################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34088 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details ; Shift list only containing H, N and CA shifts. This list is based on an hCANH experiment recorded in the same measurement session on the same magnet as the hNhhNH and hNHH experiments that were shift-matched to produce distance restraints. This was necessary because the heating by MAS results in small unwanted shift differences. ; _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D (H)N(HH)NH RFDR 2ms' . . . 34088 1 2 '3D (H)NHH RFDR 2ms' . . . 34088 1 3 '2D 13C-13C DARR 200ms' . . . 34088 1 4 '2D 13C-13C DARR 400ms' . . . 34088 1 5 '2D 13C-13C DARR 200ms' . . . 34088 1 6 '2D 13C-13C DARR 400ms' . . . 34088 1 7 '2D 13C-13C DARR 400ms' . . . 34088 1 8 '2D 13C-13C DARR 150ms' . . . 34088 1 9 '2D 13C-13C DARR 150ms' . . . 34088 1 10 '2D 13C-13C DARR 400ms' . . . 34088 1 11 '2D 13C-13C DARR 150ms' . . . 34088 1 12 '2D 13C-13C DARR 400ms' . . . 34088 1 13 '2D 13C-13C DARR 500ms' . . . 34088 1 14 '3D (H)CANH' . . . 34088 1 15 '3D (H)CANH' . . . 34088 1 16 '3D (HCO)CA(CO)NH' . . . 34088 1 17 '3D (HCA)CB(CA)NH' . . . 34088 1 18 '3D (HCA)CBCA(CO)NH' . . . 34088 1 19 '3D (H)CONH' . . . 34088 1 20 '3D (H)CO(CA)NH' . . . 34088 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 8 8 HIS H H 1 8.785 0.001 . 1 . . 1220 . A 8 HIS H . 34088 1 2 . 1 1 8 8 HIS CA C 13 55.183 . . 1 . . 168 . A 8 HIS CA . 34088 1 3 . 1 1 8 8 HIS N N 15 118.411 0.072 . 1 . . 1219 . A 8 HIS N . 34088 1 4 . 1 1 9 9 PHE H H 1 9.367 0.032 . 1 . . 860 . A 9 PHE H . 34088 1 5 . 1 1 9 9 PHE CA C 13 57.278 . . 1 . . 1204 . A 9 PHE CA . 34088 1 6 . 1 1 9 9 PHE N N 15 123.635 0.059 . 1 . . 1227 . A 9 PHE N . 34088 1 7 . 1 1 10 10 ASN H H 1 8.748 0.018 . 1 . . 1008 . A 10 ASN H . 34088 1 8 . 1 1 10 10 ASN N N 15 116.809 0.076 . 1 . . 1007 . A 10 ASN N . 34088 1 9 . 1 1 11 11 ILE H H 1 9.400 0.0 . 1 . . 1193 . A 11 ILE H . 34088 1 10 . 1 1 11 11 ILE N N 15 116.554 . . 1 . . 1192 . A 11 ILE N . 34088 1 11 . 1 1 12 12 GLY H H 1 7.836 0.009 . 1 . . 882 . A 12 GLY H . 34088 1 12 . 1 1 12 12 GLY CA C 13 47.107 . . 1 . . 725 . A 12 GLY CA . 34088 1 13 . 1 1 12 12 GLY N N 15 110.915 0.102 . 1 . . 604 . A 12 GLY N . 34088 1 14 . 1 1 13 13 ALA H H 1 8.535 0.013 . 1 . . 724 . A 13 ALA H . 34088 1 15 . 1 1 13 13 ALA CA C 13 51.178 . . 1 . . 261 . A 13 ALA CA . 34088 1 16 . 1 1 13 13 ALA N N 15 116.622 0.055 . 1 . . 262 . A 13 ALA N . 34088 1 17 . 1 1 14 14 MET H H 1 9.415 0.017 . 1 . . 1145 . A 14 MET H . 34088 1 18 . 1 1 14 14 MET CA C 13 55.292 . . 1 . . 1144 . A 14 MET CA . 34088 1 19 . 1 1 14 14 MET N N 15 119.948 0.132 . 1 . . 1168 . A 14 MET N . 34088 1 20 . 1 1 15 15 TYR H H 1 9.286 0.016 . 1 . . 859 . A 15 TYR H . 34088 1 21 . 1 1 15 15 TYR CA C 13 59.575 . . 1 . . 331 . A 15 TYR CA . 34088 1 22 . 1 1 15 15 TYR N N 15 122.119 0.043 . 1 . . 330 . A 15 TYR N . 34088 1 23 . 1 1 16 16 GLU H H 1 7.505 0.01 . 1 . . 1172 . A 16 GLU H . 34088 1 24 . 1 1 16 16 GLU CA C 13 54.287 . . 1 . . 1171 . A 16 GLU CA . 34088 1 25 . 1 1 16 16 GLU N N 15 125.840 0.077 . 1 . . 1170 . A 16 GLU N . 34088 1 26 . 1 1 32 32 GLU H H 1 8.762 0.001 . 1 . . 1122 . A 32 GLU H . 34088 1 27 . 1 1 32 32 GLU CA C 13 52.576 . . 1 . . 1123 . A 32 GLU CA . 34088 1 28 . 1 1 32 32 GLU N N 15 121.429 0.063 . 1 . . 707 . A 32 GLU N . 34088 1 29 . 1 1 34 34 SER H H 1 9.455 0.019 . 1 . . 771 . A 34 SER H . 34088 1 30 . 1 1 34 34 SER CA C 13 59.048 . . 1 . . 417 . A 34 SER CA . 34088 1 31 . 1 1 34 34 SER N N 15 110.404 0.069 . 1 . . 418 . A 34 SER N . 34088 1 32 . 1 1 35 35 VAL H H 1 9.076 0.0 . 1 . . 879 . A 35 VAL H . 34088 1 33 . 1 1 35 35 VAL CA C 13 59.328 . . 1 . . 628 . A 35 VAL CA . 34088 1 34 . 1 1 35 35 VAL N N 15 111.428 . . 1 . . 627 . A 35 VAL N . 34088 1 35 . 1 1 37 37 PHE H H 1 9.249 0.006 . 1 . . 949 . A 37 PHE H . 34088 1 36 . 1 1 37 37 PHE CA C 13 56.448 . . 1 . . 307 . A 37 PHE CA . 34088 1 37 . 1 1 37 37 PHE N N 15 118.485 0.048 . 1 . . 308 . A 37 PHE N . 34088 1 38 . 1 1 38 38 ASN H H 1 9.365 0.017 . 1 . . 951 . A 38 ASN H . 34088 1 39 . 1 1 38 38 ASN HD21 H 1 5.754 0.015 . 1 . . 922 . A 38 ASN HD21 . 34088 1 40 . 1 1 38 38 ASN CA C 13 53.327 . . 1 . . 862 . A 38 ASN CA . 34088 1 41 . 1 1 38 38 ASN N N 15 121.841 0.069 . 1 . . 1267 . A 38 ASN N . 34088 1 42 . 1 1 38 38 ASN ND2 N 15 109.610 0.03 . 1 . . 921 . A 38 ASN ND2 . 34088 1 43 . 1 1 39 39 ALA H H 1 9.179 0.012 . 1 . . 730 . A 39 ALA H . 34088 1 44 . 1 1 39 39 ALA CA C 13 51.230 . . 1 . . 257 . A 39 ALA CA . 34088 1 45 . 1 1 39 39 ALA N N 15 120.056 0.045 . 1 . . 259 . A 39 ALA N . 34088 1 46 . 1 1 40 40 ALA H H 1 8.973 0.009 . 1 . . 747 . A 40 ALA H . 34088 1 47 . 1 1 40 40 ALA CA C 13 51.260 . . 1 . . 266 . A 40 ALA CA . 34088 1 48 . 1 1 40 40 ALA N N 15 123.103 0.086 . 1 . . 267 . A 40 ALA N . 34088 1 49 . 1 1 41 41 ASN H H 1 8.070 0.004 . 1 . . 728 . A 41 ASN H . 34088 1 50 . 1 1 41 41 ASN CA C 13 53.637 . . 1 . . 727 . A 41 ASN CA . 34088 1 51 . 1 1 41 41 ASN N N 15 118.185 0.043 . 1 . . 726 . A 41 ASN N . 34088 1 52 . 1 1 42 42 GLY H H 1 8.984 0.013 . 1 . . 935 . A 42 GLY H . 34088 1 53 . 1 1 42 42 GLY CA C 13 45.464 . . 1 . . 385 . A 42 GLY CA . 34088 1 54 . 1 1 42 42 GLY N N 15 117.072 0.031 . 1 . . 386 . A 42 GLY N . 34088 1 55 . 1 1 44 44 TRP H H 1 8.148 0.004 . 1 . . 762 . A 44 TRP H . 34088 1 56 . 1 1 44 44 TRP CA C 13 57.886 . . 1 . . 149 . A 44 TRP CA . 34088 1 57 . 1 1 44 44 TRP N N 15 122.736 0.024 . 1 . . 761 . A 44 TRP N . 34088 1 58 . 1 1 45 45 ARG H H 1 9.189 0.005 . 1 . . 816 . A 45 ARG H . 34088 1 59 . 1 1 45 45 ARG CA C 13 56.763 . . 1 . . 815 . A 45 ARG CA . 34088 1 60 . 1 1 45 45 ARG N N 15 121.523 0.037 . 1 . . 1254 . A 45 ARG N . 34088 1 61 . 1 1 46 46 ILE H H 1 9.784 0.003 . 1 . . 712 . A 46 ILE H . 34088 1 62 . 1 1 46 46 ILE CA C 13 60.949 . . 1 . . 193 . A 46 ILE CA . 34088 1 63 . 1 1 46 46 ILE N N 15 126.571 0.036 . 1 . . 498 . A 46 ILE N . 34088 1 64 . 1 1 47 47 ALA H H 1 9.618 0.01 . 1 . . 714 . A 47 ALA H . 34088 1 65 . 1 1 47 47 ALA CA C 13 51.927 . . 1 . . 278 . A 47 ALA CA . 34088 1 66 . 1 1 47 47 ALA N N 15 128.832 0.036 . 1 . . 279 . A 47 ALA N . 34088 1 67 . 1 1 48 48 LEU H H 1 9.686 0.009 . 1 . . 734 . A 48 LEU H . 34088 1 68 . 1 1 48 48 LEU CA C 13 54.443 . . 1 . . 126 . A 48 LEU CA . 34088 1 69 . 1 1 48 48 LEU N N 15 122.968 0.016 . 1 . . 504 . A 48 LEU N . 34088 1 70 . 1 1 49 49 ALA H H 1 9.167 0.007 . 1 . . 952 . A 49 ALA H . 34088 1 71 . 1 1 49 49 ALA CA C 13 52.498 . . 1 . . 809 . A 49 ALA CA . 34088 1 72 . 1 1 49 49 ALA N N 15 122.243 0.01 . 1 . . 285 . A 49 ALA N . 34088 1 73 . 1 1 50 50 TYR H H 1 9.140 0.003 . 1 . . 953 . A 50 TYR H . 34088 1 74 . 1 1 50 50 TYR CA C 13 60.149 . . 1 . . 320 . A 50 TYR CA . 34088 1 75 . 1 1 50 50 TYR N N 15 118.448 0.012 . 1 . . 321 . A 50 TYR N . 34088 1 76 . 1 1 51 51 TYR H H 1 6.182 0.031 . 1 . . 669 . A 51 TYR H . 34088 1 77 . 1 1 51 51 TYR CA C 13 55.499 . . 1 . . 292 . A 51 TYR CA . 34088 1 78 . 1 1 51 51 TYR N N 15 128.468 0.069 . 1 . . 293 . A 51 TYR N . 34088 1 79 . 1 1 52 52 GLN H H 1 7.422 0.005 . 1 . . 801 . A 52 GLN H . 34088 1 80 . 1 1 52 52 GLN CA C 13 54.665 . . 1 . . 1387 . A 52 GLN CA . 34088 1 81 . 1 1 52 52 GLN N N 15 126.831 0.053 . 1 . . 800 . A 52 GLN N . 34088 1 82 . 1 1 68 68 ASP H H 1 9.026 0.039 . 1 . . 1089 . A 68 ASP H . 34088 1 83 . 1 1 68 68 ASP CA C 13 52.392 . . 1 . . 1175 . A 68 ASP CA . 34088 1 84 . 1 1 68 68 ASP N N 15 118.457 0.044 . 1 . . 1088 . A 68 ASP N . 34088 1 85 . 1 1 69 69 ARG H H 1 8.309 0.002 . 1 . . 1115 . A 69 ARG H . 34088 1 86 . 1 1 69 69 ARG CA C 13 53.970 . . 1 . . 427 . A 69 ARG CA . 34088 1 87 . 1 1 69 69 ARG N N 15 118.544 0.028 . 1 . . 1255 . A 69 ARG N . 34088 1 88 . 1 1 71 71 GLU H H 1 9.012 0.001 . 1 . . 905 . A 71 GLU H . 34088 1 89 . 1 1 71 71 GLU CA C 13 55.469 . . 1 . . 907 . A 71 GLU CA . 34088 1 90 . 1 1 71 71 GLU N N 15 119.760 0.029 . 1 . . 906 . A 71 GLU N . 34088 1 91 . 1 1 72 72 LEU H H 1 8.971 0.003 . 1 . . 983 . A 72 LEU H . 34088 1 92 . 1 1 72 72 LEU CA C 13 54.511 . . 1 . . 982 . A 72 LEU CA . 34088 1 93 . 1 1 72 72 LEU N N 15 125.005 0.029 . 1 . . 981 . A 72 LEU N . 34088 1 94 . 1 1 73 73 GLU H H 1 9.771 0.003 . 1 . . 973 . A 73 GLU H . 34088 1 95 . 1 1 73 73 GLU CA C 13 56.003 . . 1 . . 543 . A 73 GLU CA . 34088 1 96 . 1 1 73 73 GLU N N 15 121.981 0.012 . 1 . . 544 . A 73 GLU N . 34088 1 97 . 1 1 74 74 VAL H H 1 9.382 0.004 . 1 . . 954 . A 74 VAL H . 34088 1 98 . 1 1 74 74 VAL CA C 13 61.002 . . 1 . . 689 . A 74 VAL CA . 34088 1 99 . 1 1 74 74 VAL N N 15 119.871 0.039 . 1 . . 934 . A 74 VAL N . 34088 1 100 . 1 1 75 75 HIS H H 1 9.803 0.005 . 1 . . 721 . A 75 HIS H . 34088 1 101 . 1 1 75 75 HIS CA C 13 54.773 . . 1 . . 172 . A 75 HIS CA . 34088 1 102 . 1 1 75 75 HIS N N 15 124.917 0.052 . 1 . . 352 . A 75 HIS N . 34088 1 103 . 1 1 76 76 TYR H H 1 8.319 0.006 . 1 . . 927 . A 76 TYR H . 34088 1 104 . 1 1 76 76 TYR CA C 13 56.774 . . 1 . . 358 . A 76 TYR CA . 34088 1 105 . 1 1 76 76 TYR N N 15 124.918 0.028 . 1 . . 359 . A 76 TYR N . 34088 1 106 . 1 1 77 77 GLN H H 1 7.881 0.023 . 1 . . 786 . A 77 GLN H . 34088 1 107 . 1 1 77 77 GLN CA C 13 54.124 . . 1 . . 785 . A 77 GLN CA . 34088 1 108 . 1 1 77 77 GLN N N 15 129.124 0.035 . 1 . . 784 . A 77 GLN N . 34088 1 109 . 1 1 78 78 PHE H H 1 8.259 0.013 . 1 . . 1128 . A 78 PHE H . 34088 1 110 . 1 1 78 78 PHE CA C 13 62.461 . . 1 . . 1126 . A 78 PHE CA . 34088 1 111 . 1 1 78 78 PHE N N 15 125.717 0.028 . 1 . . 1127 . A 78 PHE N . 34088 1 112 . 1 1 86 86 PHE H H 1 8.662 0.013 . 1 . . 1112 . A 86 PHE H . 34088 1 113 . 1 1 86 86 PHE CA C 13 58.958 . . 1 . . 346 . A 86 PHE CA . 34088 1 114 . 1 1 86 86 PHE N N 15 121.553 0.025 . 1 . . 347 . A 86 PHE N . 34088 1 115 . 1 1 87 87 GLY H H 1 8.847 0.015 . 1 . . 1114 . A 87 GLY H . 34088 1 116 . 1 1 87 87 GLY CA C 13 45.492 . . 1 . . 388 . A 87 GLY CA . 34088 1 117 . 1 1 87 87 GLY N N 15 118.235 0.052 . 1 . . 1113 . A 87 GLY N . 34088 1 118 . 1 1 88 88 LEU H H 1 7.926 0.01 . 1 . . 717 . A 88 LEU H . 34088 1 119 . 1 1 88 88 LEU CA C 13 54.735 . . 1 . . 87 . A 88 LEU CA . 34088 1 120 . 1 1 88 88 LEU N N 15 116.960 0.056 . 1 . . 522 . A 88 LEU N . 34088 1 121 . 1 1 89 89 THR H H 1 8.562 0.004 . 1 . . 733 . A 89 THR H . 34088 1 122 . 1 1 89 89 THR CA C 13 62.344 . . 1 . . 20 . A 89 THR CA . 34088 1 123 . 1 1 89 89 THR N N 15 122.116 0.045 . 1 . . 465 . A 89 THR N . 34088 1 124 . 1 1 90 90 GLY H H 1 9.596 0.004 . 1 . . 735 . A 90 GLY H . 34088 1 125 . 1 1 90 90 GLY CA C 13 44.761 . . 1 . . 529 . A 90 GLY CA . 34088 1 126 . 1 1 90 90 GLY N N 15 113.532 0.023 . 1 . . 530 . A 90 GLY N . 34088 1 127 . 1 1 91 91 GLY H H 1 9.429 0.013 . 1 . . 668 . A 91 GLY H . 34088 1 128 . 1 1 91 91 GLY CA C 13 46.542 . . 1 . . 368 . A 91 GLY CA . 34088 1 129 . 1 1 91 91 GLY N N 15 109.088 0.022 . 1 . . 369 . A 91 GLY N . 34088 1 130 . 1 1 92 92 PHE H H 1 9.258 0.006 . 1 . . 720 . A 92 PHE H . 34088 1 131 . 1 1 92 92 PHE CA C 13 57.429 . . 1 . . 575 . A 92 PHE CA . 34088 1 132 . 1 1 92 92 PHE N N 15 120.542 0.028 . 1 . . 576 . A 92 PHE N . 34088 1 133 . 1 1 93 93 ARG H H 1 7.661 0.004 . 1 . . 902 . A 93 ARG H . 34088 1 134 . 1 1 93 93 ARG CA C 13 54.349 . . 1 . . 435 . A 93 ARG CA . 34088 1 135 . 1 1 93 93 ARG N N 15 123.905 0.036 . 1 . . 903 . A 93 ARG N . 34088 1 136 . 1 1 94 94 ASN H H 1 7.660 0.006 . 1 . . 828 . A 94 ASN H . 34088 1 137 . 1 1 94 94 ASN CA C 13 53.580 . . 1 . . 827 . A 94 ASN CA . 34088 1 138 . 1 1 94 94 ASN N N 15 117.001 0.021 . 1 . . 826 . A 94 ASN N . 34088 1 139 . 1 1 95 95 TYR H H 1 9.569 0.018 . 1 . . 858 . A 95 TYR H . 34088 1 140 . 1 1 95 95 TYR CA C 13 56.868 . . 1 . . 857 . A 95 TYR CA . 34088 1 141 . 1 1 95 95 TYR N N 15 122.908 0.016 . 1 . . 310 . A 95 TYR N . 34088 1 142 . 1 1 96 96 GLY H H 1 9.312 0.009 . 1 . . 1117 . A 96 GLY H . 34088 1 143 . 1 1 96 96 GLY CA C 13 46.131 . . 1 . . 582 . A 96 GLY CA . 34088 1 144 . 1 1 96 96 GLY N N 15 112.831 0.036 . 1 . . 1116 . A 96 GLY N . 34088 1 145 . 1 1 97 97 TYR H H 1 8.565 0.007 . 1 . . 763 . A 97 TYR H . 34088 1 146 . 1 1 97 97 TYR CA C 13 59.793 . . 1 . . 327 . A 97 TYR CA . 34088 1 147 . 1 1 97 97 TYR N N 15 122.803 0.044 . 1 . . 1121 . A 97 TYR N . 34088 1 148 . 1 1 108 108 ALA H H 1 8.139 0.018 . 1 . . 731 . A 108 ALA H . 34088 1 149 . 1 1 108 108 ALA CA C 13 52.589 . . 1 . . 282 . A 108 ALA CA . 34088 1 150 . 1 1 108 108 ALA N N 15 120.344 0.254 . 1 . . 283 . A 108 ALA N . 34088 1 151 . 1 1 109 109 ASN H H 1 10.080 0.019 . 1 . . 842 . A 109 ASN H . 34088 1 152 . 1 1 109 109 ASN CA C 13 54.694 . . 1 . . 841 . A 109 ASN CA . 34088 1 153 . 1 1 109 109 ASN N N 15 121.281 0.034 . 1 . . 840 . A 109 ASN N . 34088 1 154 . 1 1 110 110 MET H H 1 8.611 0.004 . 1 . . 803 . A 110 MET H . 34088 1 155 . 1 1 110 110 MET CA C 13 53.688 . . 1 . . 802 . A 110 MET CA . 34088 1 156 . 1 1 110 110 MET N N 15 126.201 0.053 . 1 . . 547 . A 110 MET N . 34088 1 157 . 1 1 111 111 GLN H H 1 9.727 0.019 . 1 . . 797 . A 111 GLN H . 34088 1 158 . 1 1 111 111 GLN CA C 13 56.868 . . 1 . . 796 . A 111 GLN CA . 34088 1 159 . 1 1 111 111 GLN N N 15 124.594 0.023 . 1 . . 795 . A 111 GLN N . 34088 1 160 . 1 1 112 112 ARG H H 1 8.528 0.024 . 1 . . 1087 . A 112 ARG H . 34088 1 161 . 1 1 112 112 ARG CA C 13 54.691 . . 1 . . 1134 . A 112 ARG CA . 34088 1 162 . 1 1 112 112 ARG N N 15 118.221 0.072 . 1 . . 1086 . A 112 ARG N . 34088 1 163 . 1 1 113 113 TRP H H 1 9.700 0.007 . 1 . . 758 . A 113 TRP H . 34088 1 164 . 1 1 113 113 TRP CA C 13 56.284 . . 1 . . 143 . A 113 TRP CA . 34088 1 165 . 1 1 113 113 TRP N N 15 132.768 0.028 . 1 . . 759 . A 113 TRP N . 34088 1 166 . 1 1 114 114 LYS H H 1 9.163 0.009 . 1 . . 1055 . A 114 LYS H . 34088 1 167 . 1 1 114 114 LYS CA C 13 55.445 . . 1 . . 1142 . A 114 LYS CA . 34088 1 168 . 1 1 114 114 LYS N N 15 124.354 0.025 . 1 . . 1053 . A 114 LYS N . 34088 1 169 . 1 1 115 115 ILE H H 1 8.674 0.011 . 1 . . 1052 . A 115 ILE H . 34088 1 170 . 1 1 115 115 ILE CA C 13 60.135 . . 1 . . 1051 . A 115 ILE CA . 34088 1 171 . 1 1 115 115 ILE N N 15 123.468 0.058 . 1 . . 632 . A 115 ILE N . 34088 1 172 . 1 1 116 116 ALA H H 1 9.067 0.022 . 1 . . 729 . A 116 ALA H . 34088 1 173 . 1 1 116 116 ALA CA C 13 50.581 . . 1 . . 255 . A 116 ALA CA . 34088 1 174 . 1 1 116 116 ALA N N 15 125.502 0.028 . 1 . . 264 . A 116 ALA N . 34088 1 175 . 1 1 118 118 ASP H H 1 8.692 0.028 . 1 . . 774 . A 118 ASP H . 34088 1 176 . 1 1 118 118 ASP CA C 13 54.145 . . 1 . . 663 . A 118 ASP CA . 34088 1 177 . 1 1 118 118 ASP N N 15 116.430 0.061 . 1 . . 699 . A 118 ASP N . 34088 1 178 . 1 1 119 119 TRP H H 1 8.257 0.003 . 1 . . 928 . A 119 TRP H . 34088 1 179 . 1 1 119 119 TRP CA C 13 57.705 . . 1 . . 151 . A 119 TRP CA . 