879 . . 143 GLN HB2 . 18632 2 1683 . 1 1 155 155 GLN HB3 H 1 1.635 0.007 . 2 . . 876 . . 143 GLN HB3 . 18632 2 1684 . 1 1 155 155 GLN HG2 H 1 2.191 0.003 . 2 . . 878 . . 143 GLN HG2 . 18632 2 1685 . 1 1 155 155 GLN HG3 H 1 2.331 0.004 . 2 . . 875 . . 143 GLN HG3 . 18632 2 1686 . 1 1 155 155 GLN HE21 H 1 7.058 0.011 . 1 . . 18 . . 143 GLN HE21 . 18632 2 1687 . 1 1 155 155 GLN HE22 H 1 7.473 0.001 . 1 . . 17 . . 143 GLN HE22 . 18632 2 1688 . 1 1 155 155 GLN CA C 13 55.927 0.047 . 1 . . 1554 . . 143 GLN CA . 18632 2 1689 . 1 1 155 155 GLN CB C 13 31.146 0.022 . 1 . . 1553 . . 143 GLN CB . 18632 2 1690 . 1 1 155 155 GLN CG C 13 34.968 0.036 . 1 . . 877 . . 143 GLN CG . 18632 2 1691 . 1 1 155 155 GLN N N 15 132.198 0.005 . 1 . . 122 . . 143 GLN N . 18632 2 1692 . 1 1 155 155 GLN NE2 N 15 115.551 0.009 . 1 . . 16 . . 143 GLN NE2 . 18632 2 1693 . 2 2 1 1 OLA H9 H 1 5.167 0.012 . 1 . . 1283 . . 1 OLA H9 . 18632 2 1694 . 2 2 1 1 OLA H10 H 1 5.167 0.012 . 1 . . 1831 . . 1 OLA H10 . 18632 2 1695 . 2 2 1 1 OLA H21 H 1 1.838 0.001 . 1 . . 1625 . . 1 OLA H21 . 18632 2 1696 . 2 2 1 1 OLA H22 H 1 1.838 0.001 . 1 . . 1837 . . 1 OLA H22 . 18632 2 1697 . 2 2 1 1 OLA H81 H 1 1.832 0.001 . 1 . . 1833 . . 1 OLA H81 . 18632 2 1698 . 2 2 1 1 OLA H82 H 1 1.832 0.001 . 1 . . 1622 . . 1 OLA H82 . 18632 2 1699 . 2 2 1 1 OLA H111 H 1 1.838 0.001 . 1 . . 1623 . . 1 OLA H111 . 18632 2 1700 . 2 2 1 1 OLA H112 H 1 1.838 0.001 . 1 . . 1624 . . 1 OLA H112 . 18632 2 1701 . 2 2 1 1 OLA H161 H 1 0.910 0.001 . 1 . . 1287 . . 1 OLA H161 . 18632 2 1702 . 2 2 1 1 OLA H181 H 1 0.832 0.004 . 1 . . 1832 . . 1 OLA H181 . 18632 2 1703 . 2 2 1 1 OLA H182 H 1 0.832 0.004 . 1 . . 1832 . . 1 OLA H182 . 18632 2 1704 . 2 2 1 1 OLA H183 H 1 0.832 0.004 . 1 . . 1832 . . 1 OLA H183 . 18632 2 1705 . 2 2 1 1 OLA C2 C 13 41.008 0.005 . 1 . . 1838 . . 1 OLA C2 . 18632 2 1706 . 2 2 1 1 OLA C8 C 13 29.568 0.005 . 1 . . 1836 . . 1 OLA C8 . 18632 2 1707 . 2 2 1 1 OLA C10 C 13 133.713 0.005 . 1 . . 1835 . . 1 OLA C10 . 18632 2 1708 . 2 2 1 1 OLA C18 C 13 17.312 0.005 . 1 . . 1834 . . 1 OLA C18 . 18632 2 stop_ save_