34088 1 180 . 1 1 119 119 TRP N N 15 115.196 0.038 . 1 . . 929 . A 119 TRP N . 34088 1 181 . 1 1 120 120 ASP H H 1 8.363 0.046 . 1 . . 1038 . A 120 ASP H . 34088 1 182 . 1 1 120 120 ASP CA C 13 55.704 . . 1 . . 1203 . A 120 ASP CA . 34088 1 183 . 1 1 120 120 ASP N N 15 119.625 0.293 . 1 . . 1036 . A 120 ASP N . 34088 1 184 . 1 1 121 121 VAL H H 1 9.780 0.0 . 1 . . 997 . A 121 VAL H . 34088 1 185 . 1 1 121 121 VAL CA C 13 60.949 . . 1 . . 1206 . A 121 VAL CA . 34088 1 186 . 1 1 121 121 VAL N N 15 126.548 0.016 . 1 . . 996 . A 121 VAL N . 34088 1 187 . 1 1 122 122 LYS H H 1 8.670 0.009 . 1 . . 783 . A 122 LYS H . 34088 1 188 . 1 1 122 122 LYS CA C 13 58.733 . . 1 . . 782 . A 122 LYS CA . 34088 1 189 . 1 1 122 122 LYS N N 15 128.194 0.065 . 1 . . 781 . A 122 LYS N . 34088 1 190 . 1 1 124 124 THR H H 1 8.734 0.015 . 1 . . 710 . A 124 THR H . 34088 1 191 . 1 1 124 124 THR CA C 13 60.090 . . 1 . . 40 . A 124 THR CA . 34088 1 192 . 1 1 124 124 THR N N 15 109.274 0.028 . 1 . . 460 . A 124 THR N . 34088 1 193 . 1 1 127 127 LEU H H 1 7.686 0.014 . 1 . . 810 . A 127 LEU H . 34088 1 194 . 1 1 127 127 LEU CA C 13 54.563 . . 1 . . 124 . A 127 LEU CA . 34088 1 195 . 1 1 127 127 LEU N N 15 122.647 0.056 . 1 . . 706 . A 127 LEU N . 34088 1 196 . 1 1 128 128 ARG H H 1 9.229 0.005 . 1 . . 1147 . A 128 ARG H . 34088 1 197 . 1 1 128 128 ARG CA C 13 54.915 . . 1 . . 932 . A 128 ARG CA . 34088 1 198 . 1 1 128 128 ARG N N 15 123.923 0.024 . 1 . . 1146 . A 128 ARG N . 34088 1 199 . 1 1 129 129 PHE H H 1 9.314 0.003 . 1 . . 955 . A 129 PHE H . 34088 1 200 . 1 1 129 129 PHE CA C 13 54.831 . . 1 . . 930 . A 129 PHE CA . 34088 1 201 . 1 1 129 129 PHE N N 15 121.755 0.012 . 1 . . 289 . A 129 PHE N . 34088 1 202 . 1 1 130 130 ASN H H 1 8.996 0.016 . 1 . . 956 . A 130 ASN H . 34088 1 203 . 1 1 130 130 ASN CA C 13 51.260 . . 1 . . 878 . A 130 ASN CA . 34088 1 204 . 1 1 130 130 ASN N N 15 123.179 0.06 . 1 . . 875 . A 130 ASN N . 34088 1 205 . 1 1 131 131 GLY H H 1 7.082 0.004 . 1 . . 836 . A 131 GLY H . 34088 1 206 . 1 1 131 131 GLY CA C 13 45.695 . . 1 . . 835 . A 131 GLY CA . 34088 1 207 . 1 1 131 131 GLY N N 15 104.193 0.026 . 1 . . 834 . A 131 GLY N . 34088 1 208 . 1 1 132 132 TRP H H 1 6.833 0.018 . 1 . . 746 . A 132 TRP H . 34088 1 209 . 1 1 132 132 TRP HE1 H 1 10.014 0.004 . 1 . . 1185 . A 132 TRP HE1 . 34088 1 210 . 1 1 132 132 TRP CA C 13 55.197 . . 1 . . 137 . A 132 TRP CA . 34088 1 211 . 1 1 132 132 TRP N N 15 112.990 0.134 . 1 . . 745 . A 132 TRP N . 34088 1 212 . 1 1 132 132 TRP NE1 N 15 129.707 0.042 . 1 . . 1186 . A 132 TRP NE1 . 34088 1 213 . 1 1 133 133 LEU H H 1 8.739 0.005 . 1 . . 916 . A 133 LEU H . 34088 1 214 . 1 1 133 133 LEU CA C 13 56.032 . . 1 . . 917 . A 133 LEU CA . 34088 1 215 . 1 1 133 133 LEU N N 15 124.205 0.071 . 1 . . 536 . A 133 LEU N . 34088 1 216 . 1 1 134 134 SER H H 1 10.315 0.015 . 1 . . 670 . A 134 SER H . 34088 1 217 . 1 1 134 134 SER CA C 13 57.165 . . 1 . . 414 . A 134 SER CA . 34088 1 218 . 1 1 134 134 SER N N 15 119.427 0.025 . 1 . . 415 . A 134 SER N . 34088 1 219 . 1 1 135 135 MET H H 1 8.755 0.002 . 1 . . 960 . A 135 MET H . 34088 1 220 . 1 1 135 135 MET CA C 13 54.533 . . 1 . . 1118 . A 135 MET CA . 34088 1 221 . 1 1 135 135 MET N N 15 123.136 0.028 . 1 . . 961 . A 135 MET N . 34088 1 222 . 1 1 136 136 TYR H H 1 9.275 0.0 . 1 . . 1022 . A 136 TYR H . 34088 1 223 . 1 1 136 136 TYR CA C 13 54.738 . . 1 . . 1151 . A 136 TYR CA . 34088 1 224 . 1 1 136 136 TYR N N 15 119.177 0.002 . 1 . . 1020 . A 136 TYR N . 34088 1 225 . 1 1 137 137 LYS H H 1 8.934 0.007 . 1 . . 1125 . A 137 LYS H . 34088 1 226 . 1 1 137 137 LYS CA C 13 53.197 . . 1 . . 223 . A 137 LYS CA . 34088 1 227 . 1 1 137 137 LYS N N 15 119.597 0.045 . 1 . . 1124 . A 137 LYS N . 34088 1 228 . 1 1 138 138 PHE H H 1 9.078 0.0 . 1 . . 1154 . A 138 PHE H . 34088 1 229 . 1 1 138 138 PHE CA C 13 57.262 . . 1 . . 1152 . A 138 PHE CA . 34088 1 230 . 1 1 138 138 PHE N N 15 124.950 0.0 . 1 . . 1153 . A 138 PHE N . 34088 1 231 . 1 1 139 139 ALA H H 1 9.245 0.01 . 1 . . 1120 . A 139 ALA H . 34088 1 232 . 1 1 139 139 ALA CA C 13 52.471 . . 1 . . 1137 . A 139 ALA CA . 34088 1 233 . 1 1 139 139 ALA N N 15 123.310 0.056 . 1 . . 1119 . A 139 ALA N . 34088 1 234 . 1 1 140 140 ASN H H 1 8.717 0.008 . 1 . . 716 . A 140 ASN H . 34088 1 235 . 1 1 140 140 ASN CA C 13 57.666 . . 1 . . 643 . A 140 ASN CA . 34088 1 236 . 1 1 140 140 ASN N N 15 111.363 0.074 . 1 . . 644 . A 140 ASN N . 34088 1 237 . 1 1 141 141 ASP H H 1 8.424 0.003 . 1 . . 889 . A 141 ASP H . 34088 1 238 . 1 1 141 141 ASP CA C 13 56.301 . . 1 . . 888 . A 141 ASP CA . 34088 1 239 . 1 1 141 141 ASP N N 15 112.083 0.041 . 1 . . 887 . A 141 ASP N . 34088 1 240 . 1 1 142 142 LEU H H 1 8.371 0.017 . 1 . . 757 . A 142 LEU H . 34088 1 241 . 1 1 142 142 LEU CA C 13 58.170 . . 1 . . 97 . A 142 LEU CA . 34088 1 242 . 1 1 142 142 LEU N N 15 116.606 0.055 . 1 . . 478 . A 142 LEU N . 34088 1 243 . 1 1 143 143 ASN H H 1 9.013 0.02 . 1 . . 722 . A 143 ASN H . 34088 1 244 . 1 1 143 143 ASN CA C 13 55.904 . . 1 . . 473 . A 143 ASN CA . 34088 1 245 . 1 1 143 143 ASN N N 15 115.994 0.056 . 1 . . 474 . A 143 ASN N . 34088 1 246 . 1 1 144 144 THR H H 1 7.606 0.011 . 1 . . 736 . A 144 THR H . 34088 1 247 . 1 1 144 144 THR CA C 13 65.809 . . 1 . . 1 . A 144 THR CA . 34088 1 248 . 1 1 144 144 THR N N 15 116.179 0.031 . 1 . . 463 . A 144 THR N . 34088 1 249 . 1 1 145 145 THR H H 1 8.678 0.011 . 1 . . 748 . A 145 THR H . 34088 1 250 . 1 1 145 145 THR CA C 13 63.023 . . 1 . . 13 . A 145 THR CA . 34088 1 251 . 1 1 145 145 THR N N 15 109.935 0.047 . 1 . . 464 . A 145 THR N . 34088 1 252 . 1 1 146 146 GLY H H 1 8.297 0.007 . 1 . . 744 . A 146 GLY H . 34088 1 253 . 1 1 146 146 GLY CA C 13 46.306 . . 1 . . 376 . A 146 GLY CA . 34088 1 254 . 1 1 146 146 GLY N N 15 109.052 0.037 . 1 . . 377 . A 146 GLY N . 34088 1 255 . 1 1 147 147 TYR H H 1 7.088 0.01 . 1 . . 719 . A 147 TYR H . 34088 1 256 . 1 1 147 147 TYR CA C 13 58.597 . . 1 . . 584 . A 147 TYR CA . 34088 1 257 . 1 1 147 147 TYR N N 15 120.376 0.113 . 1 . . 585 . A 147 TYR N . 34088 1 258 . 1 1 148 148 ALA H H 1 8.320 . . 1 . . 919 . A 148 ALA H . 34088 1 259 . 1 1 148 148 ALA CA C 13 51.624 . . 1 . . 247 . A 148 ALA CA . 34088 1 260 . 1 1 148 148 ALA N N 15 123.055 . . 1 . . 553 . A 148 ALA N . 34088 1 261 . 1 1 149 149 ASP H H 1 8.288 0.02 . 1 . . 749 . A 149 ASP H . 34088 1 262 . 1 1 149 149 ASP CA C 13 57.014 . . 1 . . 555 . A 149 ASP CA . 34088 1 263 . 1 1 149 149 ASP N N 15 115.477 0.028 . 1 . . 556 . A 149 ASP N . 34088 1 264 . 1 1 150 150 THR H H 1 8.438 0.001 . 1 . . 711 . A 150 THR H . 34088 1 265 . 1 1 150 150 THR CA C 13 62.434 . . 1 . . 22 . A 150 THR CA . 34088 1 266 . 1 1 150 150 THR N N 15 118.276 0.003 . 1 . . 461 . A 150 THR N . 34088 1 267 . 1 1 151 151 ARG H H 1 8.965 0.001 . 1 . . 813 . A 151 ARG H . 34088 1 268 . 1 1 151 151 ARG CA C 13 55.348 . . 1 . . 812 . A 151 ARG CA . 34088 1 269 . 1 1 151 151 ARG N N 15 125.016 0.02 . 1 . . 811 . A 151 ARG N . 34088 1 270 . 1 1 153 153 GLU H H 1 9.101 0.02 . 1 . . 963 . A 153 GLU H . 34088 1 271 . 1 1 153 153 GLU CA C 13 54.123 . . 1 . . 666 . A 153 GLU CA . 34088 1 272 . 1 1 153 153 GLU N N 15 127.861 0.069 . 1 . . 962 . A 153 GLU N . 34088 1 273 . 1 1 154 154 THR H H 1 9.049 0.016 . 1 . . 737 . A 154 THR H . 34088 1 274 . 1 1 154 154 THR CA C 13 60.103 . . 1 . . 28 . A 154 THR CA . 34088 1 275 . 1 1 154 154 THR N N 15 122.140 0.045 . 1 . . 469 . A 154 THR N . 34088 1 276 . 1 1 155 155 GLU H H 1 5.359 0.029 . 1 . . 738 . A 155 GLU H . 34088 1 277 . 1 1 155 155 GLU CA C 13 56.291 . . 1 . . 619 . A 155 GLU CA . 34088 1 278 . 1 1 155 155 GLU N N 15 123.765 0.037 . 1 . . 620 . A 155 GLU N . 34088 1 279 . 1 1 156 156 THR H H 1 9.004 0.019 . 1 . . 976 . A 156 THR H . 34088 1 280 . 1 1 156 156 THR CA C 13 60.103 . . 1 . . 33 . A 156 THR CA . 34088 1 281 . 1 1 156 156 THR N N 15 122.456 0.146 . 1 . . 468 . A 156 THR N . 34088 1 282 . 1 1 157 157 GLY H H 1 8.768 0.017 . 1 . . 751 . A 157 GLY H . 34088 1 283 . 1 1 157 157 GLY CA C 13 48.075 . . 1 . . 362 . A 157 GLY CA . 34088 1 284 . 1 1 157 157 GLY N N 15 113.935 0.03 . 1 . . 363 . A 157 GLY N . 34088 1 285 . 1 1 158 158 LEU H H 1 8.563 0.014 . 1 . . 732 . A 158 LEU H . 34088 1 286 . 1 1 158 158 LEU CA C 13 53.086 . . 1 . . 125 . A 158 LEU CA . 34088 1 287 . 1 1 158 158 LEU N N 15 118.394 0.043 . 1 . . 490 . A 158 LEU N . 34088 1 288 . 1 1 159 159 GLN H H 1 9.105 0.004 . 1 . . 822 . A 159 GLN H . 34088 1 289 . 1 1 159 159 GLN CA C 13 54.032 . . 1 . . 652 . A 159 GLN CA . 34088 1 290 . 1 1 159 159 GLN N N 15 120.358 0.034 . 1 . . 821 . A 159 GLN N . 34088 1 291 . 1 1 160 160 TYR H H 1 10.066 0.019 . 1 . . 1169 . A 160 TYR H . 34088 1 292 . 1 1 160 160 TYR CA C 13 56.840 . . 1 . . 339 . A 160 TYR CA . 34088 1 293 . 1 1 160 160 TYR N N 15 130.878 0.039 . 1 . . 340 . A 160 TYR N . 34088 1 294 . 1 1 161 161 THR H H 1 8.375 0.0 . 1 . . 900 . A 161 THR H . 34088 1 295 . 1 1 161 161 THR CA C 13 63.308 . . 1 . . 11 . A 161 THR CA . 34088 1 296 . 1 1 161 161 THR N N 15 125.219 . . 1 . . 462 . A 161 THR N . 34088 1 297 . 1 1 162 162 PHE H H 1 8.616 0.016 . 1 . . 924 . A 162 PHE H . 34088 1 298 . 1 1 162 162 PHE CA C 13 61.538 . . 1 . . 335 . A 162 PHE CA . 34088 1 299 . 1 1 162 162 PHE N N 15 126.419 0.064 . 1 . . 336 . A 162 PHE N . 34088 1 300 . 1 1 163 163 ASN H H 1 8.228 0.011 . 1 . . 739 . A 163 ASN H . 34088 1 301 . 1 1 163 163 ASN CA C 13 52.991 . . 1 . . 614 . A 163 ASN CA . 34088 1 302 . 1 1 163 163 ASN N N 15 111.300 0.047 . 1 . . 615 . A 163 ASN N . 34088 1 303 . 1 1 164 164 GLU H H 1 8.991 0.009 . 1 . . 750 . A 164 GLU H . 34088 1 304 . 1 1 164 164 GLU CA C 13 59.418 . . 1 . . 567 . A 164 GLU CA . 34088 1 305 . 1 1 164 164 GLU N N 15 114.752 0.076 . 1 . . 568 . A 164 GLU N . 34088 1 306 . 1 1 165 165 THR H H 1 8.799 . . 1 . . 1213 . A 165 THR H . 34088 1 307 . 1 1 165 165 THR N N 15 115.930 . . 1 . . 1212 . A 165 THR N . 34088 1 308 . 1 1 166 166 VAL H H 1 8.018 0.009 . 1 . . 920 . A 166 VAL H . 34088 1 309 . 1 1 166 166 VAL N N 15 119.371 0.051 . 1 . . 561 . A 166 VAL N . 34088 1 310 . 1 1 167 167 ALA H H 1 8.190 0.005 . 1 . . 672 . A 167 ALA H . 34088 1 311 . 1 1 167 167 ALA CA C 13 51.098 . . 1 . . 253 . A 167 ALA CA . 34088 1 312 . 1 1 167 167 ALA N N 15 128.488 0.069 . 1 . . 263 . A 167 ALA N . 34088 1 313 . 1 1 168 168 LEU H H 1 9.194 0.034 . 1 . . 742 . A 168 LEU H . 34088 1 314 . 1 1 168 168 LEU CA C 13 54.211 . . 1 . . 122 . A 168 LEU CA . 34088 1 315 . 1 1 168 168 LEU N N 15 116.828 0.026 . 1 . . 587 . A 168 LEU N . 34088 1 316 . 1 1 169 169 ARG H H 1 9.489 0.008 . 1 . . 773 . A 169 ARG H . 34088 1 317 . 1 1 169 169 ARG CA C 13 54.993 . . 1 . . 454 . A 169 ARG CA . 34088 1 318 . 1 1 169 169 ARG N N 15 124.579 0.032 . 1 . . 589 . A 169 ARG N . 34088 1 319 . 1 1 170 170 VAL H H 1 8.959 0.009 . 1 . . 713 . A 170 VAL H . 34088 1 320 . 1 1 170 170 VAL CA C 13 63.340 . . 1 . . 558 . A 170 VAL CA . 34088 1 321 . 1 1 170 170 VAL N N 15 122.324 0.02 . 1 . . 559 . A 170 VAL N . 34088 1 322 . 1 1 171 171 ASN H H 1 9.699 0.012 . 1 . . 942 . A 171 ASN H . 34088 1 323 . 1 1 171 171 ASN CA C 13 51.459 . . 1 . . 945 . A 171 ASN CA . 34088 1 324 . 1 1 171 171 ASN N N 15 121.854 0.012 . 1 . . 944 . A 171 ASN N . 34088 1 325 . 1 1 172 172 TYR H H 1 9.718 0.007 . 1 . . 948 . A 172 TYR H . 34088 1 326 . 1 1 172 172 TYR CA C 13 57.535 . . 1 . . 861 . A 172 TYR CA . 34088 1 327 . 1 1 172 172 TYR N N 15 122.050 0.01 . 1 . . 1160 . A 172 TYR N . 34088 1 328 . 1 1 173 173 TYR H H 1 8.439 0.002 . 1 . . 938 . A 173 TYR H . 34088 1 329 . 1 1 173 173 TYR CA C 13 56.249 . . 1 . . 937 . A 173 TYR CA . 34088 1 330 . 1 1 173 173 TYR N N 15 127.837 0.034 . 1 . . 936 . A 173 TYR N . 34088 1 331 . 1 1 174 174 LEU H H 1 7.520 0.009 . 1 . . 756 . A 174 LEU H . 34088 1 332 . 1 1 174 174 LEU CA C 13 52.927 . . 1 . . 109 . A 174 LEU CA . 34088 1 333 . 1 1 174 174 LEU N N 15 126.407 0.041 . 1 . . 491 . A 174 LEU N . 34088 1 334 . 1 1 175 175 GLU H H 1 8.782 0.0 . 1 . . 965 . A 175 GLU H . 34088 1 335 . 1 1 175 175 GLU CA C 13 55.274 . . 1 . . 966 . A 175 GLU CA . 34088 1 336 . 1 1 175 175 GLU N N 15 124.396 0.004 . 1 . . 967 . A 175 GLU N . 34088 1 337 . 1 1 194 194 ILE H H 1 8.765 0.0 . 1 . . 1216 . A 194 ILE H . 34088 1 338 . 1 1 194 194 ILE CA C 13 59.375 . . 1 . . 1215 . A 194 ILE CA . 34088 1 339 . 1 1 194 194 ILE N N 15 117.525 . . 1 . . 1214 . A 194 ILE N . 34088 1 340 . 1 1 195 195 ARG H H 1 9.530 0.013 . 1 . . 846 . A 195 ARG H . 34088 1 341 . 1 1 195 195 ARG CA C 13 55.249 . . 1 . . 451 . A 195 ARG CA . 34088 1 342 . 1 1 195 195 ARG N N 15 126.295 0.055 . 1 . . 845 . A 195 ARG N . 34088 1 343 . 1 1 196 196 ALA H H 1 8.646 0.038 . 1 . . 715 . A 196 ALA H . 34088 1 344 . 1 1 196 196 ALA CA C 13 50.043 . . 1 . . 245 . A 196 ALA CA . 34088 1 345 . 1 1 196 196 ALA N N 15 124.821 0.165 . 1 . . 258 . A 196 ALA N . 34088 1 346 . 1 1 197 197 TYR H H 1 9.709 0.008 . 1 . . 671 . A 197 TYR H . 34088 1 347 . 1 1 197 197 TYR CA C 13 56.256 . . 1 . . 296 . A 197 TYR CA . 34088 1 348 . 1 1 197 197 TYR N N 15 117.645 0.034 . 1 . . 297 . A 197 TYR N . 34088 1 349 . 1 1 198 198 LEU H H 1 8.319 0.004 . 1 . . 723 . A 198 LEU H . 34088 1 350 . 1 1 198 198 LEU CA C 13 51.904 . . 1 . . 102 . A 198 LEU CA . 34088 1 351 . 1 1 198 198 LEU N N 15 123.553 0.025 . 1 . . 494 . A 198 LEU N . 34088 1 352 . 1 1 200 200 LEU H H 1 9.590 0.017 . 1 . . 790 . A 200 LEU H . 34088 1 353 . 1 1 200 200 LEU CA C 13 53.432 . . 1 . . 791 . A 200 LEU CA . 34088 1 354 . 1 1 200 200 LEU N N 15 126.847 0.087 . 1 . . 788 . A 200 LEU N . 34088 1 355 . 1 1 201 201 THR H H 1 9.760 0.027 . 1 . . 769 . A 201 THR H . 34088 1 356 . 1 1 201 201 THR CA C 13 61.914 . . 1 . . 16 . A 201 THR CA . 34088 1 357 . 1 1 201 201 THR N N 15 122.436 0.032 . 1 . . 135 . A 201 THR N . 34088 1 358 . 1 1 202 202 LEU H H 1 8.491 0.018 . 1 . . 760 . A 202 LEU H . 34088 1 359 . 1 1 202 202 LEU CA C 13 52.456 . . 1 . . 99 . A 202 LEU CA . 34088 1 360 . 1 1 202 202 LEU N N 15 128.157 0.096 . 1 . . 489 . A 202 LEU N . 34088 1 361 . 1 1 203 203 GLY H H 1 8.707 0.013 . 1 . . 740 . A 203 GLY H . 34088 1 362 . 1 1 203 203 GLY CA C 13 47.689 . . 1 . . 365 . A 203 GLY CA . 34088 1 363 . 1 1 203 203 GLY N N 15 111.894 0.072 . 1 . . 366 . A 203 GLY N . 34088 1 364 . 1 1 204 204 ASN H H 1 9.586 0.012 . 1 . . 1173 . A 204 ASN H . 34088 1 365 . 1 1 204 204 ASN CA C 13 54.909 . . 1 . . 703 . A 204 ASN CA . 34088 1 366 . 1 1 204 204 ASN N N 15 127.024 0.025 . 1 . . 1174 . A 204 ASN N . 34088 1 367 . 1 1 205 205 HIS H H 1 8.502 0.011 . 1 . . 957 . A 205 HIS H . 34088 1 368 . 1 1 205 205 HIS CA C 13 55.967 . . 1 . . 177 . A 205 HIS CA . 34088 1 369 . 1 1 205 205 HIS N N 15 121.198 0.039 . 1 . . 353 . A 205 HIS N . 34088 1 370 . 1 1 206 206 SER H H 1 9.487 0.006 . 1 . . 823 . A 206 SER H . 34088 1 371 . 1 1 206 206 SER CA C 13 58.135 . . 1 . . 412 . A 206 SER CA . 34088 1 372 . 1 1 206 206 SER N N 15 120.521 0.116 . 1 . . 413 . A 206 SER N . 34088 1 373 . 1 1 207 207 VAL H H 1 8.768 0.06 . 1 . . 958 . A 207 VAL H . 34088 1 374 . 1 1 207 207 VAL CA C 13 61.304 . . 1 . . 743 . A 207 VAL CA . 34088 1 375 . 1 1 207 207 VAL N N 15 124.086 0.027 . 1 . . 912 . A 207 VAL N . 34088 1 376 . 1 1 208 208 THR H H 1 10.121 0.018 . 1 . . 709 . A 208 THR H . 34088 1 377 . 1 1 208 208 THR CA C 13 59.415 . . 1 . . 35 . A 208 THR CA . 34088 1 378 . 1 1 208 208 THR N N 15 121.951 0.039 . 1 . . 467 . A 208 THR N . 34088 1 379 . 1 1 210 210 TYR H H 1 8.979 0.004 . 1 . . 901 . A 210 TYR H . 34088 1 380 . 1 1 210 210 TYR CA C 13 57.329 . . 1 . . 595 . A 210 TYR CA . 34088 1 381 . 1 1 210 210 TYR N N 15 118.422 0.017 . 1 . . 596 . A 210 TYR N . 34088 1 382 . 1 1 211 211 THR H H 1 9.052 0.04 . 1 . . 753 . A 211 THR H . 34088 1 383 . 1 1 211 211 THR CA C 13 59.328 . . 1 . . 39 . A 211 THR CA . 34088 1 384 . 1 1 211 211 THR N N 15 111.418 0.047 . 1 . . 752 . A 211 THR N . 34088 1 385 . 1 1 238 238 GLY H H 1 8.298 0.01 . 1 . . 885 . A 238 GLY H . 34088 1 386 . 1 1 238 238 GLY CA C 13 45.954 . . 1 . . 884 . A 238 GLY CA . 34088 1 387 . 1 1 238 238 GLY N N 15 110.498 0.061 . 1 . . 883 . A 238 GLY N . 34088 1 388 . 1 1 239 239 LEU H H 1 9.187 0.044 . 1 . . 776 . A 239 LEU H . 34088 1 389 . 1 1 239 239 LEU CA C 13 55.190 . . 1 . . 127 . A 239 LEU CA . 34088 1 390 . 1 1 239 239 LEU N N 15 117.861 0.13 . 1 . . 535 . A 239 LEU N . 34088 1 391 . 1 1 240 240 PHE H H 1 8.251 0.0 . 1 . . 985 . A 240 PHE H . 34088 1 392 . 1 1 240 240 PHE CA C 13 57.118 . . 1 . . 1156 . A 240 PHE CA . 34088 1 393 . 1 1 240 240 PHE N N 15 124.804 0.155 . 1 . . 984 . A 240 PHE N . 34088 1 394 . 1 1 241 241 TYR H H 1 9.377 0.05 . 1 . . 787 . A 241 TYR H . 34088 1 395 . 1 1 241 241 TYR CA C 13 56.905 . . 1 . . 910 . A 241 TYR CA . 34088 1 396 . 1 1 241 241 TYR N N 15 130.105 0.132 . 1 . . 342 . A 241 TYR N . 34088 1 397 . 1 1 242 242 GLY H H 1 8.714 0.005 . 1 . . 830 . A 242 GLY H . 34088 1 398 . 1 1 242 242 GLY CA C 13 44.433 . . 1 . . 389 . A 242 GLY CA . 34088 1 399 . 1 1 242 242 GLY N N 15 113.574 0.062 . 1 . . 390 . A 242 GLY N . 34088 1 400 . 1 1 243 243 TYR H H 1 8.192 0.005 . 1 . . 718 . A 243 TYR H . 34088 1 401 . 1 1 243 243 TYR CA C 13 58.479 . . 1 . . 600 . A 243 TYR CA . 34088 1 402 . 1 1 243 243 TYR N N 15 118.580 0.044 . 1 . . 599 . A 243 TYR N . 34088 1 403 . 1 1 244 244 ASP H H 1 6.553 0.009 . 1 . . 1057 . A 244 ASP H . 34088 1 404 . 1 1 244 244 ASP CA C 13 52.852 . . 1 . . 814 . A 244 ASP CA . 34088 1 405 . 1 1 244 244 ASP N N 15 125.877 0.027 . 1 . . 1056 . A 244 ASP N . 34088 1 406 . 1 1 245 245 PHE H H 1 8.731 0.007 . 1 . . 1106 . A 245 PHE H . 34088 1 407 . 1 1 245 245 PHE CA C 13 60.661 . . 1 . . 324 . A 245 PHE CA . 34088 1 408 . 1 1 245 245 PHE N N 15 121.042 0.066 . 1 . . 323 . A 245 PHE N . 34088 1 409 . 1 1 250 250 SER H H 1 9.816 0.018 . 1 . . 881 . A 250 SER H . 34088 1 410 . 1 1 250 250 SER CA C 13 58.236 . . 1 . . 523 . A 250 SER CA . 34088 1 411 . 1 1 250 250 SER N N 15 119.431 0.021 . 1 . . 880 . A 250 SER N . 34088 1 412 . 1 1 251 251 VAL H H 1 8.975 0.005 . 1 . . 978 . A 251 VAL H . 34088 1 413 . 1 1 251 251 VAL CA C 13 59.418 . . 1 . . 526 . A 251 VAL CA . 34088 1 414 . 1 1 251 251 VAL N N 15 114.272 0.15 . 1 . . 527 . A 251 VAL N . 34088 1 415 . 1 1 252 252 SER H H 1 9.456 0.015 . 1 . . 741 . A 252 SER H . 34088 1 416 . 1 1 252 252 SER CA C 13 57.535 . . 1 . . 409 . A 252 SER CA . 34088 1 417 . 1 1 252 252 SER N N 15 119.170 0.042 . 1 . . 410 . A 252 SER N . 34088 1 418 . 1 1 253 253 LEU H H 1 9.688 0.003 . 1 . . 925 . A 253 LEU H . 34088 1 419 . 1 1 253 253 LEU CA C 13 54.905 . . 1 . . 123 . A 253 LEU CA . 34088 1 420 . 1 1 253 253 LEU N N 15 121.479 0.012 . 1 . . 539 . A 253 LEU N . 34088 1 421 . 1 1 254 254 GLU H H 1 9.268 0.026 . 1 . . 1191 . A 254 GLU H . 34088 1 422 . 1 1 254 254 GLU CA C 13 55.462 . . 1 . . 1189 . A 254 GLU CA . 34088 1 423 . 1 1 254 254 GLU N N 15 122.330 0.025 . 1 . . 1190 . A 254 GLU N . 34088 1 424 . 1 1 255 255 TYR H H 1 8.561 0.015 . 1 . . 1085 . A 255 TYR H . 34088 1 425 . 1 1 255 255 TYR CA C 13 57.113 . . 1 . . 1084 . A 255 TYR CA . 34088 1 426 . 1 1 255 255 TYR N N 15 123.537 0.032 . 1 . . 1083 . A 255 TYR N . 34088 1 427 . 1 1 274 274 GLY H H 1 8.955 0.006 . 1 . . 667 . A 274 GLY H . 34088 1 428 . 1 1 274 274 GLY CA C 13 46.611 . . 1 . . 379 . A 274 GLY CA . 34088 1 429 . 1 1 274 274 GLY N N 15 104.933 0.146 . 1 . . 380 . A 274 GLY N . 34088 1 430 . 1 1 275 275 VAL H H 1 8.993 0.0 . 1 . . 1162 . A 275 VAL H . 34088 1 431 . 1 1 275 275 VAL CA C 13 59.672 . . 1 . . 636 . A 275 VAL CA . 34088 1 432 . 1 1 275 275 VAL N N 15 120.381 0.002 . 1 . . 635 . A 275 VAL N . 34088 1 433 . 1 1 276 276 GLY H H 1 9.182 0.011 . 1 . . 975 . A 276 GLY H . 34088 1 434 . 1 1 276 276 GLY CA C 13 46.092 . . 1 . . 370 . A 276 GLY CA . 34088 1 435 . 1 1 276 276 GLY N N 15 111.682 0.058 . 1 . . 371 . A 276 GLY N . 34088 1 436 . 1 1 277 277 VAL H H 1 8.891 0.019 . 1 . . 1129 . A 277 VAL H . 34088 1 437 . 1 1 277 277 VAL CA C 13 60.200 . . 1 . . 1208 . A 277 VAL CA . 34088 1 438 . 1 1 277 277 VAL N N 15 115.893 0.193 . 1 . . 998 . A 277 VAL N . 34088 1 439 . 1 1 278 278 ASN H H 1 9.087 0.034 . 1 . . 1131 . A 278 ASN H . 34088 1 440 . 1 1 278 278 ASN CA C 13 53.602 . . 1 . . 1200 . A 278 ASN CA . 34088 1 441 . 1 1 278 278 ASN N N 15 123.625 0.058 . 1 . . 1130 . A 278 ASN N . 34088 1 442 . 1 1 279 279 TYR H H 1 10.120 0.016 . 1 . . 980 . A 279 TYR H . 34088 1 443 . 1 1 279 279 TYR CA C 13 57.302 . . 1 . . 1210 . A 279 TYR CA . 34088 1 444 . 1 1 279 279 TYR N N 15 126.573 0.077 . 1 . . 979 . A 279 TYR N . 34088 1 445 . 1 1 280 280 SER H H 1 8.318 . . 1 . . 986 . A 280 SER H . 34088 1 446 . 1 1 280 280 SER CA C 13 56.352 . . 1 . . 407 . A 280 SER CA . 34088 1 447 . 1 1 280 280 SER N N 15 123.736 . . 1 . . 1223 . A 280 SER N . 34088 1 448 . 1 1 281 281 PHE H H 1 8.865 0.017 . 1 . . 1222 . A 281 PHE H . 34088 1 449 . 1 1 281 281 PHE CA C 13 58.674 . . 1 . . 1248 . A 281 PHE CA . 34088 1 450 . 1 1 281 281 PHE N N 15 127.121 0.034 . 1 . . 1250 . A 281 PHE N . 34088 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_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 34088 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details ; Chemical shift list corresponding to 13C-detected experiments. List contains 15N, and 13C chemical shifts including side-chain 13C. ; _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D (H)N(HH)NH RFDR 2ms' . . . 34088 2 2 '3D (H)NHH RFDR 2ms' . . . 34088 2 3 '2D 13C-13C DARR 200ms' . . . 34088 2 4 '2D 13C-13C DARR 400ms' . . . 34088 2 5 '2D 13C-13C DARR 200ms' . . . 34088 2 6 '2D 13C-13C DARR 400ms' . . . 34088 2 7 '2D 13C-13C DARR 400ms' . . . 34088 2 8 '2D 13C-13C DARR 150ms' . . . 34088 2 9 '2D 13C-13C DARR 150ms' . . . 34088 2 10 '2D 13C-13C DARR 400ms' . . . 34088 2 11 '2D 13C-13C DARR 150ms' . . . 34088 2 12 '2D 13C-13C DARR 400ms' . . . 34088 2 13 '2D 13C-13C DARR 500ms' . . . 34088 2 14 '3D (H)CANH' . . . 34088 2 15 '3D (H)CANH' . . . 34088 2 16 '3D (HCO)CA(CO)NH' . . . 34088 2 17 '3D (HCA)CB(CA)NH' . . . 34088 2 18 '3D (HCA)CBCA(CO)NH' . . . 34088 2 19 '3D (H)CONH' . . . 34088 2 20 '3D (H)CO(CA)NH' . . . 34088 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 8 8 HIS C C 13 174.144 0.175 . 1 . . 1253 . A 8 HIS C . 34088 2 2 . 1 1 8 8 HIS CA C 13 54.998 0.092 . 1 . . 168 . A 8 HIS CA . 34088 2 3 . 1 1 8 8 HIS CB C 13 31.763 0.156 . 1 . . 167 . A 8 HIS CB . 34088 2 4 . 1 1 8 8 HIS CG C 13 131.265 0.154 . 1 . . 169 . A 8 HIS CG . 34088 2 5 . 1 1 8 8 HIS CD2 C 13 120.988 0.119 . 1 . . 170 . A 8 HIS CD2 . 34088 2 6 . 1 1 8 8 HIS N N 15 118.404 0.264 . 1 . . 1219 . A 8 HIS N . 34088 2 7 . 1 1 9 9 PHE CA C 13 57.116 0.08 . 1 . . 1204 . A 9 PHE CA . 34088 2 8 . 1 1 9 9 PHE CB C 13 43.362 0.105 . 1 . . 1205 . A 9 PHE CB . 34088 2 9 . 1 1 9 9 PHE CG C 13 139.701 0.069 . 1 . . 1284 . A 9 PHE CG . 34088 2 10 . 1 1 9 9 PHE N N 15 123.680 0.445 . 1 . . 1227 . A 9 PHE N . 34088 2 11 . 1 1 10 10 ASN C C 13 173.879 . . 1 . . 1263 . A 10 ASN C . 34088 2 12 . 1 1 10 10 ASN CA C 13 54.186 0.17 . 1 . . 1199 . A 10 ASN CA . 34088 2 13 . 1 1 10 10 ASN CB C 13 44.096 0.097 . 1 . . 1198 . A 10 ASN CB . 34088 2 14 . 1 1 10 10 ASN CG C 13 178.500 . . 1 . . 1282 . A 10 ASN CG . 34088 2 15 . 1 1 10 10 ASN N N 15 117.511 0.216 . 1 . . 1007 . A 10 ASN N . 34088 2 16 . 1 1 11 11 ILE C C 13 175.451 0.114 . 1 . . 1268 . A 11 ILE C . 34088 2 17 . 1 1 11 11 ILE CA C 13 59.663 0.106 . 1 . . 215 . A 11 ILE CA . 34088 2 18 . 1 1 11 11 ILE CB C 13 43.476 0.077 . 1 . . 214 . A 11 ILE CB . 34088 2 19 . 1 1 11 11 ILE CG1 C 13 27.998 0.209 . 1 . . 216 . A 11 ILE CG1 . 34088 2 20 . 1 1 11 11 ILE CG2 C 13 18.897 0.124 . 1 . . 217 . A 11 ILE CG2 . 34088 2 21 . 1 1 11 11 ILE CD1 C 13 14.460 0.097 . 1 . . 218 . A 11 ILE CD1 . 34088 2 22 . 1 1 12 12 GLY C C 13 170.370 0.087 . 1 . . 766 . A 12 GLY C . 34088 2 23 . 1 1 12 12 GLY CA C 13 47.105 0.124 . 1 . . 725 . A 12 GLY CA . 34088 2 24 . 1 1 12 12 GLY N N 15 109.727 0.251 . 1 . . 604 . A 12 GLY N . 34088 2 25 . 1 1 13 13 ALA C C 13 176.089 0.138 . 1 . . 271 . A 13 ALA C . 34088 2 26 . 1 1 13 13 ALA CA C 13 51.073 0.127 . 1 . . 261 . A 13 ALA CA . 34088 2 27 . 1 1 13 13 ALA CB C 13 24.120 0.079 . 1 . . 260 . A 13 ALA CB . 34088 2 28 . 1 1 13 13 ALA N N 15 116.544 0.347 . 1 . . 262 . A 13 ALA N . 34088 2 29 . 1 1 14 14 MET CA C 13 55.078 0.055 . 1 . . 1144 . A 14 MET CA . 34088 2 30 . 1 1 14 14 MET CB C 13 37.752 0.286 . 1 . . 682 . A 14 MET CB . 34088 2 31 . 1 1 14 14 MET CG C 13 32.660 0.127 . 1 . . 70 . A 14 MET CG . 34088 2 32 . 1 1 14 14 MET CE C 13 17.072 0.1 . 1 . . 681 . A 14 MET CE . 34088 2 33 . 1 1 15 15 TYR CA C 13 59.582 0.065 . 1 . . 331 . A 15 TYR CA . 34088 2 34 . 1 1 15 15 TYR CB C 13 42.930 0.145 . 1 . . 333 . A 15 TYR CB . 34088 2 35 . 1 1 15 15 TYR CG C 13 132.798 0.101 . 1 . . 332 . A 15 TYR CG . 34088 2 36 . 1 1 15 15 TYR N N 15 122.752 0.368 . 1 . . 330 . A 15 TYR N . 34088 2 37 . 1 1 31 31 ALA C C 13 178.899 0.12 . 1 . . 1194 . A 31 ALA C . 34088 2 38 . 1 1 31 31 ALA CA C 13 51.820 0.079 . 1 . . 249 . A 31 ALA CA . 34088 2 39 . 1 1 31 31 ALA CB C 13 22.056 0.139 . 1 . . 248 . A 31 ALA CB . 34088 2 40 . 1 1 31 31 ALA N N 15 124.392 0.425 . 1 . . 273 . A 31 ALA N . 34088 2 41 . 1 1 32 32 GLU CA C 13 52.410 0.109 . 1 . . 1123 . A 32 GLU CA . 34088 2 42 . 1 1 32 32 GLU CB C 13 29.108 0.095 . 1 . . 651 . A 32 GLU CB . 34088 2 43 . 1 1 32 32 GLU CG C 13 32.404 0.027 . 1 . . 650 . A 32 GLU CG . 34088 2 44 . 1 1 33 33 PRO C C 13 175.844 0.067 . 1 . . 625 . A 33 PRO C . 34088 2 45 . 1 1 33 33 PRO CA C 13 62.497 0.064 . 1 . . 48 . A 33 PRO CA . 34088 2 46 . 1 1 33 33 PRO CB C 13 33.603 0.22 . 1 . . 46 . A 33 PRO CB . 34088 2 47 . 1 1 33 33 PRO CG C 13 27.141 0.104 . 1 . . 485 . A 33 PRO CG . 34088 2 48 . 1 1 33 33 PRO CD C 13 49.464 0.071 . 1 . . 47 . A 33 PRO CD . 34088 2 49 . 1 1 33 33 PRO N N 15 141.111 0.245 . 1 . . 501 . A 33 PRO N . 34088 2 50 . 1 1 34 34 SER C C 13 173.665 0.161 . 1 . . 626 . A 34 SER C . 34088 2 51 . 1 1 34 34 SER CA C 13 58.834 0.122 . 1 . . 417 . A 34 SER CA . 34088 2 52 . 1 1 34 34 SER CB C 13 67.396 0.15 . 1 . . 416 . A 34 SER CB . 34088 2 53 . 1 1 34 34 SER N N 15 110.293 0.23 . 1 . . 418 . A 34 SER N . 34088 2 54 . 1 1 35 35 VAL CA C 13 59.548 0.238 . 1 . . 628 . A 35 VAL CA . 34088 2 55 . 1 1 35 35 VAL CB C 13 36.169 0.148 . 1 . . 629 . A 35 VAL CB . 34088 2 56 . 1 1 35 35 VAL CG1 C 13 21.301 0.107 . 1 . . 630 . A 35 VAL CG1 . 34088 2 57 . 1 1 35 35 VAL N N 15 111.352 0.211 . 1 . . 627 . A 35 VAL N . 34088 2 58 . 1 1 36 36 TYR CA C 13 57.059 0.139 . 1 . . 312 . A 36 TYR CA . 34088 2 59 . 1 1 36 36 TYR CB C 13 42.373 0.116 . 1 . . 311 . A 36 TYR CB . 34088 2 60 . 1 1 36 36 TYR CG C 13 130.696 0.082 . 1 . . 314 . A 36 TYR CG . 34088 2 61 . 1 1 36 36 TYR N N 15 118.563 0.267 . 1 . . 313 . A 36 TYR N . 34088 2 62 . 1 1 37 37 PHE CA C 13 56.476 0.124 . 1 . . 307 . A 37 PHE CA . 34088 2 63 . 1 1 37 37 PHE CB C 13 45.307 0.06 . 1 . . 306 . A 37 PHE CB . 34088 2 64 . 1 1 37 37 PHE CG C 13 139.459 0.01 . 1 . . 1228 . A 37 PHE CG . 34088 2 65 . 1 1 37 37 PHE N N 15 118.554 . . 1 . . 308 . A 37 PHE N . 34088 2 66 . 1 1 38 38 ASN C C 13 172.085 0.094 . 1 . . 545 . A 38 ASN C . 34088 2 67 . 1 1 38 38 ASN CA C 13 53.131 0.093 . 1 . . 862 . A 38 ASN CA . 34088 2 68 . 1 1 38 38 ASN CB C 13 42.729 0.099 . 1 . . 546 . A 38 ASN CB . 34088 2 69 . 1 1 38 38 ASN N N 15 121.480 0.06 . 1 . . 1267 . A 38 ASN N . 34088 2 70 . 1 1 39 39 ALA C C 13 175.306 0.124 . 1 . . 270 . A 39 ALA C . 34088 2 71 . 1 1 39 39 ALA CA C 13 51.079 0.08 . 1 . . 257 . A 39 ALA CA . 34088 2 72 . 1 1 39 39 ALA CB C 13 25.184 0.082 . 1 . . 256 . A 39 ALA CB . 34088 2 73 . 1 1 39 39 ALA N N 15 119.926 0.291 . 1 . . 259 . A 39 ALA N . 34088 2 74 . 1 1 40 40 ALA C C 13 175.939 0.033 . 1 . . 573 . A 40 ALA C . 34088 2 75 . 1 1 40 40 ALA CA C 13 51.262 0.16 . 1 . . 266 . A 40 ALA CA . 34088 2 76 . 1 1 40 40 ALA CB C 13 24.057 0.119 . 1 . . 265 . A 40 ALA CB . 34088 2 77 . 1 1 40 40 ALA N N 15 123.233 0.296 . 1 . . 267 . A 40 ALA N . 34088 2 78 . 1 1 41 41 ASN C C 13 175.447 0.089 . 1 . . 1266 . A 41 ASN C . 34088 2 79 . 1 1 41 41 ASN CA C 13 53.253 0.168 . 1 . . 727 . A 41 ASN CA . 34088 2 80 . 1 1 41 41 ASN CB C 13 39.321 0.181 . 1 . . 824 . A 41 ASN CB . 34088 2 81 . 1 1 42 42 GLY C C 13 174.149 0.084 . 1 . . 384 . A 42 GLY C . 34088 2 82 . 1 1 42 42 GLY CA C 13 45.409 0.096 . 1 . . 385 . A 42 GLY CA . 34088 2 83 . 1 1 42 42 GLY N N 15 116.748 0.129 . 1 . . 386 . A 42 GLY N . 34088 2 84 . 1 1 43 43 PRO C C 13 176.409 0.108 . 1 . . 970 . A 43 PRO C . 34088 2 85 . 1 1 43 43 PRO CA C 13 63.657 0.119 . 1 . . 59 . A 43 PRO CA . 34088 2 86 . 1 1 43 43 PRO CB C 13 32.469 0.075 . 1 . . 57 . A 43 PRO CB . 34088 2 87 . 1 1 43 43 PRO CG C 13 26.623 0.036 . 1 . . 486 . A 43 PRO CG . 34088 2 88 . 1 1 43 43 PRO CD C 13 51.190 0.052 . 1 . . 58 . A 43 PRO CD . 34088 2 89 . 1 1 43 43 PRO N N 15 137.228 . . 1 . . 75 . A 43 PRO N . 34088 2 90 . 1 1 44 44 TRP C C 13 177.622 0.069 . 1 . . 190 . A 44 TRP C . 34088 2 91 . 1 1 44 44 TRP CA C 13 57.630 0.085 . 1 . . 149 . A 44 TRP CA . 34088 2 92 . 1 1 44 44 TRP CB C 13 33.430 0.111 . 1 . . 148 . A 44 TRP CB . 34088 2 93 . 1 1 44 44 TRP CG C 13 112.641 0.101 . 1 . . 152 . A 44 TRP CG . 34088 2 94 . 1 1 44 44 TRP CD2 C 13 131.133 0.069 . 1 . . 1235 . A 44 TRP CD2 . 34088 2 95 . 1 1 44 44 TRP CZ3 C 13 121.896 0.094 . 1 . . 1237 . A 44 TRP CZ3 . 34088 2 96 . 1 1 45 45 ARG C C 13 175.007 0.137 . 1 . . 764 . A 45 ARG C . 34088 2 97 . 1 1 45 45 ARG CA C 13 56.568 0.117 . 1 . . 815 . A 45 ARG CA . 34088 2 98 . 1 1 45 45 ARG CB C 13 34.876 0.087 . 1 . . 817 . A 45 ARG CB . 34088 2 99 . 1 1 45 45 ARG CG C 13 28.649 0.08 . 1 . . 440 . A 45 ARG CG . 34088 2 100 . 1 1 45 45 ARG CD C 13 44.038 0.11 . 1 . . 441 . A 45 ARG CD . 34088 2 101 . 1 1 45 45 ARG CZ C 13 159.581 0.057 . 1 . . 701 . A 45 ARG CZ . 34088 2 102 . 1 1 45 45 ARG N N 15 121.757 . . 1 . . 1254 . A 45 ARG N . 34088 2 103 . 1 1 46 46 ILE C C 13 173.574 0.13 . 1 . . 497 . A 46 ILE C . 34088 2 104 . 1 1 46 46 ILE CA C 13 60.922 0.109 . 1 . . 193 . A 46 ILE CA . 34088 2 105 . 1 1 46 46 ILE CB C 13 42.331 0.076 . 1 . . 192 . A 46 ILE CB . 34088 2 106 . 1 1 46 46 ILE CG1 C 13 29.517 0.07 . 1 . . 194 . A 46 ILE CG1 . 34088 2 107 . 1 1 46 46 ILE CG2 C 13 19.089 0.06 . 1 . . 195 . A 46 ILE CG2 . 34088 2 108 . 1 1 46 46 ILE CD1 C 13 15.533 0.081 . 1 . . 196 . A 46 ILE CD1 . 34088 2 109 . 1 1 46 46 ILE N N 15 126.953 0.469 . 1 . . 498 . A 46 ILE N . 34088 2 110 . 1 1 47 47 ALA C C 13 175.583 0.134 . 1 . . 505 . A 47 ALA C . 34088 2 111 . 1 1 47 47 ALA CA C 13 51.725 0.128 . 1 . . 278 . A 47 ALA CA . 34088 2 112 . 1 1 47 47 ALA CB C 13 24.090 0.092 . 1 . . 277 . A 47 ALA CB . 34088 2 113 . 1 1 47 47 ALA N N 15 129.250 0.403 . 1 . . 279 . A 47 ALA N . 34088 2 114 . 1 1 48 48 LEU C C 13 176.551 0.043 . 1 . . 84 . A 48 LEU C . 34088 2 115 . 1 1 48 48 LEU CA C 13 54.338 0.091 . 1 . . 126 . A 48 LEU CA . 34088 2 116 . 1 1 48 48 LEU CB C 13 47.176 0.072 . 1 . . 83 . A 48 LEU CB . 34088 2 117 . 1 1 48 48 LEU CG C 13 28.921 0.07 . 1 . . 82 . A 48 LEU CG . 34088 2 118 . 1 1 48 48 LEU CD1 C 13 25.978 . . 1 . . 1269 . A 48 LEU CD1 . 34088 2 119 . 1 1 48 48 LEU N N 15 122.381 0.262 . 1 . . 504 . A 48 LEU N . 34088 2 120 . 1 1 49 49 ALA C C 13 175.469 0.121 . 1 . . 286 . A 49 ALA C . 34088 2 121 . 1 1 49 49 ALA CA C 13 52.291 0.091 . 1 . . 809 . A 49 ALA CA . 34088 2 122 . 1 1 49 49 ALA CB C 13 24.520 0.105 . 1 . . 808 . A 49 ALA CB . 34088 2 123 . 1 1 49 49 ALA N N 15 122.463 0.095 . 1 . . 285 . A 49 ALA N . 34088 2 124 . 1 1 50 50 TYR CA C 13 60.067 0.041 . 1 . . 320 . A 50 TYR CA . 34088 2 125 . 1 1 50 50 TYR CB C 13 42.184 0.084 . 1 . . 319 . A 50 TYR CB . 34088 2 126 . 1 1 50 50 TYR CG C 13 129.073 0.141 . 1 . . 322 . A 50 TYR CG . 34088 2 127 . 1 1 50 50 TYR N N 15 118.271 0.079 . 1 . . 321 . A 50 TYR N . 34088 2 128 . 1 1 51 51 TYR CA C 13 55.394 0.145 . 1 . . 292 . A 51 TYR CA . 34088 2 129 . 1 1 51 51 TYR CB C 13 43.409 0.063 . 1 . . 291 . A 51 TYR CB . 34088 2 130 . 1 1 51 51 TYR CG C 13 128.422 0.163 . 1 . . 294 . A 51 TYR CG . 34088 2 131 . 1 1 51 51 TYR N N 15 128.214 0.146 . 1 . . 293 . A 51 TYR N . 34088 2 132 . 1 1 52 52 GLN CA C 13 54.910 . . 1 . . 1387 . A 52 GLN CA . 34088 2 133 . 1 1 52 52 GLN CB C 13 35.771 . . 1 . . 1386 . A 52 GLN CB . 34088 2 134 . 1 1 67 67 PHE CA C 13 56.328 0.052 . 1 . . 1176 . A 67 PHE CA . 34088 2 135 . 1 1 67 67 PHE CB C 13 42.116 0.0 . 1 . . 299 . A 67 PHE CB . 34088 2 136 . 1 1 67 67 PHE CG C 13 139.114 0.052 . 1 . . 301 . A 67 PHE CG . 34088 2 137 . 1 1 67 67 PHE N N 15 114.055 0.352 . 1 . . 300 . A 67 PHE N . 34088 2 138 . 1 1 68 68 ASP CA C 13 52.192 0.159 . 1 . . 1175 . A 68 ASP CA . 34088 2 139 . 1 1 68 68 ASP CB C 13 42.787 . . 1 . . 1202 . A 68 ASP CB . 34088 2 140 . 1 1 69 69 ARG C C 13 174.450 0.214 . 1 . . 549 . A 69 ARG C . 34088 2 141 . 1 1 69 69 ARG CA C 13 53.755 0.08 . 1 . . 427 . A 69 ARG CA . 34088 2 142 . 1 1 69 69 ARG CB C 13 36.482 0.119 . 1 . . 426 . A 69 ARG CB . 34088 2 143 . 1 1 69 69 ARG CG C 13 26.889 0.046 . 1 . . 429 . A 69 ARG CG . 34088 2 144 . 1 1 69 69 ARG CD C 13 44.810 0.09 . 1 . . 428 . A 69 ARG CD . 34088 2 145 . 1 1 69 69 ARG CZ C 13 159.360 0.435 . 1 . . 1257 . A 69 ARG CZ . 34088 2 146 . 1 1 69 69 ARG N N 15 118.320 . . 1 . . 1255 . A 69 ARG N . 34088 2 147 . 1 1 70 70 PRO C C 13 176.035 . . 1 . . 1179 . A 70 PRO C . 34088 2 148 . 1 1 70 70 PRO CA C 13 63.535 0.093 . 1 . . 53 . A 70 PRO CA . 34088 2 149 . 1 1 70 70 PRO CB C 13 33.794 0.1 . 1 . . 1177 . A 70 PRO CB . 34088 2 150 . 1 1 70 70 PRO CG C 13 28.492 0.092 . 1 . . 487 . A 70 PRO CG . 34088 2 151 . 1 1 70 70 PRO CD C 13 50.827 0.127 . 1 . . 52 . A 70 PRO CD . 34088 2 152 . 1 1 70 70 PRO N N 15 139.695 0.183 . 1 . . 74 . A 70 PRO N . 34088 2 153 . 1 1 71 71 GLU CA C 13 55.276 0.127 . 1 . . 907 . A 71 GLU CA . 34088 2 154 . 1 1 72 72 LEU C C 13 174.726 0.065 . 1 . . 1178 . A 72 LEU C . 34088 2 155 . 1 1 72 72 LEU CA C 13 54.662 0.065 . 1 . . 982 . A 72 LEU CA . 34088 2 156 . 1 1 72 72 LEU CB C 13 47.982 0.193 . 1 . . 119 . A 72 LEU CB . 34088 2 157 . 1 1 72 72 LEU CG C 13 28.431 0.094 . 1 . . 118 . A 72 LEU CG . 34088 2 158 . 1 1 72 72 LEU CD1 C 13 26.398 0.024 . 1 . . 513 . A 72 LEU CD1 . 34088 2 159 . 1 1 73 73 GLU CA C 13 55.864 0.128 . 1 . . 543 . A 73 GLU CA . 34088 2 160 . 1 1 73 73 GLU CG C 13 37.825 0.081 . 1 . . 542 . A 73 GLU CG . 34088 2 161 . 1 1 73 73 GLU N N 15 122.089 0.073 . 1 . . 544 . A 73 GLU N . 34088 2 162 . 1 1 74 74 VAL C C 13 173.634 . . 1 . . 765 . A 74 VAL C . 34088 2 163 . 1 1 74 74 VAL CA C 13 61.046 0.12 . 1 . . 689 . A 74 VAL CA . 34088 2 164 . 1 1 74 74 VAL CB C 13 36.019 0.104 . 1 . . 686 . A 74 VAL CB . 34088 2 165 . 1 1 74 74 VAL CG1 C 13 22.100 0.062 . 1 . . 687 . A 74 VAL CG1 . 34088 2 166 . 1 1 75 75 HIS C C 13 172.716 0.179 . 1 . . 187 . A 75 HIS C . 34088 2 167 . 1 1 75 75 HIS CA C 13 54.586 0.095 . 1 . . 172 . A 75 HIS CA . 34088 2 168 . 1 1 75 75 HIS CB C 13 32.578 0.17 . 1 . . 171 . A 75 HIS CB . 34088 2 169 . 1 1 75 75 HIS CG C 13 130.902 0.168 . 1 . . 173 . A 75 HIS CG . 34088 2 170 . 1 1 75 75 HIS CD2 C 13 122.136 0.129 . 1 . . 175 . A 75 HIS CD2 . 34088 2 171 . 1 1 75 75 HIS CE1 C 13 135.924 0.137 . 1 . . 174 . A 75 HIS CE1 . 34088 2 172 . 1 1 75 75 HIS N N 15 125.234 0.247 . 1 . . 352 . A 75 HIS N . 34088 2 173 . 1 1 75 75 HIS ND1 N 15 178.244 0.247 . 1 . . 356 . A 75 HIS ND1 . 34088 2 174 . 1 1 75 75 HIS NE2 N 15 178.370 . . 1 . . 571 . A 75 HIS NE2 . 34088 2 175 . 1 1 76 76 TYR CA C 13 57.031 0.228 . 1 . . 358 . A 76 TYR CA . 34088 2 176 . 1 1 76 76 TYR CB C 13 42.542 0.194 . 1 . . 357 . A 76 TYR CB . 34088 2 177 . 1 1 76 76 TYR CG C 13 129.788 . . 1 . . 360 . A 76 TYR CG . 34088 2 178 . 1 1 76 76 TYR N N 15 125.748 0.822 . 1 . . 359 . A 76 TYR N . 34088 2 179 . 1 1 77 77 GLN C C 13 173.787 0.05 . 1 . . 873 . A 77 GLN C . 34088 2 180 . 1 1 77 77 GLN CA C 13 54.089 0.075 . 1 . . 785 . A 77 GLN CA . 34088 2 181 . 1 1 77 77 GLN CB C 13 28.896 0.217 . 1 . . 799 . A 77 GLN CB . 34088 2 182 . 1 1 77 77 GLN CG C 13 33.498 0.096 . 1 . . 1103 . A 77 GLN CG . 34088 2 183 . 1 1 77 77 GLN CD C 13 179.656 0.014 . 1 . . 1246 . A 77 GLN CD . 34088 2 184 . 1 1 77 77 GLN N N 15 129.134 0.213 . 1 . . 784 . A 77 GLN N . 34088 2 185 . 1 1 78 78 PHE CA C 13 62.485 0.061 . 1 . . 1126 . A 78 PHE CA . 34088 2 186 . 1 1 78 78 PHE CB C 13 41.225 0.059 . 1 . . 344 . A 78 PHE CB . 34088 2 187 . 1 1 78 78 PHE CG C 13 140.427 0.157 . 1 . . 345 . A 78 PHE CG . 34088 2 188 . 1 1 78 78 PHE N N 15 125.826 0.059 . 1 . . 1127 . A 78 PHE N . 34088 2 189 . 1 1 85 85 SER CA C 13 58.004 0.147 . 1 . . 419 . A 85 SER CA . 34088 2 190 . 1 1 85 85 SER CB C 13 66.738 0.098 . 1 . . 1273 . A 85 SER CB . 34088 2 191 . 1 1 86 86 PHE CA C 13 58.656 0.136 . 1 . . 346 . A 86 PHE CA . 34088 2 192 . 1 1 86 86 PHE CB C 13 45.017 0.051 . 1 . . 1287 . A 86 PHE CB . 34088 2 193 . 1 1 86 86 PHE CG C 13 139.320 0.134 . 1 . . 688 . A 86 PHE CG . 34088 2 194 . 1 1 86 86 PHE CE1 C 13 129.913 0.048 . 1 . . 348 . A 86 PHE CE1 . 34088 2 195 . 1 1 86 86 PHE CE2 C 13 129.913 0.048 . 1 . . 348 . A 86 PHE CE2 . 34088 2 196 . 1 1 86 86 PHE N N 15 121.070 0.101 . 1 . . 347 . A 86 PHE N . 34088 2 197 . 1 1 87 87 GLY C C 13 170.194 0.133 . 1 . . 387 . A 87 GLY C . 34088 2 198 . 1 1 87 87 GLY CA C 13 45.422 0.105 . 1 . . 388 . A 87 GLY CA . 34088 2 199 . 1 1 87 87 GLY N N 15 117.857 . . 1 . . 1113 . A 87 GLY N . 34088 2 200 . 1 1 88 88 LEU C C 13 174.155 0.085 . 1 . . 78 . A 88 LEU C . 34088 2 201 . 1 1 88 88 LEU CA C 13 54.679 0.137 . 1 . . 87 . A 88 LEU CA . 34088 2 202 . 1 1 88 88 LEU CB C 13 49.473 0.079 . 1 . . 77 . A 88 LEU CB . 34088 2 203 . 1 1 88 88 LEU CG C 13 27.609 0.078 . 1 . . 76 . A 88 LEU CG . 34088 2 204 . 1 1 88 88 LEU CD1 C 13 24.086 0.064 . 1 . . 506 . A 88 LEU CD1 . 34088 2 205 . 1 1 88 88 LEU N N 15 116.788 0.146 . 1 . . 522 . A 88 LEU N . 34088 2 206 . 1 1 89 89 THR C C 13 174.559 0.126 . 1 . . 531 . A 89 THR C . 34088 2 207 . 1 1 89 89 THR CA C 13 62.265 0.071 . 1 . . 20 . A 89 THR CA . 34088 2 208 . 1 1 89 89 THR CB C 13 71.379 0.067 . 1 . . 21 . A 89 THR CB . 34088 2 209 . 1 1 89 89 THR CG2 C 13 22.697 0.149 . 1 . . 19 . A 89 THR CG2 . 34088 2 210 . 1 1 89 89 THR N N 15 121.916 0.177 . 1 . . 465 . A 89 THR N . 34088 2 211 . 1 1 90 90 GLY C C 13 172.949 0.107 . 1 . . 528 . A 90 GLY C . 34088 2 212 . 1 1 90 90 GLY CA C 13 44.661 0.111 . 1 . . 529 . A 90 GLY CA . 34088 2 213 . 1 1 90 90 GLY N N 15 113.158 0.044 . 1 . . 530 . A 90 GLY N . 34088 2 214 . 1 1 91 91 GLY C C 13 170.361 0.091 . 1 . . 367 . A 91 GLY C . 34088 2 215 . 1 1 91 91 GLY CA C 13 46.491 0.136 . 1 . . 368 . A 91 GLY CA . 34088 2 216 . 1 1 91 91 GLY N N 15 109.244 0.235 . 1 . . 369 . A 91 GLY N . 34088 2 217 . 1 1 92 92 PHE C C 13 173.190 0.006 . 1 . . 904 . A 92 PHE C . 34088 2 218 . 1 1 92 92 PHE CA C 13 57.247 0.074 . 1 . . 575 . A 92 PHE CA . 34088 2 219 . 1 1 92 92 PHE CB C 13 44.434 0.136 . 1 . . 574 . A 92 PHE CB . 34088 2 220 . 1 1 92 92 PHE CG C 13 138.569 0.112 . 1 . . 577 . A 92 PHE CG . 34088 2 221 . 1 1 92 92 PHE N N 15 120.502 0.161 . 1 . . 576 . A 92 PHE N . 34088 2 222 . 1 1 93 93 ARG C C 13 175.133 0.165 . 1 . . 551 . A 93 ARG C . 34088 2 223 . 1 1 93 93 ARG CA C 13 54.505 0.095 . 1 . . 435 . A 93 ARG CA . 34088 2 224 . 1 1 93 93 ARG CB C 13 37.322 0.101 . 1 . . 434 . A 93 ARG CB . 34088 2 225 . 1 1 93 93 ARG CG C 13 26.552 0.004 . 1 . . 437 . A 93 ARG CG . 34088 2 226 . 1 1 93 93 ARG CD C 13 44.115 0.105 . 1 . . 436 . A 93 ARG CD . 34088 2 227 . 1 1 93 93 ARG CZ C 13 159.214 0.038 . 1 . . 1259 . A 93 ARG CZ . 34088 2 228 . 1 1 93 93 ARG N N 15 123.133 0.314 . 1 . . 903 . A 93 ARG N . 34088 2 229 . 1 1 94 94 ASN N N 15 118.062 . . 1 . . 826 . A 94 ASN N . 34088 2 230 . 1 1 95 95 TYR CA C 13 56.913 0.134 . 1 . . 857 . A 95 TYR CA . 34088 2 231 . 1 1 95 95 TYR CB C 13 39.136 0.06 . 1 . . 309 . A 95 TYR CB . 34088 2 232 . 1 1 95 95 TYR CG C 13 133.594 0.112 . 1 . . 1247 . A 95 TYR CG . 34088 2 233 . 1 1 95 95 TYR N N 15 122.822 0.053 . 1 . . 310 . A 95 TYR N . 34088 2 234 . 1 1 96 96 GLY C C 13 172.045 0.066 . 1 . . 581 . A 96 GLY C . 34088 2 235 . 1 1 96 96 GLY CA C 13 46.062 0.095 . 1 . . 582 . A 96 GLY CA . 34088 2 236 . 1 1 96 96 GLY N N 15 112.291 0.258 . 1 . . 1116 . A 96 GLY N . 34088 2 237 . 1 1 97 97 TYR CA C 13 59.470 0.112 . 1 . . 327 . A 97 TYR CA . 34088 2 238 . 1 1 97 97 TYR CB C 13 42.455 0.105 . 1 . . 328 . A 97 TYR CB . 34088 2 239 . 1 1 97 97 TYR CG C 13 130.898 0.138 . 1 . . 329 . A 97 TYR CG . 34088 2 240 . 1 1 97 97 TYR N N 15 122.205 0.173 . 1 . . 1121 . A 97 TYR N . 34088 2 241 . 1 1 106 106 ASP CA C 13 56.317 0.208 . 1 . . 679 . A 106 ASP CA . 34088 2 242 . 1 1 106 106 ASP CB C 13 42.643 0.126 . 1 . . 675 . A 106 ASP CB . 34088 2 243 . 1 1 106 106 ASP CG C 13 180.426 0.165 . 1 . . 676 . A 106 ASP CG . 34088 2 244 . 1 1 107 107 THR C C 13 174.515 0.142 . 1 . . 479 . A 107 THR C . 34088 2 245 . 1 1 107 107 THR CA C 13 60.149 0.19 . 1 . . 43 . A 107 THR CA . 34088 2 246 . 1 1 107 107 THR CB C 13 73.594 0.09 . 1 . . 44 . A 107 THR CB . 34088 2 247 . 1 1 107 107 THR CG2 C 13 22.374 0.085 . 1 . . 45 . A 107 THR CG2 . 34088 2 248 . 1 1 108 108 ALA C C 13 175.771 0.207 . 1 . . 284 . A 108 ALA C . 34088 2 249 . 1 1 108 108 ALA CA C 13 52.187 0.167 . 1 . . 282 . A 108 ALA CA . 34088 2 250 . 1 1 108 108 ALA CB C 13 24.206 0.115 . 1 . . 281 . A 108 ALA CB . 34088 2 251 . 1 1 108 108 ALA N N 15 120.413 0.28 . 1 . . 283 . A 108 ALA N . 34088 2 252 . 1 1 109 109 ASN C C 13 171.965 0.139 . 1 . . 1136 . A 109 ASN C . 34088 2 253 . 1 1 109 109 ASN CA C 13 54.405 0.05 . 1 . . 841 . A 109 ASN CA . 34088 2 254 . 1 1 109 109 ASN CB C 13 42.669 0.14 . 1 . . 590 . A 109 ASN CB . 34088 2 255 . 1 1 109 109 ASN N N 15 121.072 . . 1 . . 840 . A 109 ASN N . 34088 2 256 . 1 1 110 110 MET C C 13 175.708 0.041 . 1 . . 1135 . A 110 MET C . 34088 2 257 . 1 1 110 110 MET CA C 13 53.531 0.101 . 1 . . 802 . A 110 MET CA . 34088 2 258 . 1 1 110 110 MET CB C 13 37.357 0.148 . 1 . . 804 . A 110 MET CB . 34088 2 259 . 1 1 110 110 MET CG C 13 31.379 0.065 . 1 . . 71 . A 110 MET CG . 34088 2 260 . 1 1 110 110 MET CE C 13 14.439 0.069 . 1 . . 72 . A 110 MET CE . 34088 2 261 . 1 1 110 110 MET N N 15 125.860 0.051 . 1 . . 547 . A 110 MET N . 34088 2 262 . 1 1 111 111 GLN CA C 13 56.869 0.092 . 1 . . 796 . A 111 GLN CA . 34088 2 263 . 1 1 111 111 GLN CB C 13 30.889 0.003 . 1 . . 798 . A 111 GLN CB . 34088 2 264 . 1 1 111 111 GLN CG C 13 36.838 . . 1 . . 661 . A 111 GLN CG . 34088 2 265 . 1 1 112 112 ARG C C 13 175.048 . . 1 . . 1141 . A 112 ARG C . 34088 2 266 . 1 1 112 112 ARG CA C 13 54.842 0.095 . 1 . . 1134 . A 112 ARG CA . 34088 2 267 . 1 1 112 112 ARG CB C 13 37.055 0.075 . 1 . . 1016 . A 112 ARG CB . 34088 2 268 . 1 1 112 112 ARG CG C 13 26.991 0.024 . 1 . . 439 . A 112 ARG CG . 34088 2 269 . 1 1 112 112 ARG CD C 13 44.764 0.034 . 1 . . 438 . A 112 ARG CD . 34088 2 270 . 1 1 112 112 ARG CZ C 13 159.766 . . 1 . . 1260 . A 112 ARG CZ . 34088 2 271 . 1 1 113 113 TRP C C 13 175.510 0.046 . 1 . . 189 . A 113 TRP C . 34088 2 272 . 1 1 113 113 TRP CA C 13 56.156 0.069 . 1 . . 143 . A 113 TRP CA . 34088 2 273 . 1 1 113 113 TRP CB C 13 32.222 0.071 . 1 . . 142 . A 113 TRP CB . 34088 2 274 . 1 1 113 113 TRP CG C 13 112.196 0.11 . 1 . . 144 . A 113 TRP CG . 34088 2 275 . 1 1 113 113 TRP CD2 C 13 130.165 0.101 . 1 . . 1108 . A 113 TRP CD2 . 34088 2 276 . 1 1 113 113 TRP CZ3 C 13 121.528 0.116 . 1 . . 1238 . A 113 TRP CZ3 . 34088 2 277 . 1 1 113 113 TRP N N 15 132.467 . . 1 . . 759 . A 113 TRP N . 34088 2 278 . 1 1 114 114 LYS CA C 13 55.310 0.143 . 1 . . 1142 . A 114 LYS CA . 34088 2 279 . 1 1 114 114 LYS CB C 13 40.266 0.056 . 1 . . 1054 . A 114 LYS CB . 34088 2 280 . 1 1 114 114 LYS CG C 13 25.922 0.039 . 1 . . 219 . A 114 LYS CG . 34088 2 281 . 1 1 114 114 LYS CD C 13 32.310 0.041 . 1 . . 241 . A 114 LYS CD . 34088 2 282 . 1 1 114 114 LYS CE C 13 42.486 0.08 . 1 . . 233 . A 114 LYS CE . 34088 2 283 . 1 1 115 115 ILE C C 13 174.835 0.215 . 1 . . 503 . A 115 ILE C . 34088 2 284 . 1 1 115 115 ILE CA C 13 59.808 0.216 . 1 . . 1051 . A 115 ILE CA . 34088 2 285 . 1 1 115 115 ILE CB C 13 42.383 0.087 . 1 . . 199 . A 115 ILE CB . 34088 2 286 . 1 1 115 115 ILE CG1 C 13 29.506 0.073 . 1 . . 198 . A 115 ILE CG1 . 34088 2 287 . 1 1 115 115 ILE CG2 C 13 18.417 0.129 . 1 . . 200 . A 115 ILE CG2 . 34088 2 288 . 1 1 115 115 ILE CD1 C 13 14.592 0.053 . 1 . . 197 . A 115 ILE CD1 . 34088 2 289 . 1 1 115 115 ILE N N 15 123.955 0.128 . 1 . . 632 . A 115 ILE N . 34088 2 290 . 1 1 116 116 ALA C C 13 176.798 0.109 . 1 . . 268 . A 116 ALA C . 34088 2 291 . 1 1 116 116 ALA CA C 13 50.437 0.067 . 1 . . 255 . A 116 ALA CA . 34088 2 292 . 1 1 116 116 ALA CB C 13 24.668 0.111 . 1 . . 254 . A 116 ALA CB . 34088 2 293 . 1 1 116 116 ALA N N 15 125.764 0.647 . 1 . . 264 . A 116 ALA N . 34088 2 294 . 1 1 117 117 PRO C C 13 176.394 0.134 . 1 . . 704 . A 117 PRO C . 34088 2 295 . 1 1 117 117 PRO CA C 13 62.831 0.06 . 1 . . 62 . A 117 PRO CA . 34088 2 296 . 1 1 117 117 PRO CB C 13 34.767 0.108 . 1 . . 60 . A 117 PRO CB . 34088 2 297 . 1 1 117 117 PRO CG C 13 28.246 0.035 . 1 . . 646 . A 117 PRO CG . 34088 2 298 . 1 1 117 117 PRO CD C 13 51.342 0.094 . 1 . . 61 . A 117 PRO CD . 34088 2 299 . 1 1 117 117 PRO N N 15 143.542 0.047 . 1 . . 502 . A 117 PRO N . 34088 2 300 . 1 1 118 118 ASP C C 13 173.926 0.104 . 1 . . 665 . A 118 ASP C . 34088 2 301 . 1 1 118 118 ASP CA C 13 54.050 0.063 . 1 . . 663 . A 118 ASP CA . 34088 2 302 . 1 1 118 118 ASP CB C 13 45.175 0.152 . 1 . . 662 . A 118 ASP CB . 34088 2 303 . 1 1 118 118 ASP CG C 13 180.788 0.138 . 1 . . 664 . A 118 ASP CG . 34088 2 304 . 1 1 118 118 ASP N N 15 116.662 0.198 . 1 . . 699 . A 118 ASP N . 34088 2 305 . 1 1 119 119 TRP C C 13 175.382 0.068 . 1 . . 191 . A 119 TRP C . 34088 2 306 . 1 1 119 119 TRP CA C 13 57.542 0.111 . 1 . . 151 . A 119 TRP CA . 34088 2 307 . 1 1 119 119 TRP CB C 13 33.712 0.093 . 1 . . 150 . A 119 TRP CB . 34088 2 308 . 1 1 119 119 TRP CG C 13 112.923 0.029 . 1 . . 153 . A 119 TRP CG . 34088 2 309 . 1 1 119 119 TRP CD1 C 13 124.867 0.069 . 1 . . 350 . A 119 TRP CD1 . 34088 2 310 . 1 1 119 119 TRP N N 15 114.813 . . 1 . . 929 . A 119 TRP N . 34088 2 311 . 1 1 120 120 ASP CA C 13 55.293 0.101 . 1 . . 1203 . A 120 ASP CA . 34088 2 312 . 1 1 120 120 ASP CB C 13 44.372 0.147 . 1 . . 1037 . A 120 ASP CB . 34088 2 313 . 1 1 121 121 VAL CA C 13 61.309 0.067 . 1 . . 1206 . A 121 VAL CA . 34088 2 314 . 1 1 121 121 VAL CB C 13 36.200 0.075 . 1 . . 1207 . A 121 VAL CB . 34088 2 315 . 1 1 122 122 LYS CA C 13 58.824 0.037 . 1 . . 782 . A 122 LYS CA . 34088 2 316 . 1 1 122 122 LYS CB C 13 34.785 0.093 . 1 . . 235 . A 122 LYS CB . 34088 2 317 . 1 1 122 122 LYS CG C 13 25.995 0.057 . 1 . . 224 . A 122 LYS CG . 34088 2 318 . 1 1 122 122 LYS CD C 13 30.158 0.066 . 1 . . 236 . A 122 LYS CD . 34088 2 319 . 1 1 122 122 LYS CE C 13 42.833 0.036 . 1 . . 234 . A 122 LYS CE . 34088 2 320 . 1 1 123 123 LEU C C 13 177.622 0.123 . 1 . . 93 . A 123 LEU C . 34088 2 321 . 1 1 123 123 LEU CA C 13 56.374 0.078 . 1 . . 98 . A 123 LEU CA . 34088 2 322 . 1 1 123 123 LEU CB C 13 42.267 0.083 . 1 . . 92 . A 123 LEU CB . 34088 2 323 . 1 1 123 123 LEU CG C 13 26.861 0.059 . 1 . . 91 . A 123 LEU CG . 34088 2 324 . 1 1 123 123 LEU CD1 C 13 21.174 0.069 . 1 . . 507 . A 123 LEU CD1 . 34088 2 325 . 1 1 123 123 LEU N N 15 124.874 0.151 . 1 . . 532 . A 123 LEU N . 34088 2 326 . 1 1 124 124 THR C C 13 172.874 0.143 . 1 . . 480 . A 124 THR C . 34088 2 327 . 1 1 124 124 THR CA C 13 59.745 0.143 . 1 . . 40 . A 124 THR CA . 34088 2 328 . 1 1 124 124 THR CB C 13 72.270 0.153 . 1 . . 41 . A 124 THR CB . 34088 2 329 . 1 1 124 124 THR CG2 C 13 22.556 0.15 . 1 . . 42 . A 124 THR CG2 . 34088 2 330 . 1 1 124 124 THR N N 15 109.059 0.471 . 1 . . 460 . A 124 THR N . 34088 2 331 . 1 1 125 125 ASP CA C 13 58.081 0.114 . 1 . . 695 . A 125 ASP CA . 34088 2 332 . 1 1 125 125 ASP CB C 13 41.184 0.146 . 1 . . 684 . A 125 ASP CB . 34088 2 333 . 1 1 125 125 ASP CG C 13 180.079 0.057 . 1 . . 1265 . A 125 ASP CG . 34088 2 334 . 1 1 126 126 ASP CA C 13 54.364 . . 1 . . 1279 . A 126 ASP CA . 34088 2 335 . 1 1 126 126 ASP CB C 13 44.114 . . 1 . . 1280 . A 126 ASP CB . 34088 2 336 . 1 1 127 127 LEU C C 13 175.167 0.109 . 1 . . 131 . A 127 LEU C . 34088 2 337 . 1 1 127 127 LEU CA C 13 54.401 0.082 . 1 . . 124 . A 127 LEU CA . 34088 2 338 . 1 1 127 127 LEU CB C 13 46.711 0.075 . 1 . . 111 . A 127 LEU CB . 34088 2 339 . 1 1 127 127 LEU CG C 13 27.864 0.066 . 1 . . 110 . A 127 LEU CG . 34088 2 340 . 1 1 127 127 LEU CD1 C 13 25.141 0.165 . 1 . . 510 . A 127 LEU CD1 . 34088 2 341 . 1 1 128 128 ARG C C 13 174.652 . . 1 . . 1256 . A 128 ARG C . 34088 2 342 . 1 1 128 128 ARG CA C 13 54.882 0.056 . 1 . . 932 . A 128 ARG CA . 34088 2 343 . 1 1 128 128 ARG CB C 13 34.773 0.183 . 1 . . 931 . A 128 ARG CB . 34088 2 344 . 1 1 128 128 ARG CZ C 13 159.795 . . 1 . . 1262 . A 128 ARG CZ . 34088 2 345 . 1 1 129 129 PHE C C 13 173.788 . . 1 . . 933 . A 129 PHE C . 34088 2 346 . 1 1 129 129 PHE CA C 13 54.599 0.101 . 1 . . 930 . A 129 PHE CA . 34088 2 347 . 1 1 129 129 PHE CB C 13 42.388 0.023 . 1 . . 288 . A 129 PHE CB . 34088 2 348 . 1 1 129 129 PHE CG C 13 139.309 0.053 . 1 . . 290 . A 129 PHE CG . 34088 2 349 . 1 1 129 129 PHE N N 15 121.568 0.269 . 1 . . 289 . A 129 PHE N . 34088 2 350 . 1 1 130 130 ASN C C 13 173.981 0.165 . 1 . . 877 . A 130 ASN C . 34088 2 351 . 1 1 130 130 ASN CA C 13 51.172 0.08 . 1 . . 878 . A 130 ASN CA . 34088 2 352 . 1 1 130 130 ASN CB C 13 42.575 0.115 . 1 . . 876 . A 130 ASN CB . 34088 2 353 . 1 1 131 131 GLY C C 13 169.120 0.134 . 1 . . 871 . A 131 GLY C . 34088 2 354 . 1 1 131 131 GLY CA C 13 45.771 0.162 . 1 . . 835 . A 131 GLY CA . 34088 2 355 . 1 1 132 132 TRP C C 13 175.163 0.043 . 1 . . 188 . A 132 TRP C . 34088 2 356 . 1 1 132 132 TRP CA C 13 55.054 0.064 . 1 . . 137 . A 132 TRP CA . 34088 2 357 . 1 1 132 132 TRP CB C 13 32.142 0.13 . 1 . . 136 . A 132 TRP CB . 34088 2 358 . 1 1 132 132 TRP CG C 13 110.770 0.089 . 1 . . 138 . A 132 TRP CG . 34088 2 359 . 1 1 132 132 TRP CD2 C 13 130.180 0.028 . 1 . . 1107 . A 132 TRP CD2 . 34088 2 360 . 1 1 132 132 TRP CE3 C 13 120.578 0.151 . 1 . . 1105 . A 132 TRP CE3 . 34088 2 361 . 1 1 132 132 TRP CZ3 C 13 121.412 0.116 . 1 . . 1239 . A 132 TRP CZ3 . 34088 2 362 . 1 1 132 132 TRP N N 15 113.331 . . 1 . . 745 . A 132 TRP N . 34088 2 363 . 1 1 133 133 LEU C C 13 173.558 0.071 . 1 . . 918 . A 133 LEU C . 34088 2 364 . 1 1 133 133 LEU CA C 13 55.372 0.021 . 1 . . 917 . A 133 LEU CA . 34088 2 365 . 1 1 133 133 LEU CB C 13 45.977 0.092 . 1 . . 915 . A 133 LEU CB . 34088 2 366 . 1 1 133 133 LEU CG C 13 28.414 0.089 . 1 . . 106 . A 133 LEU CG . 34088 2 367 . 1 1 133 133 LEU CD1 C 13 26.380 0.01 . 2 . . 508 . A 133 LEU CD1 . 34088 2 368 . 1 1 133 133 LEU CD2 C 13 26.583 0.111 . 2 . . 1104 . A 133 LEU CD2 . 34088 2 369 . 1 1 133 133 LEU N N 15 124.161 . . 1 . . 536 . A 133 LEU N . 34088 2 370 . 1 1 134 134 SER CA C 13 57.076 0.119 . 1 . . 414 . A 134 SER CA . 34088 2 371 . 1 1 134 134 SER CB C 13 67.626 0.163 . 1 . . 825 . A 134 SER CB . 34088 2 372 . 1 1 134 134 SER N N 15 119.105 . . 1 . . 415 . A 134 SER N . 34088 2 373 . 1 1 135 135 MET CA C 13 54.340 0.152 . 1 . . 1118 . A 135 MET CA . 34088 2 374 . 1 1 135 135 MET CG C 13 33.288 0.171 . 1 . . 1384 . A 135 MET CG . 34088 2 375 . 1 1 135 135 MET CE C 13 17.211 . . 1 . . 1383 . A 135 MET CE . 34088 2 376 . 1 1 136 136 TYR CA C 13 54.657 0.093 . 1 . . 1151 . A 136 TYR CA . 34088 2 377 . 1 1 136 136 TYR CB C 13 42.379 0.016 . 1 . . 1021 . A 136 TYR CB . 34088 2 378 . 1 1 136 136 TYR CG C 13 130.768 0.047 . 1 . . 287 . A 136 TYR CG . 34088 2 379 . 1 1 136 136 TYR N N 15 119.116 0.403 . 1 . . 1020 . A 136 TYR N . 34088 2 380 . 1 1 137 137 LYS CA C 13 53.081 0.123 . 1 . . 223 . A 137 LYS CA . 34088 2 381 . 1 1 137 137 LYS CB C 13 35.697 0.067 . 1 . . 237 . A 137 LYS CB . 34088 2 382 . 1 1 137 137 LYS CG C 13 24.581 0.078 . 1 . . 222 . A 137 LYS CG . 34088 2 383 . 1 1 137 137 LYS CD C 13 29.743 . . 1 . . 238 . A 137 LYS CD . 34088 2 384 . 1 1 137 137 LYS CE C 13 42.430 0.056 . 1 . . 229 . A 137 LYS CE . 34088 2 385 . 1 1 138 138 PHE CA C 13 57.037 0.048 . 1 . . 1152 . A 138 PHE CA . 34088 2 386 . 1 1 138 138 PHE CB C 13 43.010 0.043 . 1 . . 1143 . A 138 PHE CB . 34088 2 387 . 1 1 138 138 PHE CG C 13 141.859 0.117 . 1 . . 1229 . A 138 PHE CG . 34088 2 388 . 1 1 138 138 PHE N N 15 124.376 0.079 . 1 . . 1153 . A 138 PHE N . 34088 2 389 . 1 1 139 139 ALA C C 13 175.477 0.148 . 1 . . 1139 . A 139 ALA C . 34088 2 390 . 1 1 139 139 ALA CA C 13 52.340 0.188 . 1 . . 1137 . A 139 ALA CA . 34088 2 391 . 1 1 139 139 ALA CB C 13 24.250 0.096 . 1 . . 1138 . A 139 ALA CB . 34088 2 392 . 1 1 139 139 ALA N N 15 122.472 0.108 . 1 . . 1119 . A 139 ALA N . 34088 2 393 . 1 1 140 140 ASN C C 13 172.605 0.126 . 1 . . 1155 . A 140 ASN C . 34088 2 394 . 1 1 140 140 ASN CA C 13 57.562 0.134 . 1 . . 643 . A 140 ASN CA . 34088 2 395 . 1 1 140 140 ASN CB C 13 39.180 0.087 . 1 . . 642 . A 140 ASN CB . 34088 2 396 . 1 1 140 140 ASN CG C 13 179.155 0.083 . 1 . . 645 . A 140 ASN CG . 34088 2 397 . 1 1 140 140 ASN N N 15 111.346 0.302 . 1 . . 644 . A 140 ASN N . 34088 2 398 . 1 1 141 141 ASP C C 13 177.664 0.102 . 1 . . 770 . A 141 ASP C . 34088 2 399 . 1 1 141 141 ASP CA C 13 56.226 0.159 . 1 . . 888 . A 141 ASP CA . 34088 2 400 . 1 1 141 141 ASP CB C 13 39.528 0.209 . 1 . . 1234 . A 141 ASP CB . 34088 2 401 . 1 1 142 142 LEU C C 13 181.344 0.138 . 1 . . 90 . A 142 LEU C . 34088 2 402 . 1 1 142 142 LEU CA C 13 58.050 0.084 . 1 . . 97 . A 142 LEU CA . 34088 2 403 . 1 1 142 142 LEU CB C 13 40.533 0.054 . 1 . . 89 . A 142 LEU CB . 34088 2 404 . 1 1 142 142 LEU CG C 13 27.422 0.057 . 1 . . 88 . A 142 LEU CG . 34088 2 405 . 1 1 142 142 LEU CD1 C 13 26.246 0.097 . 2 . . 476 . A 142 LEU CD1 . 34088 2 406 . 1 1 142 142 LEU CD2 C 13 23.548 0.078 . 2 . . 477 . A 142 LEU CD2 . 34088 2 407 . 1 1 142 142 LEU N N 15 116.424 0.459 . 1 . . 478 . A 142 LEU N . 34088 2 408 . 1 1 143 143 ASN C C 13 177.101 0.144 . 1 . . 475 . A 143 ASN C . 34088 2 409 . 1 1 143 143 ASN CA C 13 55.730 0.084 . 1 . . 473 . A 143 ASN CA . 34088 2 410 . 1 1 143 143 ASN CB C 13 37.508 0.109 . 1 . . 472 . A 143 ASN CB . 34088 2 411 . 1 1 143 143 ASN N N 15 115.754 0.231 . 1 . . 474 . A 143 ASN N . 34088 2 412 . 1 1 144 144 THR C C 13 175.196 0.093 . 1 . . 471 . A 144 THR C . 34088 2 413 . 1 1 144 144 THR CA C 13 65.722 0.068 . 1 . . 1 . A 144 THR CA . 34088 2 414 . 1 1 144 144 THR CB C 13 69.243 0.075 . 1 . . 2 . A 144 THR CB . 34088 2 415 . 1 1 144 144 THR CG2 C 13 23.572 0.098 . 1 . . 3 . A 144 THR CG2 . 34088 2 416 . 1 1 144 144 THR N N 15 116.172 0.214 . 1 . . 463 . A 144 THR N . 34088 2 417 . 1 1 145 145 THR C C 13 177.402 0.203 . 1 . . 483 . A 145 THR C . 34088 2 418 . 1 1 145 145 THR CA C 13 62.889 0.088 . 1 . . 13 . A 145 THR CA . 34088 2 419 . 1 1 145 145 THR CB C 13 69.869 0.163 . 1 . . 14 . A 145 THR CB . 34088 2 420 . 1 1 145 145 THR CG2 C 13 22.838 0.176 . 1 . . 15 . A 145 THR CG2 . 34088 2 421 . 1 1 145 145 THR N N 15 109.986 0.231 . 1 . . 464 . A 145 THR N . 34088 2 422 . 1 1 146 146 GLY C C 13 174.118 0.214 . 1 . . 375 . A 146 GLY C . 34088 2 423 . 1 1 146 146 GLY CA C 13 46.179 0.101 . 1 . . 376 . A 146 GLY CA . 34088 2 424 . 1 1 146 146 GLY N N 15 108.629 0.457 . 1 . . 377 . A 146 GLY N . 34088 2 425 . 1 1 147 147 TYR CA C 13 58.401 0.097 . 1 . . 584 . A 147 TYR CA . 34088 2 426 . 1 1 147 147 TYR CB C 13 39.349 0.147 . 1 . . 583 . A 147 TYR CB . 34088 2 427 . 1 1 147 147 TYR CG C 13 130.745 0.086 . 1 . . 690 . A 147 TYR CG . 34088 2 428 . 1 1 147 147 TYR N N 15 120.466 0.105 . 1 . . 585 . A 147 TYR N . 34088 2 429 . 1 1 148 148 ALA C C 13 179.016 0.085 . 1 . . 280 . A 148 ALA C . 34088 2 430 . 1 1 148 148 ALA CA C 13 51.362 0.115 . 1 . . 247 . A 148 ALA CA . 34088 2 431 . 1 1 148 148 ALA CB C 13 18.389 0.112 . 1 . . 246 . A 148 ALA CB . 34088 2 432 . 1 1 148 148 ALA N N 15 122.945 0.567 . 1 . . 553 . A 148 ALA N . 34088 2 433 . 1 1 149 149 ASP C C 13 176.721 0.134 . 1 . . 767 . A 149 ASP C . 34088 2 434 . 1 1 149 149 ASP CA C 13 56.890 0.112 . 1 . . 555 . A 149 ASP CA . 34088 2 435 . 1 1 149 149 ASP CB C 13 42.220 0.191 . 1 . . 554 . A 149 ASP CB . 34088 2 436 . 1 1 149 149 ASP CG C 13 180.834 0.118 . 1 . . 691 . A 149 ASP CG . 34088 2 437 . 1 1 149 149 ASP N N 15 115.774 0.354 . 1 . . 556 . A 149 ASP N . 34088 2 438 . 1 1 150 150 THR C C 13 172.763 0.125 . 1 . . 603 . A 150 THR C . 34088 2 439 . 1 1 150 150 THR CA C 13 62.474 0.107 . 1 . . 22 . A 150 THR CA . 34088 2 440 . 1 1 150 150 THR CB C 13 71.420 0.098 . 1 . . 23 . A 150 THR CB . 34088 2 441 . 1 1 150 150 THR CG2 C 13 23.576 0.169 . 1 . . 24 . A 150 THR CG2 . 34088 2 442 . 1 1 150 150 THR N N 15 118.085 0.2 . 1 . . 461 . A 150 THR N . 34088 2 443 . 1 1 151 151 ARG C C 13 174.376 0.094 . 1 . . 552 . A 151 ARG C . 34088 2 444 . 1 1 151 151 ARG CA C 13 55.037 0.107 . 1 . . 812 . A 151 ARG CA . 34088 2 445 . 1 1 151 151 ARG CB C 13 32.080 0.2 . 1 . . 457 . A 151 ARG CB . 34088 2 446 . 1 1 151 151 ARG CG C 13 26.737 0.11 . 1 . . 459 . A 151 ARG CG . 34088 2 447 . 1 1 151 151 ARG CD C 13 44.040 0.139 . 1 . . 458 . A 151 ARG CD . 34088 2 448 . 1 1 151 151 ARG CZ C 13 159.736 0.008 . 1 . . 1261 . A 151 ARG CZ . 34088 2 449 . 1 1 151 151 ARG N N 15 124.033 . . 1 . . 811 . A 151 ARG N . 34088 2 450 . 1 1 152 152 VAL C C 13 173.189 . . 1 . . 964 . A 152 VAL C . 34088 2 451 . 1 1 152 152 VAL CA C 13 59.850 0.171 . 1 . . 1217 . A 152 VAL CA . 34088 2 452 . 1 1 152 152 VAL CB C 13 35.820 0.192 . 1 . . 977 . A 152 VAL CB . 34088 2 453 . 1 1 153 153 GLU C C 13 173.561 0.082 . 1 . . 775 . A 153 GLU C . 34088 2 454 . 1 1 153 153 GLU CA C 13 54.057 0.148 . 1 . . 666 . A 153 GLU CA . 34088 2 455 . 1 1 153 153 GLU CB C 13 36.297 0.224 . 1 . . 621 . A 153 GLU CB . 34088 2 456 . 1 1 153 153 GLU CG C 13 36.923 0.093 . 1 . . 677 . A 153 GLU CG . 34088 2 457 . 1 1 153 153 GLU CD C 13 183.768 0.045 . 1 . . 1240 . A 153 GLU CD . 34088 2 458 . 1 1 153 153 GLU N N 15 127.797 . . 1 . . 962 . A 153 GLU N . 34088 2 459 . 1 1 154 154 THR C C 13 169.317 0.118 . 1 . . 481 . A 154 THR C . 34088 2 460 . 1 1 154 154 THR CA C 13 60.055 0.097 . 1 . . 28 . A 154 THR CA . 34088 2 461 . 1 1 154 154 THR CB C 13 70.106 0.104 . 1 . . 29 . A 154 THR CB . 34088 2 462 . 1 1 154 154 THR CG2 C 13 19.090 0.155 . 1 . . 30 . A 154 THR CG2 . 34088 2 463 . 1 1 154 154 THR N N 15 122.217 0.206 . 1 . . 469 . A 154 THR N . 34088 2 464 . 1 1 155 155 GLU C C 13 176.169 0.228 . 1 . . 870 . A 155 GLU C . 34088 2 465 . 1 1 155 155 GLU CA C 13 56.159 0.12 . 1 . . 619 . A 155 GLU CA . 34088 2 466 . 1 1 155 155 GLU CB C 13 31.316 0.113 . 1 . . 678 . A 155 GLU CB . 34088 2 467 . 1 1 155 155 GLU CG C 13 37.020 0.133 . 1 . . 618 . A 155 GLU CG . 34088 2 468 . 1 1 155 155 GLU CD C 13 182.221 0.168 . 1 . . 698 . A 155 GLU CD . 34088 2 469 . 1 1 155 155 GLU N N 15 123.606 0.427 . 1 . . 620 . A 155 GLU N . 34088 2 470 . 1 1 156 156 THR C C 13 171.799 0.094 . 1 . . 482 . A 156 THR C . 34088 2 471 . 1 1 156 156 THR CA C 13 60.125 0.099 . 1 . . 33 . A 156 THR CA . 34088 2 472 . 1 1 156 156 THR CB C 13 70.830 0.161 . 1 . . 32 . A 156 THR CB . 34088 2 473 . 1 1 156 156 THR CG2 C 13 20.650 0.106 . 1 . . 31 . A 156 THR CG2 . 34088 2 474 . 1 1 156 156 THR N N 15 123.494 . . 1 . . 468 . A 156 THR N . 34088 2 475 . 1 1 157 157 GLY C C 13 172.063 0.108 . 1 . . 361 . A 157 GLY C . 34088 2 476 . 1 1 157 157 GLY CA C 13 48.051 0.096 . 1 . . 362 . A 157 GLY CA . 34088 2 477 . 1 1 157 157 GLY N N 15 113.547 0.142 . 1 . . 363 . A 157 GLY N . 34088 2 478 . 1 1 158 158 LEU C C 13 175.952 0.118 . 1 . . 134 . A 158 LEU C . 34088 2 479 . 1 1 158 158 LEU CA C 13 52.933 0.125 . 1 . . 125 . A 158 LEU CA . 34088 2 480 . 1 1 158 158 LEU CB C 13 46.853 0.134 . 1 . . 113 . A 158 LEU CB . 34088 2 481 . 1 1 158 158 LEU CG C 13 27.951 0.08 . 1 . . 112 . A 158 LEU CG . 34088 2 482 . 1 1 158 158 LEU CD1 C 13 24.326 0.09 . 1 . . 511 . A 158 LEU CD1 . 34088 2 483 . 1 1 158 158 LEU N N 15 117.779 0.394 . 1 . . 490 . A 158 LEU N . 34088 2 484 . 1 1 159 159 GLN C C 13 174.788 0.124 . 1 . . 772 . A 159 GLN C . 34088 2 485 . 1 1 159 159 GLN CA C 13 54.232 0.105 . 1 . . 652 . A 159 GLN CA . 34088 2 486 . 1 1 159 159 GLN CB C 13 33.370 0.145 . 1 . . 653 . A 159 GLN CB . 34088 2 487 . 1 1 160 160 TYR C C 13 174.472 . . 1 . . 909 . A 160 TYR C . 34088 2 488 . 1 1 160 160 TYR CA C 13 56.643 0.059 . 1 . . 339 . A 160 TYR CA . 34088 2 489 . 1 1 160 160 TYR CB C 13 42.428 0.111 . 1 . . 338 . A 160 TYR CB . 34088 2 490 . 1 1 160 160 TYR CG C 13 128.863 0.123 . 1 . . 341 . A 160 TYR CG . 34088 2 491 . 1 1 160 160 TYR CE1 C 13 118.273 0.095 . 1 . . 1241 . A 160 TYR CE1 . 34088 2 492 . 1 1 160 160 TYR CE2 C 13 118.273 0.095 . 1 . . 1241 . A 160 TYR CE2 . 34088 2 493 . 1 1 160 160 TYR N N 15 131.117 0.134 . 1 . . 340 . A 160 TYR N . 34088 2 494 . 1 1 161 161 THR C C 13 174.113 0.082 . 1 . . 570 . A 161 THR C . 34088 2 495 . 1 1 161 161 THR CA C 13 63.238 0.12 . 1 . . 11 . A 161 THR CA . 34088 2 496 . 1 1 161 161 THR CB C 13 70.091 0.082 . 1 . . 12 . A 161 THR CB . 34088 2 497 . 1 1 161 161 THR CG2 C 13 22.156 0.081 . 1 . . 10 . A 161 THR CG2 . 34088 2 498 . 1 1 161 161 THR N N 15 125.224 0.394 . 1 . . 462 . A 161 THR N . 34088 2 499 . 1 1 162 162 PHE C C 13 176.248 0.161 . 1 . . 616 . A 162 PHE C . 34088 2 500 . 1 1 162 162 PHE CA C 13 61.400 0.076 . 1 . . 335 . A 162 PHE CA . 34088 2 501 . 1 1 162 162 PHE CB C 13 39.550 0.229 . 1 . . 334 . A 162 PHE CB . 34088 2 502 . 1 1 162 162 PHE CG C 13 140.971 0.128 . 1 . . 337 . A 162 PHE CG . 34088 2 503 . 1 1 162 162 PHE N N 15 126.310 0.38 . 1 . . 336 . A 162 PHE N . 34088 2 504 . 1 1 163 163 ASN C C 13 173.808 0.064 . 1 . . 617 . A 163 ASN C . 34088 2 505 . 1 1 163 163 ASN CA C 13 52.753 0.094 . 1 . . 614 . A 163 ASN CA . 34088 2 506 . 1 1 163 163 ASN CB C 13 39.376 0.157 . 1 . . 613 . A 163 ASN CB . 34088 2 507 . 1 1 163 163 ASN N N 15 110.824 0.327 . 1 . . 615 . A 163 ASN N . 34088 2 508 . 1 1 164 164 GLU C C 13 176.583 0.141 . 1 . . 611 . A 164 GLU C . 34088 2 509 . 1 1 164 164 GLU CA C 13 59.342 0.101 . 1 . . 567 . A 164 GLU CA . 34088 2 510 . 1 1 164 164 GLU CB C 13 29.824 0.115 . 1 . . 569 . A 164 GLU CB . 34088 2 511 . 1 1 164 164 GLU CG C 13 36.984 0.13 . 1 . . 566 . A 164 GLU CG . 34088 2 512 . 1 1 164 164 GLU N N 15 114.477 0.319 . 1 . . 568 . A 164 GLU N . 34088 2 513 . 1 1 165 165 THR C C 13 173.962 0.084 . 1 . . 612 . A 165 THR C . 34088 2 514 . 1 1 165 165 THR CA C 13 64.572 0.099 . 1 . . 4 . A 165 THR CA . 34088 2 515 . 1 1 165 165 THR CB C 13 70.362 0.122 . 1 . . 5 . A 165 THR CB . 34088 2 516 . 1 1 165 165 THR CG2 C 13 22.800 0.071 . 1 . . 6 . A 165 THR CG2 . 34088 2 517 . 1 1 165 165 THR N N 15 115.757 0.482 . 1 . . 1212 . A 165 THR N . 34088 2 518 . 1 1 166 166 VAL C C 13 173.898 0.146 . 1 . . 563 . A 166 VAL C . 34088 2 519 . 1 1 166 166 VAL CA C 13 63.130 0.093 . 1 . . 1385 . A 166 VAL CA . 34088 2 520 . 1 1 166 166 VAL CB C 13 35.392 0.14 . 1 . . 560 . A 166 VAL CB . 34088 2 521 . 1 1 166 166 VAL CG1 C 13 21.227 0.12 . 1 . . 564 . A 166 VAL CG1 . 34088 2 522 . 1 1 166 166 VAL N N 15 120.180 0.393 . 1 . . 561 . A 166 VAL N . 34088 2 523 . 1 1 167 167 ALA C C 13 172.844 0.117 . 1 . . 269 . A 167 ALA C . 34088 2 524 . 1 1 167 167 ALA CA C 13 50.999 0.092 . 1 . . 253 . A 167 ALA CA . 34088 2 525 . 1 1 167 167 ALA CB C 13 23.457 0.107 . 1 . . 252 . A 167 ALA CB . 34088 2 526 . 1 1 167 167 ALA N N 15 128.306 0.144 . 1 . . 263 . A 167 ALA N . 34088 2 527 . 1 1 168 168 LEU C C 13 175.622 0.042 . 1 . . 133 . A 168 LEU C . 34088 2 528 . 1 1 168 168 LEU CA C 13 54.209 0.101 . 1 . . 122 . A 168 LEU CA . 34088 2 529 . 1 1 168 168 LEU CB C 13 48.282 0.11 . 1 . . 121 . A 168 LEU CB . 34088 2 530 . 1 1 168 168 LEU CG C 13 28.700 0.072 . 1 . . 120 . A 168 LEU CG . 34088 2 531 . 1 1 168 168 LEU CD1 C 13 23.955 0.091 . 2 . . 514 . A 168 LEU CD1 . 34088 2 532 . 1 1 168 168 LEU CD2 C 13 27.706 0.204 . 2 . . 586 . A 168 LEU CD2 . 34088 2 533 . 1 1 168 168 LEU N N 15 116.690 0.339 . 1 . . 587 . A 168 LEU N . 34088 2 534 . 1 1 169 169 ARG C C 13 175.719 0.096 . 1 . . 588 . A 169 ARG C . 34088 2 535 . 1 1 169 169 ARG CA C 13 54.867 0.094 . 1 . . 454 . A 169 ARG CA . 34088 2 536 . 1 1 169 169 ARG CB C 13 34.738 0.105 . 1 . . 456 . A 169 ARG CB . 34088 2 537 . 1 1 169 169 ARG CG C 13 27.756 0.12 . 1 . . 453 . A 169 ARG CG . 34088 2 538 . 1 1 169 169 ARG CD C 13 44.233 0.069 . 1 . . 455 . A 169 ARG CD . 34088 2 539 . 1 1 169 169 ARG CZ C 13 159.667 0.097 . 1 . . 700 . A 169 ARG CZ . 34088 2 540 . 1 1 169 169 ARG N N 15 125.004 0.279 . 1 . . 589 . A 169 ARG N . 34088 2 541 . 1 1 170 170 VAL C C 13 172.941 0.084 . 1 . . 562 . A 170 VAL C . 34088 2 542 . 1 1 170 170 VAL CA C 13 63.148 0.069 . 1 . . 558 . A 170 VAL CA . 34088 2 543 . 1 1 170 170 VAL CB C 13 34.697 0.072 . 1 . . 557 . A 170 VAL CB . 34088 2 544 . 1 1 170 170 VAL CG1 C 13 21.920 0.091 . 1 . . 565 . A 170 VAL CG1 . 34088 2 545 . 1 1 170 170 VAL N N 15 122.102 0.183 . 1 . . 559 . A 170 VAL N . 34088 2 546 . 1 1 171 171 ASN C C 13 175.204 . . 1 . . 1264 . A 171 ASN C . 34088 2 547 . 1 1 171 171 ASN CA C 13 51.217 0.058 . 1 . . 945 . A 171 ASN CA . 34088 2 548 . 1 1 171 171 ASN CB C 13 43.029 0.185 . 1 . . 943 . A 171 ASN CB . 34088 2 549 . 1 1 171 171 ASN N N 15 121.296 0.154 . 1 . . 944 . A 171 ASN N . 34088 2 550 . 1 1 172 172 TYR CA C 13 57.426 0.148 . 1 . . 861 . A 172 TYR CA . 34088 2 551 . 1 1 172 172 TYR CB C 13 42.073 0.216 . 1 . . 947 . A 172 TYR CB . 34088 2 552 . 1 1 172 172 TYR N N 15 121.857 . . 1 . . 1160 . A 172 TYR N . 34088 2 553 . 1 1 173 173 TYR C C 13 172.018 0.081 . 1 . . 939 . A 173 TYR C . 34088 2 554 . 1 1 173 173 TYR CA C 13 55.806 0.137 . 1 . . 937 . A 173 TYR CA . 34088 2 555 . 1 1 173 173 TYR CB C 13 42.710 0.163 . 1 . . 940 . A 173 TYR CB . 34088 2 556 . 1 1 173 173 TYR CD1 C 13 132.878 . . 1 . . 941 . A 173 TYR CD1 . 34088 2 557 . 1 1 173 173 TYR CD2 C 13 132.878 . . 1 . . 941 . A 173 TYR CD2 . 34088 2 558 . 1 1 174 174 LEU C C 13 173.916 0.104 . 1 . . 130 . A 174 LEU C . 34088 2 559 . 1 1 174 174 LEU CA C 13 52.662 0.1 . 1 . . 109 . A 174 LEU CA . 34088 2 560 . 1 1 174 174 LEU CB C 13 46.118 0.099 . 1 . . 108 . A 174 LEU CB . 34088 2 561 . 1 1 174 174 LEU CG C 13 28.473 0.055 . 1 . . 107 . A 174 LEU CG . 34088 2 562 . 1 1 174 174 LEU CD1 C 13 24.199 0.049 . 1 . . 509 . A 174 LEU CD1 . 34088 2 563 . 1 1 174 174 LEU N N 15 126.203 0.24 . 1 . . 491 . A 174 LEU N . 34088 2 564 . 1 1 194 194 ILE CA C 13 59.348 0.155 . 1 . . 1215 . A 194 ILE CA . 34088 2 565 . 1 1 194 194 ILE CB C 13 40.365 0.109 . 1 . . 959 . A 194 ILE CB . 34088 2 566 . 1 1 194 194 ILE CG1 C 13 27.593 0.079 . 1 . . 206 . A 194 ILE CG1 . 34088 2 567 . 1 1 194 194 ILE CG2 C 13 17.936 0.077 . 1 . . 208 . A 194 ILE CG2 . 34088 2 568 . 1 1 194 194 ILE CD1 C 13 13.343 0.08 . 1 . . 207 . A 194 ILE CD1 . 34088 2 569 . 1 1 195 195 ARG C C 13 173.457 0.095 . 1 . . 548 . A 195 ARG C . 34088 2 570 . 1 1 195 195 ARG CA C 13 55.101 0.073 . 1 . . 451 . A 195 ARG CA . 34088 2 571 . 1 1 195 195 ARG CB C 13 33.996 0.08 . 1 . . 452 . A 195 ARG CB . 34088 2 572 . 1 1 195 195 ARG CG C 13 28.617 0.064 . 1 . . 450 . A 195 ARG CG . 34088 2 573 . 1 1 195 195 ARG CD C 13 44.829 0.08 . 1 . . 1167 . A 195 ARG CD . 34088 2 574 . 1 1 195 195 ARG CZ C 13 159.720 . . 1 . . 1258 . A 195 ARG CZ . 34088 2 575 . 1 1 196 196 ALA C C 13 175.489 0.139 . 1 . . 272 . A 196 ALA C . 34088 2 576 . 1 1 196 196 ALA CA C 13 49.885 0.093 . 1 . . 245 . A 196 ALA CA . 34088 2 577 . 1 1 196 196 ALA CB C 13 22.196 0.087 . 1 . . 244 . A 196 ALA CB . 34088 2 578 . 1 1 196 196 ALA N N 15 124.169 0.361 . 1 . . 258 . A 196 ALA N . 34088 2 579 . 1 1 197 197 TYR C C 13 174.701 0.15 . 1 . . 496 . A 197 TYR C . 34088 2 580 . 1 1 197 197 TYR CA C 13 56.171 0.069 . 1 . . 296 . A 197 TYR CA . 34088 2 581 . 1 1 197 197 TYR CB C 13 43.341 0.103 . 1 . . 295 . A 197 TYR CB . 34088 2 582 . 1 1 197 197 TYR CG C 13 129.016 0.082 . 1 . . 298 . A 197 TYR CG . 34088 2 583 . 1 1 197 197 TYR CE1 C 13 119.609 0.153 . 1 . . 685 . A 197 TYR CE1 . 34088 2 584 . 1 1 197 197 TYR CE2 C 13 119.609 0.153 . 1 . . 685 . A 197 TYR CE2 . 34088 2 585 . 1 1 197 197 TYR N N 15 117.428 0.165 . 1 . . 297 . A 197 TYR N . 34088 2 586 . 1 1 198 198 LEU C C 13 171.113 0.084 . 1 . . 81 . A 198 LEU C . 34088 2 587 . 1 1 198 198 LEU CA C 13 51.718 0.08 . 1 . . 102 . A 198 LEU CA . 34088 2 588 . 1 1 198 198 LEU CB C 13 45.278 0.081 . 1 . . 80 . A 198 LEU CB . 34088 2 589 . 1 1 198 198 LEU CG C 13 27.939 0.069 . 1 . . 79 . A 198 LEU CG . 34088 2 590 . 1 1 198 198 LEU CD1 C 13 26.096 0.197 . 1 . . 495 . A 198 LEU CD1 . 34088 2 591 . 1 1 198 198 LEU N N 15 123.388 0.162 . 1 . . 494 . A 198 LEU N . 34088 2 592 . 1 1 199 199 PRO C C 13 177.551 0.105 . 1 . . 488 . A 199 PRO C . 34088 2 593 . 1 1 199 199 PRO CA C 13 64.538 0.09 . 1 . . 51 . A 199 PRO CA . 34088 2 594 . 1 1 199 199 PRO CB C 13 32.445 0.068 . 1 . . 49 . A 199 PRO CB . 34088 2 595 . 1 1 199 199 PRO CG C 13 28.467 0.064 . 1 . . 484 . A 199 PRO CG . 34088 2 596 . 1 1 199 199 PRO CD C 13 49.832 0.062 . 1 . . 50 . A 199 PRO CD . 34088 2 597 . 1 1 199 199 PRO N N 15 134.465 0.41 . 1 . . 73 . A 199 PRO N . 34088 2 598 . 1 1 200 200 LEU C C 13 179.143 0.092 . 1 . . 86 . A 200 LEU C . 34088 2 599 . 1 1 200 200 LEU CA C 13 53.277 0.072 . 1 . . 791 . A 200 LEU CA . 34088 2 600 . 1 1 200 200 LEU CB C 13 43.973 0.138 . 1 . . 789 . A 200 LEU CB . 34088 2 601 . 1 1 200 200 LEU CG C 13 26.733 0.067 . 1 . . 85 . A 200 LEU CG . 34088 2 602 . 1 1 200 200 LEU N N 15 126.143 0.563 . 1 . . 788 . A 200 LEU N . 34088 2 603 . 1 1 201 201 THR C C 13 174.021 0.075 . 1 . . 493 . A 201 THR C . 34088 2 604 . 1 1 201 201 THR CA C 13 61.943 0.089 . 1 . . 16 . A 201 THR CA . 34088 2 605 . 1 1 201 201 THR CB C 13 70.242 0.078 . 1 . . 17 . A 201 THR CB . 34088 2 606 . 1 1 201 201 THR CG2 C 13 21.991 0.057 . 1 . . 18 . A 201 THR CG2 . 34088 2 607 . 1 1 201 201 THR N N 15 122.151 0.152 . 1 . . 135 . A 201 THR N . 34088 2 608 . 1 1 202 202 LEU C C 13 176.405 0.089 . 1 . . 96 . A 202 LEU C . 34088 2 609 . 1 1 202 202 LEU CA C 13 52.375 0.067 . 1 . . 99 . A 202 LEU CA . 34088 2 610 . 1 1 202 202 LEU CB C 13 43.465 0.117 . 1 . . 95 . A 202 LEU CB . 34088 2 611 . 1 1 202 202 LEU CG C 13 26.844 0.075 . 1 . . 94 . A 202 LEU CG . 34088 2 612 . 1 1 202 202 LEU CD1 C 13 25.339 0.062 . 1 . . 492 . A 202 LEU CD1 . 34088 2 613 . 1 1 202 202 LEU N N 15 127.745 0.272 . 1 . . 489 . A 202 LEU N . 34088 2 614 . 1 1 203 203 GLY C C 13 176.036 0.215 . 1 . . 364 . A 203 GLY C . 34088 2 615 . 1 1 203 203 GLY CA C 13 47.591 0.081 . 1 . . 365 . A 203 GLY CA . 34088 2 616 . 1 1 203 203 GLY N N 15 111.900 0.105 . 1 . . 366 . A 203 GLY N . 34088 2 617 . 1 1 204 204 ASN C C 13 174.432 . . 1 . . 1251 . A 204 ASN C . 34088 2 618 . 1 1 204 204 ASN CA C 13 54.746 0.105 . 1 . . 703 . A 204 ASN CA . 34088 2 619 . 1 1 204 204 ASN CB C 13 39.282 0.102 . 1 . . 702 . A 204 ASN CB . 34088 2 620 . 1 1 204 204 ASN N N 15 126.158 0.206 . 1 . . 1174 . A 204 ASN N . 34088 2 621 . 1 1 205 205 HIS C C 13 176.140 0.164 . 1 . . 186 . A 205 HIS C . 34088 2 622 . 1 1 205 205 HIS CA C 13 55.828 0.072 . 1 . . 177 . A 205 HIS CA . 34088 2 623 . 1 1 205 205 HIS CB C 13 33.321 0.107 . 1 . . 176 . A 205 HIS CB . 34088 2 624 . 1 1 205 205 HIS CG C 13 137.334 0.124 . 1 . . 179 . A 205 HIS CG . 34088 2 625 . 1 1 205 205 HIS CD2 C 13 120.814 0.131 . 1 . . 178 . A 205 HIS CD2 . 34088 2 626 . 1 1 205 205 HIS CE1 C 13 137.723 0.272 . 1 . . 180 . A 205 HIS CE1 . 34088 2 627 . 1 1 205 205 HIS N N 15 121.348 0.399 . 1 . . 353 . A 205 HIS N . 34088 2 628 . 1 1 205 205 HIS ND1 N 15 166.717 0.323 . 1 . . 355 . A 205 HIS ND1 . 34088 2 629 . 1 1 206 206 SER C C 13 173.107 0.029 . 1 . . 972 . A 206 SER C . 34088 2 630 . 1 1 206 206 SER CA C 13 57.812 0.101 . 1 . . 412 . A 206 SER CA . 34088 2 631 . 1 1 206 206 SER CB C 13 64.962 0.084 . 1 . . 411 . A 206 SER CB . 34088 2 632 . 1 1 206 206 SER N N 15 121.059 0.338 . 1 . . 413 . A 206 SER N . 34088 2 633 . 1 1 207 207 VAL CA C 13 61.308 0.074 . 1 . . 743 . A 207 VAL CA . 34088 2 634 . 1 1 207 207 VAL CB C 13 35.868 0.077 . 1 . . 1218 . A 207 VAL CB . 34088 2 635 . 1 1 207 207 VAL N N 15 123.804 . . 1 . . 912 . A 207 VAL N . 34088 2 636 . 1 1 208 208 THR C C 13 173.576 0.089 . 1 . . 680 . A 208 THR C . 34088 2 637 . 1 1 208 208 THR CA C 13 59.431 0.103 . 1 . . 35 . A 208 THR CA . 34088 2 638 . 1 1 208 208 THR CB C 13 71.373 0.1 . 1 . . 36 . A 208 THR CB . 34088 2 639 . 1 1 208 208 THR CG2 C 13 23.911 0.084 . 1 . . 34 . A 208 THR CG2 . 34088 2 640 . 1 1 208 208 THR N N 15 121.679 0.14 . 1 . . 467 . A 208 THR N . 34088 2 641 . 1 1 209 209 PRO C C 13 175.955 0.084 . 1 . . 598 . A 209 PRO C . 34088 2 642 . 1 1 209 209 PRO CA C 13 62.405 0.133 . 1 . . 56 . A 209 PRO CA . 34088 2 643 . 1 1 209 209 PRO CB C 13 33.174 0.131 . 1 . . 54 . A 209 PRO CB . 34088 2 644 . 1 1 209 209 PRO CG C 13 28.284 0.091 . 1 . . 499 . A 209 PRO CG . 34088 2 645 . 1 1 209 209 PRO CD C 13 51.179 0.052 . 1 . . 55 . A 209 PRO CD . 34088 2 646 . 1 1 209 209 PRO N N 15 141.204 0.192 . 1 . . 500 . A 209 PRO N . 34088 2 647 . 1 1 210 210 TYR CA C 13 57.646 0.41 . 1 . . 595 . A 210 TYR CA . 34088 2 648 . 1 1 210 210 TYR CB C 13 42.673 0.166 . 1 . . 594 . A 210 TYR CB . 34088 2 649 . 1 1 210 210 TYR CG C 13 130.734 0.051 . 1 . . 597 . A 210 TYR CG . 34088 2 650 . 1 1 210 210 TYR N N 15 118.571 0.303 . 1 . . 596 . A 210 TYR N . 34088 2 651 . 1 1 211 211 THR CA C 13 59.393 0.118 . 1 . . 39 . A 211 THR CA . 34088 2 652 . 1 1 211 211 THR CB C 13 71.336 0.146 . 1 . . 38 . A 211 THR CB . 34088 2 653 . 1 1 211 211 THR CG2 C 13 19.649 0.163 . 1 . . 37 . A 211 THR CG2 . 34088 2 654 . 1 1 211 211 THR N N 15 111.777 0.06 . 1 . . 752 . A 211 THR N . 34088 2 655 . 1 1 237 237 VAL CA C 13 60.601 0.133 . 1 . . 1100 . A 237 VAL CA . 34088 2 656 . 1 1 238 238 GLY C C 13 170.511 0.002 . 1 . . 886 . A 238 GLY C . 34088 2 657 . 1 1 238 238 GLY CA C 13 46.122 0.008 . 1 . . 884 . A 238 GLY CA . 34088 2 658 . 1 1 238 238 GLY N N 15 110.004 0.746 . 1 . . 883 . A 238 GLY N . 34088 2 659 . 1 1 239 239 LEU C C 13 174.264 0.17 . 1 . . 537 . A 239 LEU C . 34088 2 660 . 1 1 239 239 LEU CA C 13 55.125 0.051 . 1 . . 127 . A 239 LEU CA . 34088 2 661 . 1 1 239 239 LEU CB C 13 47.107 0.069 . 1 . . 115 . A 239 LEU CB . 34088 2 662 . 1 1 239 239 LEU CG C 13 27.838 0.055 . 1 . . 114 . A 239 LEU CG . 34088 2 663 . 1 1 239 239 LEU CD1 C 13 26.725 0.066 . 1 . . 1270 . A 239 LEU CD1 . 34088 2 664 . 1 1 240 240 PHE CA C 13 57.101 0.134 . 1 . . 1231 . A 240 PHE CA . 34088 2 665 . 1 1 240 240 PHE CB C 13 42.627 . . 1 . . 1233 . A 240 PHE CB . 34088 2 666 . 1 1 240 240 PHE CG C 13 140.005 0.052 . 1 . . 1232 . A 240 PHE CG . 34088 2 667 . 1 1 240 240 PHE N N 15 123.519 . . 1 . . 1230 . A 240 PHE N . 34088 2 668 . 1 1 241 241 TYR CA C 13 56.784 0.044 . 1 . . 910 . A 241 TYR CA . 34088 2 669 . 1 1 241 241 TYR CB C 13 43.193 0.031 . 1 . . 911 . A 241 TYR CB . 34088 2 670 . 1 1 241 241 TYR CG C 13 128.367 0.214 . 1 . . 343 . A 241 TYR CG . 34088 2 671 . 1 1 241 241 TYR N N 15 130.400 0.242 . 1 . . 342 . A 241 TYR N . 34088 2 672 . 1 1 242 242 GLY C C 13 170.863 0.088 . 1 . . 869 . A 242 GLY C . 34088 2 673 . 1 1 242 242 GLY CA C 13 44.482 0.14 . 1 . . 389 . A 242 GLY CA . 34088 2 674 . 1 1 242 242 GLY N N 15 113.671 0.255 . 1 . . 390 . A 242 GLY N . 34088 2 675 . 1 1 243 243 TYR CA C 13 58.266 0.108 . 1 . . 600 . A 243 TYR CA . 34088 2 676 . 1 1 243 243 TYR CB C 13 42.488 0.093 . 1 . . 601 . A 243 TYR CB . 34088 2 677 . 1 1 243 243 TYR CG C 13 130.771 0.075 . 1 . . 602 . A 243 TYR CG . 34088 2 678 . 1 1 243 243 TYR CE1 C 13 117.783 0.08 . 1 . . 1242 . A 243 TYR CE1 . 34088 2 679 . 1 1 243 243 TYR CE2 C 13 117.783 0.08 . 1 . . 1242 . A 243 TYR CE2 . 34088 2 680 . 1 1 243 243 TYR N N 15 118.526 0.233 . 1 . . 599 . A 243 TYR N . 34088 2 681 . 1 1 244 244 ASP CA C 13 52.770 0.248 . 1 . . 814 . A 244 ASP CA . 34088 2 682 . 1 1 244 244 ASP CB C 13 42.859 0.139 . 1 . . 850 . A 244 ASP CB . 34088 2 683 . 1 1 245 245 PHE CA C 13 60.541 0.051 . 1 . . 324 . A 245 PHE CA . 34088 2 684 . 1 1 245 245 PHE CB C 13 39.228 0.075 . 1 . . 325 . A 245 PHE CB . 34088 2 685 . 1 1 245 245 PHE CG C 13 142.322 0.141 . 1 . . 326 . A 245 PHE CG . 34088 2 686 . 1 1 245 245 PHE CE1 C 13 131.577 0.14 . 1 . . 1285 . A 245 PHE CE1 . 34088 2 687 . 1 1 245 245 PHE CE2 C 13 131.577 0.14 . 1 . . 1285 . A 245 PHE CE2 . 34088 2 688 . 1 1 245 245 PHE N N 15 120.810 0.132 . 1 . . 323 . A 245 PHE N . 34088 2 689 . 1 1 249 249 LEU C C 13 175.752 0.243 . 1 . . 683 . A 249 LEU C . 34088 2 690 . 1 1 249 249 LEU CA C 13 55.178 0.016 . 1 . . 105 . A 249 LEU CA . 34088 2 691 . 1 1 249 249 LEU CB C 13 45.136 0.127 . 1 . . 104 . A 249 LEU CB . 34088 2 692 . 1 1 249 249 LEU CG C 13 28.058 0.002 . 1 . . 103 . A 249 LEU CG . 34088 2 693 . 1 1 249 249 LEU CD1 C 13 26.660 . . 1 . . 1272 . A 249 LEU CD1 . 34088 2 694 . 1 1 250 250 SER C C 13 173.035 0.157 . 1 . . 540 . A 250 SER C . 34088 2 695 . 1 1 250 250 SER CA C 13 57.269 0.314 . 1 . . 523 . A 250 SER CA . 34088 2 696 . 1 1 250 250 SER CB C 13 68.158 0.48 . 1 . . 524 . A 250 SER CB . 34088 2 697 . 1 1 251 251 VAL C C 13 175.345 0.166 . 1 . . 541 . A 251 VAL C . 34088 2 698 . 1 1 251 251 VAL CA C 13 59.227 0.053 . 1 . . 526 . A 251 VAL CA . 34088 2 699 . 1 1 251 251 VAL CB C 13 37.191 0.087 . 1 . . 525 . A 251 VAL CB . 34088 2 700 . 1 1 251 251 VAL CG1 C 13 20.154 . . 1 . . 708 . A 251 VAL CG1 . 34088 2 701 . 1 1 251 251 VAL N N 15 113.974 0.391 . 1 . . 527 . A 251 VAL N . 34088 2 702 . 1 1 252 252 SER C C 13 172.875 0.129 . 1 . . 538 . A 252 SER C . 34088 2 703 . 1 1 252 252 SER CA C 13 57.093 0.163 . 1 . . 409 . A 252 SER CA . 34088 2 704 . 1 1 252 252 SER CB C 13 67.671 0.294 . 1 . . 408 . A 252 SER CB . 34088 2 705 . 1 1 252 252 SER N N 15 119.401 0.239 . 1 . . 410 . A 252 SER N . 34088 2 706 . 1 1 253 253 LEU C C 13 175.713 0.088 . 1 . . 132 . A 253 LEU C . 34088 2 707 . 1 1 253 253 LEU CA C 13 54.556 0.16 . 1 . . 123 . A 253 LEU CA . 34088 2 708 . 1 1 253 253 LEU CB C 13 47.617 0.203 . 1 . . 117 . A 253 LEU CB . 34088 2 709 . 1 1 253 253 LEU CG C 13 28.540 0.117 . 1 . . 116 . A 253 LEU CG . 34088 2 710 . 1 1 253 253 LEU CD1 C 13 25.379 0.057 . 2 . . 512 . A 253 LEU CD1 . 34088 2 711 . 1 1 253 253 LEU CD2 C 13 27.090 . . 2 . . 1271 . A 253 LEU CD2 . 34088 2 712 . 1 1 253 253 LEU N N 15 121.373 0.217 . 1 . . 539 . A 253 LEU N . 34088 2 713 . 1 1 272 272 TYR C C 13 172.085 0.129 . 1 . . 634 . A 272 TYR C . 34088 2 714 . 1 1 272 272 TYR CB C 13 42.026 0.058 . 1 . . 633 . A 272 TYR CB . 34088 2 715 . 1 1 273 273 ALA C C 13 175.534 0.149 . 1 . . 631 . A 273 ALA C . 34088 2 716 . 1 1 273 273 ALA CA C 13 51.430 0.11 . 1 . . 275 . A 273 ALA CA . 34088 2 717 . 1 1 273 273 ALA CB C 13 24.185 0.154 . 1 . . 274 . A 273 ALA CB . 34088 2 718 . 1 1 273 273 ALA N N 15 127.632 0.101 . 1 . . 276 . A 273 ALA N . 34088 2 719 . 1 1 274 274 GLY C C 13 172.772 0.086 . 1 . . 378 . A 274 GLY C . 34088 2 720 . 1 1 274 274 GLY CA C 13 46.443 0.168 . 1 . . 379 . A 274 GLY CA . 34088 2 721 . 1 1 274 274 GLY N N 15 105.314 0.327 . 1 . . 380 . A 274 GLY N . 34088 2 722 . 1 1 275 275 VAL C C 13 173.528 . . 1 . . 637 . A 275 VAL C . 34088 2 723 . 1 1 275 275 VAL CA C 13 59.699 0.098 . 1 . . 636 . A 275 VAL CA . 34088 2 724 . 1 1 275 275 VAL CB C 13 36.094 0.079 . 1 . . 1132 . A 275 VAL CB . 34088 2 725 . 1 1 275 275 VAL CG1 C 13 21.893 0.148 . 1 . . 638 . A 275 VAL CG1 . 34088 2 726 . 1 1 275 275 VAL N N 15 119.266 0.016 . 1 . . 635 . A 275 VAL N . 34088 2 727 . 1 1 276 276 GLY C C 13 171.990 0.064 . 1 . . 1159 . A 276 GLY C . 34088 2 728 . 1 1 276 276 GLY CA C 13 46.144 0.115 . 1 . . 370 . A 276 GLY CA . 34088 2 729 . 1 1 276 276 GLY N N 15 111.759 0.14 . 1 . . 371 . A 276 GLY N . 34088 2 730 . 1 1 277 277 VAL CA C 13 60.033 0.063 . 1 . . 1208 . A 277 VAL CA . 34088 2 731 . 1 1 277 277 VAL CB C 13 36.286 0.066 . 1 . . 1209 . A 277 VAL CB . 34088 2 732 . 1 1 278 278 ASN C C 13 172.954 . . 1 . . 1150 . A 278 ASN C . 34088 2 733 . 1 1 278 278 ASN CA C 13 53.385 0.115 . 1 . . 1200 . A 278 ASN CA . 34088 2 734 . 1 1 278 278 ASN CB C 13 44.925 0.177 . 1 . . 1201 . A 278 ASN CB . 34088 2 735 . 1 1 278 278 ASN CG C 13 178.105 . . 1 . . 1283 . A 278 ASN CG . 34088 2 736 . 1 1 279 279 TYR CA C 13 57.010 0.206 . 1 . . 1210 . A 279 TYR CA . 34088 2 737 . 1 1 279 279 TYR CB C 13 42.201 0.022 . 1 . . 1211 . A 279 TYR CB . 34088 2 738 . 1 1 280 280 SER C C 13 173.890 . . 1 . . 1221 . A 280 SER C . 34088 2 739 . 1 1 280 280 SER CA C 13 56.492 0.127 . 1 . . 407 . A 280 SER CA . 34088 2 740 . 1 1 280 280 SER CB C 13 66.275 0.094 . 1 . . 406 . A 280 SER CB . 34088 2 741 . 1 1 280 280 SER N N 15 123.984 0.478 . 1 . . 1223 . A 280 SER N . 34088 2 742 . 1 1 281 281 PHE CA C 13 58.571 0.162 . 1 . . 1248 . A 281 PHE CA . 34088 2 743 . 1 1 281 281 PHE CG C 13 141.025 0.097 . 1 . . 1249 . A 281 PHE CG . 34088 2 744 . 1 1 281 281 PHE N N 15 127.445 . . 1 . . 1250 . A 281 PHE N . 34088 2 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_chemical_shifts_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_3 _Assigned_chem_shift_list.Entry_ID 34088 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details ; Shift list corresponding to the shifts found doing a back-bone walk. List includes H, N, CA, CB and CO chemical shifts. As indicated, the sample used was deuterated and back-exchanged. Therefore an isotope shift is present compared to the shifts in shift list 2. This isotope shift is most pronounced in the CB chemical shifts. ; _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D (H)N(HH)NH RFDR 2ms' . . . 34088 3 2 '3D (H)NHH RFDR 2ms' . . . 34088 3 3 '2D 13C-13C DARR 200ms' . . . 34088 3 4 '2D 13C-13C DARR 400ms' . . . 34088 3 5 '2D 13C-13C DARR 200ms' . . . 34088 3 6 '2D 13C-13C DARR 400ms' . . . 34088 3 7 '2D 13C-13C DARR 400ms' . . . 34088 3 8 '2D 13C-13C DARR 150ms' . . . 34088 3 9 '2D 13C-13C DARR 150ms' . . . 34088 3 10 '2D 13C-13C DARR 400ms' . . . 34088 3 11 '2D 13C-13C DARR 150ms' . . . 34088 3 12 '2D 13C-13C DARR 400ms' . . . 34088 3 13 '2D 13C-13C DARR 500ms' . . . 34088 3 14 '3D (H)CANH' . . . 34088 3 15 '3D (H)CANH' . . . 34088 3 16 '3D (HCO)CA(CO)NH' . . . 34088 3 17 '3D (HCA)CB(CA)NH' . . . 34088 3 18 '3D (HCA)CBCA(CO)NH' . . . 34088 3 19 '3D (H)CONH' . . . 34088 3 20 '3D (H)CO(CA)NH' . . . 34088 3 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 8 8 HIS H H 1 8.790 . . 1 . . 1220 . A 8 HIS H . 34088 3 2 . 1 1 8 8 HIS C C 13 174.505 . . 1 . . 1253 . A 8 HIS C . 34088 3 3 . 1 1 8 8 HIS CA C 13 55.008 0.197 . 1 . . 168 . A 8 HIS CA . 34088 3 4 . 1 1 8 8 HIS N N 15 118.559 0.05 . 1 . . 1219 . A 8 HIS N . 34088 3 5 . 1 1 9 9 PHE H H 1 9.295 0.033 . 1 . . 860 . A 9 PHE H . 34088 3 6 . 1 1 9 9 PHE C C 13 174.384 0.067 . 1 . . 1252 . A 9 PHE C . 34088 3 7 . 1 1 9 9 PHE CA C 13 57.316 0.081 . 1 . . 1204 . A 9 PHE CA . 34088 3 8 . 1 1 9 9 PHE CB C 13 43.018 . . 1 . . 1205 . A 9 PHE CB . 34088 3 9 . 1 1 9 9 PHE N N 15 123.478 0.106 . 1 . . 1227 . A 9 PHE N . 34088 3 10 . 1 1 10 10 ASN H H 1 8.687 0.025 . 1 . . 1008 . A 10 ASN H . 34088 3 11 . 1 1 10 10 ASN HD21 H 1 6.706 0.004 . 1 . . 1276 . A 10 ASN HD21 . 34088 3 12 . 1 1 10 10 ASN C C 13 173.704 . . 1 . . 1263 . A 10 ASN C . 34088 3 13 . 1 1 10 10 ASN CA C 13 54.235 0.104 . 1 . . 1199 . A 10 ASN CA . 34088 3 14 . 1 1 10 10 ASN CB C 13 43.787 0.081 . 1 . . 1198 . A 10 ASN CB . 34088 3 15 . 1 1 10 10 ASN CG C 13 178.495 . . 1 . . 1278 . A 10 ASN CG . 34088 3 16 . 1 1 10 10 ASN N N 15 116.655 0.174 . 1 . . 1007 . A 10 ASN N . 34088 3 17 . 1 1 10 10 ASN ND2 N 15 115.800 0.017 . 1 . . 1277 . A 10 ASN ND2 . 34088 3 18 . 1 1 11 11 ILE H H 1 9.457 0.003 . 1 . . 1193 . A 11 ILE H . 34088 3 19 . 1 1 11 11 ILE C C 13 175.427 . . 1 . . 1268 . A 11 ILE C . 34088 3 20 . 1 1 11 11 ILE CA C 13 59.448 0.246 . 1 . . 215 . A 11 ILE CA . 34088 3 21 . 1 1 11 11 ILE CB C 13 43.002 0.224 . 1 . . 214 . A 11 ILE CB . 34088 3 22 . 1 1 11 11 ILE N N 15 116.613 0.011 . 1 . . 1192 . A 11 ILE N . 34088 3 23 . 1 1 12 12 GLY H H 1 7.830 0.028 . 1 . . 882 . A 12 GLY H . 34088 3 24 . 1 1 12 12 GLY C C 13 170.440 0.068 . 1 . . 766 . A 12 GLY C . 34088 3 25 . 1 1 12 12 GLY CA C 13 46.932 0.071 . 1 . . 725 . A 12 GLY CA . 34088 3 26 . 1 1 12 12 GLY N N 15 110.642 0.344 . 1 . . 604 . A 12 GLY N . 34088 3 27 . 1 1 13 13 ALA H H 1 8.562 0.082 . 1 . . 724 . A 13 ALA H . 34088 3 28 . 1 1 13 13 ALA C C 13 175.962 0.103 . 1 . . 271 . A 13 ALA C . 34088 3 29 . 1 1 13 13 ALA CA C 13 51.082 0.068 . 1 . . 261 . A 13 ALA CA . 34088 3 30 . 1 1 13 13 ALA CB C 13 23.732 0.076 . 1 . . 260 . A 13 ALA CB . 34088 3 31 . 1 1 13 13 ALA N N 15 116.639 0.184 . 1 . . 262 . A 13 ALA N . 34088 3 32 . 1 1 14 14 MET H H 1 9.389 0.028 . 1 . . 1145 . A 14 MET H . 34088 3 33 . 1 1 14 14 MET CA C 13 55.050 0.039 . 1 . . 1144 . A 14 MET CA . 34088 3 34 . 1 1 14 14 MET CB C 13 37.344 . . 1 . . 682 . A 14 MET CB . 34088 3 35 . 1 1 14 14 MET N N 15 120.008 0.324 . 1 . . 1168 . A 14 MET N . 34088 3 36 . 1 1 15 15 TYR H H 1 9.297 0.028 . 1 . . 859 . A 15 TYR H . 34088 3 37 . 1 1 15 15 TYR CA C 13 59.541 0.064 . 1 . . 331 . A 15 TYR CA . 34088 3 38 . 1 1 15 15 TYR N N 15 122.415 0.271 . 1 . . 330 . A 15 TYR N . 34088 3 39 . 1 1 16 16 GLU H H 1 7.482 0.017 . 1 . . 1172 . A 16 GLU H . 34088 3 40 . 1 1 16 16 GLU CA C 13 54.236 . . 1 . . 1171 . A 16 GLU CA . 34088 3 41 . 1 1 16 16 GLU N N 15 126.092 0.066 . 1 . . 1170 . A 16 GLU N . 34088 3 42 . 1 1 31 31 ALA C C 13 178.968 . . 1 . . 1194 . A 31 ALA C . 34088 3 43 . 1 1 31 31 ALA CA C 13 51.816 . . 1 . . 249 . A 31 ALA CA . 34088 3 44 . 1 1 32 32 GLU H H 1 8.759 0.023 . 1 . . 1122 . A 32 GLU H . 34088 3 45 . 1 1 32 32 GLU CA C 13 52.419 0.001 . 1 . . 1123 . A 32 GLU CA . 34088 3 46 . 1 1 32 32 GLU N N 15 121.470 0.061 . 1 . . 707 . A 32 GLU N . 34088 3 47 . 1 1 33 33 PRO C C 13 176.010 . . 1 . . 625 . A 33 PRO C . 34088 3 48 . 1 1 33 33 PRO CA C 13 62.446 0.247 . 1 . . 48 . A 33 PRO CA . 34088 3 49 . 1 1 34 34 SER H H 1 9.452 0.037 . 1 . . 771 . A 34 SER H . 34088 3 50 . 1 1 34 34 SER C C 13 172.750 . . 1 . . 626 . A 34 SER C . 34088 3 51 . 1 1 34 34 SER CA C 13 58.975 0.04 . 1 . . 417 . A 34 SER CA . 34088 3 52 . 1 1 34 34 SER N N 15 110.558 0.413 . 1 . . 418 . A 34 SER N . 34088 3 53 . 1 1 35 35 VAL H H 1 9.050 0.044 . 1 . . 879 . A 35 VAL H . 34088 3 54 . 1 1 35 35 VAL CA C 13 59.479 0.044 . 1 . . 628 . A 35 VAL CA . 34088 3 55 . 1 1 35 35 VAL CB C 13 36.212 . . 1 . . 629 . A 35 VAL CB . 34088 3 56 . 1 1 35 35 VAL N N 15 111.504 0.218 . 1 . . 627 . A 35 VAL N . 34088 3 57 . 1 1 36 36 TYR CA C 13 57.834 0.406 . 1 . . 312 . A 36 TYR CA . 34088 3 58 . 1 1 36 36 TYR CB C 13 41.696 . . 1 . . 311 . A 36 TYR CB . 34088 3 59 . 1 1 37 37 PHE H H 1 9.228 0.035 . 1 . . 949 . A 37 PHE H . 34088 3 60 . 1 1 37 37 PHE C C 13 174.496 0.052 . 1 . . 950 . A 37 PHE C . 34088 3 61 . 1 1 37 37 PHE CA C 13 56.473 0.109 . 1 . . 307 . A 37 PHE CA . 34088 3 62 . 1 1 37 37 PHE CB C 13 44.809 0.043 . 1 . . 306 . A 37 PHE CB . 34088 3 63 . 1 1 37 37 PHE N N 15 118.645 0.225 . 1 . . 308 . A 37 PHE N . 34088 3 64 . 1 1 38 38 ASN H H 1 9.347 0.027 . 1 . . 951 . A 38 ASN H . 34088 3 65 . 1 1 38 38 ASN HD21 H 1 5.744 0.038 . 1 . . 922 . A 38 ASN HD21 . 34088 3 66 . 1 1 38 38 ASN C C 13 172.184 0.059 . 1 . . 545 . A 38 ASN C . 34088 3 67 . 1 1 38 38 ASN CA C 13 53.109 0.048 . 1 . . 862 . A 38 ASN CA . 34088 3 68 . 1 1 38 38 ASN CB C 13 42.695 0.113 . 1 . . 546 . A 38 ASN CB . 34088 3 69 . 1 1 38 38 ASN CG C 13 175.246 . . 1 . . 923 . A 38 ASN CG . 34088 3 70 . 1 1 38 38 ASN N N 15 122.089 0.181 . 1 . . 1267 . A 38 ASN N . 34088 3 71 . 1 1 38 38 ASN ND2 N 15 109.181 0.312 . 1 . . 921 . A 38 ASN ND2 . 34088 3 72 . 1 1 39 39 ALA H H 1 9.126 0.043 . 1 . . 730 . A 39 ALA H . 34088 3 73 . 1 1 39 39 ALA C C 13 175.330 0.044 . 1 . . 270 . A 39 ALA C . 34088 3 74 . 1 1 39 39 ALA CA C 13 51.067 0.08 . 1 . . 257 . A 39 ALA CA . 34088 3 75 . 1 1 39 39 ALA CB C 13 24.484 0.158 . 1 . . 256 . A 39 ALA CB . 34088 3 76 . 1 1 39 39 ALA N N 15 120.451 0.268 . 1 . . 259 . A 39 ALA N . 34088 3 77 . 1 1 40 40 ALA H H 1 9.006 0.049 . 1 . . 747 . A 40 ALA H . 34088 3 78 . 1 1 40 40 ALA C C 13 176.046 0.088 . 1 . . 573 . A 40 ALA C . 34088 3 79 . 1 1 40 40 ALA CA C 13 51.172 0.084 . 1 . . 266 . A 40 ALA CA . 34088 3 80 . 1 1 40 40 ALA CB C 13 23.548 0.079 . 1 . . 265 . A 40 ALA CB . 34088 3 81 . 1 1 40 40 ALA N N 15 123.634 0.22 . 1 . . 267 . A 40 ALA N . 34088 3 82 . 1 1 41 41 ASN H H 1 8.095 0.037 . 1 . . 728 . A 41 ASN H . 34088 3 83 . 1 1 41 41 ASN C C 13 175.587 0.046 . 1 . . 1266 . A 41 ASN C . 34088 3 84 . 1 1 41 41 ASN CA C 13 53.195 0.253 . 1 . . 727 . A 41 ASN CA . 34088 3 85 . 1 1 41 41 ASN CB C 13 38.881 0.162 . 1 . . 824 . A 41 ASN CB . 34088 3 86 . 1 1 41 41 ASN N N 15 118.359 0.117 . 1 . . 726 . A 41 ASN N . 34088 3 87 . 1 1 42 42 GLY H H 1 8.939 0.036 . 1 . . 935 . A 42 GLY H . 34088 3 88 . 1 1 42 42 GLY C C 13 174.033 . . 1 . . 384 . A 42 GLY C . 34088 3 89 . 1 1 42 42 GLY CA C 13 45.290 0.037 . 1 . . 385 . A 42 GLY CA . 34088 3 90 . 1 1 42 42 GLY N N 15 116.959 0.17 . 1 . . 386 . A 42 GLY N . 34088 3 91 . 1 1 43 43 PRO C C 13 176.432 . . 1 . . 970 . A 43 PRO C . 34088 3 92 . 1 1 43 43 PRO CA C 13 63.678 0.107 . 1 . . 59 . A 43 PRO CA . 34088 3 93 . 1 1 43 43 PRO CB C 13 31.921 0.023 . 1 . . 57 . A 43 PRO CB . 34088 3 94 . 1 1 44 44 TRP H H 1 8.063 0.054 . 1 . . 762 . A 44 TRP H . 34088 3 95 . 1 1 44 44 TRP C C 13 177.612 . . 1 . . 190 . A 44 TRP C . 34088 3 96 . 1 1 44 44 TRP CA C 13 57.739 0.089 . 1 . . 149 . A 44 TRP CA . 34088 3 97 . 1 1 44 44 TRP CB C 13 33.266 0.138 . 1 . . 148 . A 44 TRP CB . 34088 3 98 . 1 1 44 44 TRP N N 15 122.578 0.148 . 1 . . 761 . A 44 TRP N . 34088 3 99 . 1 1 45 45 ARG H H 1 9.232 0.032 . 1 . . 816 . A 45 ARG H . 34088 3 100 . 1 1 45 45 ARG C C 13 174.978 . . 1 . . 764 . A 45 ARG C . 34088 3 101 . 1 1 45 45 ARG CA C 13 56.541 0.146 . 1 . . 815 . A 45 ARG CA . 34088 3 102 . 1 1 45 45 ARG CB C 13 34.068 0.157 . 1 . . 817 . A 45 ARG CB . 34088 3 103 . 1 1 45 45 ARG N N 15 121.660 0.149 . 1 . . 1254 . A 45 ARG N . 34088 3 104 . 1 1 46 46 ILE H H 1 9.775 0.02 . 1 . . 712 . A 46 ILE H . 34088 3 105 . 1 1 46 46 ILE C C 13 173.856 . . 1 . . 497 . A 46 ILE C . 34088 3 106 . 1 1 46 46 ILE CA C 13 60.880 0.088 . 1 . . 193 . A 46 ILE CA . 34088 3 107 . 1 1 46 46 ILE CB C 13 41.460 0.092 . 1 . . 192 . A 46 ILE CB . 34088 3 108 . 1 1 46 46 ILE N N 15 126.908 0.253 . 1 . . 498 . A 46 ILE N . 34088 3 109 . 1 1 47 47 ALA H H 1 9.599 0.029 . 1 . . 714 . A 47 ALA H . 34088 3 110 . 1 1 47 47 ALA C C 13 175.450 0.092 . 1 . . 505 . A 47 ALA C . 34088 3 111 . 1 1 47 47 ALA CA C 13 51.619 0.222 . 1 . . 278 . A 47 ALA CA . 34088 3 112 . 1 1 47 47 ALA CB C 13 23.459 0.09 . 1 . . 277 . A 47 ALA CB . 34088 3 113 . 1 1 47 47 ALA N N 15 128.890 0.162 . 1 . . 279 . A 47 ALA N . 34088 3 114 . 1 1 48 48 LEU H H 1 9.617 0.045 . 1 . . 734 . A 48 LEU H . 34088 3 115 . 1 1 48 48 LEU C C 13 176.528 0.095 . 1 . . 84 . A 48 LEU C . 34088 3 116 . 1 1 48 48 LEU CA C 13 54.266 0.058 . 1 . . 126 . A 48 LEU CA . 34088 3 117 . 1 1 48 48 LEU CB C 13 46.281 0.17 . 1 . . 83 . A 48 LEU CB . 34088 3 118 . 1 1 48 48 LEU N N 15 123.034 0.289 . 1 . . 504 . A 48 LEU N . 34088 3 119 . 1 1 49 49 ALA H H 1 9.199 0.099 . 1 . . 952 . A 49 ALA H . 34088 3 120 . 1 1 49 49 ALA C C 13 175.425 . . 1 . . 286 . A 49 ALA C . 34088 3 121 . 1 1 49 49 ALA CA C 13 52.282 0.071 . 1 . . 809 . A 49 ALA CA . 34088 3 122 . 1 1 49 49 ALA CB C 13 23.929 0.232 . 1 . . 808 . A 49 ALA CB . 34088 3 123 . 1 1 49 49 ALA N N 15 122.721 0.478 . 1 . . 285 . A 49 ALA N . 34088 3 124 . 1 1 50 50 TYR H H 1 9.090 0.072 . 1 . . 953 . A 50 TYR H . 34088 3 125 . 1 1 50 50 TYR C C 13 172.070 . . 1 . . 974 . A 50 TYR C . 34088 3 126 . 1 1 50 50 TYR CA C 13 60.071 0.113 . 1 . . 320 . A 50 TYR CA . 34088 3 127 . 1 1 50 50 TYR CB C 13 42.094 0.154 . 1 . . 319 . A 50 TYR CB . 34088 3 128 . 1 1 50 50 TYR N N 15 118.407 0.213 . 1 . . 321 . A 50 TYR N . 34088 3 129 . 1 1 51 51 TYR H H 1 6.144 0.046 . 1 . . 669 . A 51 TYR H . 34088 3 130 . 1 1 51 51 TYR C C 13 171.796 . . 1 . . 1163 . A 51 TYR C . 34088 3 131 . 1 1 51 51 TYR CA C 13 55.499 0.007 . 1 . . 292 . A 51 TYR CA . 34088 3 132 . 1 1 51 51 TYR CB C 13 43.312 0.213 . 1 . . 291 . A 51 TYR CB . 34088 3 133 . 1 1 51 51 TYR N N 15 128.302 0.247 . 1 . . 293 . A 51 TYR N . 34088 3 134 . 1 1 52 52 GLN H H 1 7.431 0.028 . 1 . . 801 . A 52 GLN H . 34088 3 135 . 1 1 52 52 GLN CA C 13 54.546 0.065 . 1 . . 1387 . A 52 GLN CA . 34088 3 136 . 1 1 52 52 GLN CB C 13 34.856 . . 1 . . 1386 . A 52 GLN CB . 34088 3 137 . 1 1 52 52 GLN N N 15 126.655 0.204 . 1 . . 800 . A 52 GLN N . 34088 3 138 . 1 1 67 67 PHE H H 1 8.775 0.003 . 1 . . 969 . A 67 PHE H . 34088 3 139 . 1 1 67 67 PHE C C 13 173.781 . . 1 . . 1286 . A 67 PHE C . 34088 3 140 . 1 1 67 67 PHE CA C 13 56.306 0.132 . 1 . . 1176 . A 67 PHE CA . 34088 3 141 . 1 1 67 67 PHE CB C 13 42.199 . . 1 . . 299 . A 67 PHE CB . 34088 3 142 . 1 1 67 67 PHE N N 15 114.625 0.111 . 1 . . 300 . A 67 PHE N . 34088 3 143 . 1 1 68 68 ASP H H 1 9.034 0.015 . 1 . . 1089 . A 68 ASP H . 34088 3 144 . 1 1 68 68 ASP CA C 13 52.308 0.057 . 1 . . 1175 . A 68 ASP CA . 34088 3 145 . 1 1 68 68 ASP CB C 13 42.349 . . 1 . . 1202 . A 68 ASP CB . 34088 3 146 . 1 1 68 68 ASP N N 15 118.602 0.093 . 1 . . 1088 . A 68 ASP N . 34088 3 147 . 1 1 69 69 ARG H H 1 8.284 0.018 . 1 . . 1115 . A 69 ARG H . 34088 3 148 . 1 1 69 69 ARG CA C 13 53.796 0.003 . 1 . . 427 . A 69 ARG CA . 34088 3 149 . 1 1 69 69 ARG N N 15 118.601 0.004 . 1 . . 1255 . A 69 ARG N . 34088 3 150 . 1 1 70 70 PRO C C 13 176.085 . . 1 . . 1179 . A 70 PRO C . 34088 3 151 . 1 1 70 70 PRO CA C 13 63.736 . . 1 . . 53 . A 70 PRO CA . 34088 3 152 . 1 1 70 70 PRO CB C 13 32.891 . . 1 . . 1177 . A 70 PRO CB . 34088 3 153 . 1 1 71 71 GLU H H 1 8.962 0.041 . 1 . . 905 . A 71 GLU H . 34088 3 154 . 1 1 71 71 GLU CA C 13 55.390 0.045 . 1 . . 907 . A 71 GLU CA . 34088 3 155 . 1 1 71 71 GLU CB C 13 35.675 0.158 . 1 . . 908 . A 71 GLU CB . 34088 3 156 . 1 1 71 71 GLU N N 15 119.632 0.209 . 1 . . 906 . A 71 GLU N . 34088 3 157 . 1 1 72 72 LEU H H 1 8.963 0.029 . 1 . . 983 . A 72 LEU H . 34088 3 158 . 1 1 72 72 LEU CA C 13 54.707 0.208 . 1 . . 982 . A 72 LEU CA . 34088 3 159 . 1 1 72 72 LEU CB C 13 46.893 0.128 . 1 . . 119 . A 72 LEU CB . 34088 3 160 . 1 1 72 72 LEU N N 15 125.080 0.08 . 1 . . 981 . A 72 LEU N . 34088 3 161 . 1 1 73 73 GLU H H 1 9.738 0.022 . 1 . . 973 . A 73 GLU H . 34088 3 162 . 1 1 73 73 GLU CA C 13 55.969 0.041 . 1 . . 543 . A 73 GLU CA . 34088 3 163 . 1 1 73 73 GLU CB C 13 34.711 0.069 . 1 . . 1188 . A 73 GLU CB . 34088 3 164 . 1 1 73 73 GLU N N 15 121.954 0.199 . 1 . . 544 . A 73 GLU N . 34088 3 165 . 1 1 74 74 VAL H H 1 9.403 0.023 . 1 . . 954 . A 74 VAL H . 34088 3 166 . 1 1 74 74 VAL C C 13 173.592 . . 1 . . 765 . A 74 VAL C . 34088 3 167 . 1 1 74 74 VAL CA C 13 60.921 0.075 . 1 . . 689 . A 74 VAL CA . 34088 3 168 . 1 1 74 74 VAL CB C 13 35.393 0.064 . 1 . . 686 . A 74 VAL CB . 34088 3 169 . 1 1 74 74 VAL N N 15 120.099 0.17 . 1 . . 934 . A 74 VAL N . 34088 3 170 . 1 1 75 75 HIS H H 1 9.784 0.021 . 1 . . 721 . A 75 HIS H . 34088 3 171 . 1 1 75 75 HIS C C 13 172.555 0.063 . 1 . . 187 . A 75 HIS C . 34088 3 172 . 1 1 75 75 HIS CA C 13 54.708 0.049 . 1 . . 172 . A 75 HIS CA . 34088 3 173 . 1 1 75 75 HIS CB C 13 32.706 0.176 . 1 . . 171 . A 75 HIS CB . 34088 3 174 . 1 1 75 75 HIS N N 15 125.173 0.229 . 1 . . 352 . A 75 HIS N . 34088 3 175 . 1 1 76 76 TYR H H 1 8.306 0.028 . 1 . . 927 . A 76 TYR H . 34088 3 176 . 1 1 76 76 TYR C C 13 173.420 0.1 . 1 . . 872 . A 76 TYR C . 34088 3 177 . 1 1 76 76 TYR CA C 13 56.631 0.118 . 1 . . 358 . A 76 TYR CA . 34088 3 178 . 1 1 76 76 TYR CB C 13 42.696 0.185 . 1 . . 357 . A 76 TYR CB . 34088 3 179 . 1 1 76 76 TYR N N 15 125.203 0.188 . 1 . . 359 . A 76 TYR N . 34088 3 180 . 1 1 77 77 GLN H H 1 7.880 0.054 . 1 . . 786 . A 77 GLN H . 34088 3 181 . 1 1 77 77 GLN C C 13 173.672 0.117 . 1 . . 873 . A 77 GLN C . 34088 3 182 . 1 1 77 77 GLN CA C 13 54.045 0.091 . 1 . . 785 . A 77 GLN CA . 34088 3 183 . 1 1 77 77 GLN CB C 13 28.210 0.152 . 1 . . 799 . A 77 GLN CB . 34088 3 184 . 1 1 77 77 GLN N N 15 129.042 0.274 . 1 . . 784 . A 77 GLN N . 34088 3 185 . 1 1 78 78 PHE H H 1 8.218 0.032 . 1 . . 1128 . A 78 PHE H . 34088 3 186 . 1 1 78 78 PHE CA C 13 62.517 0.001 . 1 . . 1126 . A 78 PHE CA . 34088 3 187 . 1 1 78 78 PHE N N 15 125.752 0.213 . 1 . . 1127 . A 78 PHE N . 34088 3 188 . 1 1 85 85 SER CA C 13 57.830 . . 1 . . 419 . A 85 SER CA . 34088 3 189 . 1 1 85 85 SER CB C 13 67.028 . . 1 . . 1273 . A 85 SER CB . 34088 3 190 . 1 1 86 86 PHE H H 1 8.672 0.037 . 1 . . 1112 . A 86 PHE H . 34088 3 191 . 1 1 86 86 PHE CA C 13 58.827 0.013 . 1 . . 346 . A 86 PHE CA . 34088 3 192 . 1 1 86 86 PHE CB C 13 44.681 . . 1 . . 1287 . A 86 PHE CB . 34088 3 193 . 1 1 86 86 PHE N N 15 121.766 0.147 . 1 . . 347 . A 86 PHE N . 34088 3 194 . 1 1 87 87 GLY H H 1 8.800 0.065 . 1 . . 1114 . A 87 GLY H . 34088 3 195 . 1 1 87 87 GLY C C 13 170.426 . . 1 . . 387 . A 87 GLY C . 34088 3 196 . 1 1 87 87 GLY CA C 13 45.235 0.133 . 1 . . 388 . A 87 GLY CA . 34088 3 197 . 1 1 87 87 GLY N N 15 118.463 0.071 . 1 . . 1113 . A 87 GLY N . 34088 3 198 . 1 1 88 88 LEU H H 1 7.951 0.04 . 1 . . 717 . A 88 LEU H . 34088 3 199 . 1 1 88 88 LEU C C 13 174.248 0.123 . 1 . . 78 . A 88 LEU C . 34088 3 200 . 1 1 88 88 LEU CA C 13 54.782 0.116 . 1 . . 87 . A 88 LEU CA . 34088 3 201 . 1 1 88 88 LEU CB C 13 48.721 0.187 . 1 . . 77 . A 88 LEU CB . 34088 3 202 . 1 1 88 88 LEU N N 15 117.112 0.128 . 1 . . 522 . A 88 LEU N . 34088 3 203 . 1 1 89 89 THR H H 1 8.536 0.029 . 1 . . 733 . A 89 THR H . 34088 3 204 . 1 1 89 89 THR C C 13 174.717 . . 1 . . 531 . A 89 THR C . 34088 3 205 . 1 1 89 89 THR CA C 13 62.192 0.121 . 1 . . 20 . A 89 THR CA . 34088 3 206 . 1 1 89 89 THR CB C 13 71.353 0.08 . 1 . . 21 . A 89 THR CB . 34088 3 207 . 1 1 89 89 THR N N 15 121.846 0.349 . 1 . . 465 . A 89 THR N . 34088 3 208 . 1 1 90 90 GLY H H 1 9.600 0.028 . 1 . . 735 . A 90 GLY H . 34088 3 209 . 1 1 90 90 GLY C C 13 172.835 0.09 . 1 . . 528 . A 90 GLY C . 34088 3 210 . 1 1 90 90 GLY CA C 13 44.576 0.125 . 1 . . 529 . A 90 GLY CA . 34088 3 211 . 1 1 90 90 GLY N N 15 113.639 0.096 . 1 . . 530 . A 90 GLY N . 34088 3 212 . 1 1 91 91 GLY H H 1 9.435 0.042 . 1 . . 668 . A 91 GLY H . 34088 3 213 . 1 1 91 91 GLY C C 13 170.333 0.083 . 1 . . 367 . A 91 GLY C . 34088 3 214 . 1 1 91 91 GLY CA C 13 46.398 0.113 . 1 . . 368 . A 91 GLY CA . 34088 3 215 . 1 1 91 91 GLY N N 15 109.198 0.1 . 1 . . 369 . A 91 GLY N . 34088 3 216 . 1 1 92 92 PHE H H 1 9.227 0.027 . 1 . . 720 . A 92 PHE H . 34088 3 217 . 1 1 92 92 PHE C C 13 173.312 . . 1 . . 904 . A 92 PHE C . 34088 3 218 . 1 1 92 92 PHE CA C 13 57.355 0.093 . 1 . . 575 . A 92 PHE CA . 34088 3 219 . 1 1 92 92 PHE CB C 13 43.749 0.138 . 1 . . 574 . A 92 PHE CB . 34088 3 220 . 1 1 92 92 PHE N N 15 120.609 0.121 . 1 . . 576 . A 92 PHE N . 34088 3 221 . 1 1 93 93 ARG H H 1 7.650 0.024 . 1 . . 902 . A 93 ARG H . 34088 3 222 . 1 1 93 93 ARG C C 13 174.995 . . 1 . . 551 . A 93 ARG C . 34088 3 223 . 1 1 93 93 ARG CA C 13 54.342 0.092 . 1 . . 435 . A 93 ARG CA . 34088 3 224 . 1 1 93 93 ARG CB C 13 36.815 0.049 . 1 . . 434 . A 93 ARG CB . 34088 3 225 . 1 1 93 93 ARG N N 15 124.041 0.264 . 1 . . 903 . A 93 ARG N . 34088 3 226 . 1 1 94 94 ASN H H 1 7.654 0.043 . 1 . . 828 . A 94 ASN H . 34088 3 227 . 1 1 94 94 ASN CA C 13 53.460 0.083 . 1 . . 827 . A 94 ASN CA . 34088 3 228 . 1 1 94 94 ASN N N 15 117.282 0.258 . 1 . . 826 . A 94 ASN N . 34088 3 229 . 1 1 95 95 TYR H H 1 9.527 0.034 . 1 . . 858 . A 95 TYR H . 34088 3 230 . 1 1 95 95 TYR C C 13 175.208 . . 1 . . 1180 . A 95 TYR C . 34088 3 231 . 1 1 95 95 TYR CA C 13 56.915 0.02 . 1 . . 857 . A 95 TYR CA . 34088 3 232 . 1 1 95 95 TYR N N 15 122.931 0.11 . 1 . . 310 . A 95 TYR N . 34088 3 233 . 1 1 96 96 GLY H H 1 9.262 0.042 . 1 . . 1117 . A 96 GLY H . 34088 3 234 . 1 1 96 96 GLY C C 13 171.937 . . 1 . . 581 . A 96 GLY C . 34088 3 235 . 1 1 96 96 GLY CA C 13 45.952 0.098 . 1 . . 582 . A 96 GLY CA . 34088 3 236 . 1 1 96 96 GLY N N 15 112.425 0.453 . 1 . . 1116 . A 96 GLY N . 34088 3 237 . 1 1 97 97 TYR H H 1 8.554 0.055 . 1 . . 763 . A 97 TYR H . 34088 3 238 . 1 1 97 97 TYR CA C 13 59.642 0.1 . 1 . . 327 . A 97 TYR CA . 34088 3 239 . 1 1 97 97 TYR N N 15 122.857 0.28 . 1 . . 1121 . A 97 TYR N . 34088 3 240 . 1 1 107 107 THR CA C 13 60.249 0.185 . 1 . . 43 . A 107 THR CA . 34088 3 241 . 1 1 108 108 ALA H H 1 8.122 0.018 . 1 . . 731 . A 108 ALA H . 34088 3 242 . 1 1 108 108 ALA C C 13 176.165 0.092 . 1 . . 284 . A 108 ALA C . 34088 3 243 . 1 1 108 108 ALA CA C 13 52.263 0.051 . 1 . . 282 . A 108 ALA CA . 34088 3 244 . 1 1 108 108 ALA N N 15 120.759 0.29 . 1 . . 283 . A 108 ALA N . 34088 3 245 . 1 1 109 109 ASN H H 1 10.058 0.106 . 1 . . 842 . A 109 ASN H . 34088 3 246 . 1 1 109 109 ASN C C 13 172.101 0.025 . 1 . . 1136 . A 109 ASN C . 34088 3 247 . 1 1 109 109 ASN CA C 13 54.550 0.072 . 1 . . 841 . A 109 ASN CA . 34088 3 248 . 1 1 109 109 ASN CB C 13 43.175 . . 1 . . 590 . A 109 ASN CB . 34088 3 249 . 1 1 109 109 ASN N N 15 121.401 0.23 . 1 . . 840 . A 109 ASN N . 34088 3 250 . 1 1 110 110 MET H H 1 8.606 0.031 . 1 . . 803 . A 110 MET H . 34088 3 251 . 1 1 110 110 MET C C 13 175.521 0.167 . 1 . . 1135 . A 110 MET C . 34088 3 252 . 1 1 110 110 MET CA C 13 53.697 0.056 . 1 . . 802 . A 110 MET CA . 34088 3 253 . 1 1 110 110 MET CB C 13 36.923 0.073 . 1 . . 804 . A 110 MET CB . 34088 3 254 . 1 1 110 110 MET N N 15 126.242 0.181 . 1 . . 547 . A 110 MET N . 34088 3 255 . 1 1 111 111 GLN H H 1 9.682 0.043 . 1 . . 797 . A 111 GLN H . 34088 3 256 . 1 1 111 111 GLN C C 13 175.184 0.052 . 1 . . 1140 . A 111 GLN C . 34088 3 257 . 1 1 111 111 GLN CA C 13 56.819 0.132 . 1 . . 796 . A 111 GLN CA . 34088 3 258 . 1 1 111 111 GLN CB C 13 30.837 0.08 . 1 . . 798 . A 111 GLN CB . 34088 3 259 . 1 1 111 111 GLN N N 15 124.661 0.113 . 1 . . 795 . A 111 GLN N . 34088 3 260 . 1 1 112 112 ARG H H 1 8.522 0.032 . 1 . . 1087 . A 112 ARG H . 34088 3 261 . 1 1 112 112 ARG C C 13 175.199 0.047 . 1 . . 1141 . A 112 ARG C . 34088 3 262 . 1 1 112 112 ARG CA C 13 54.692 0.036 . 1 . . 1134 . A 112 ARG CA . 34088 3 263 . 1 1 112 112 ARG CB C 13 36.165 0.046 . 1 . . 1016 . A 112 ARG CB . 34088 3 264 . 1 1 112 112 ARG N N 15 118.356 0.165 . 1 . . 1086 . A 112 ARG N . 34088 3 265 . 1 1 113 113 TRP H H 1 9.678 0.029 . 1 . . 758 . A 113 TRP H . 34088 3 266 . 1 1 113 113 TRP C C 13 175.358 0.051 . 1 . . 189 . A 113 TRP C . 34088 3 267 . 1 1 113 113 TRP CA C 13 56.234 0.07 . 1 . . 143 . A 113 TRP CA . 34088 3 268 . 1 1 113 113 TRP CB C 13 31.863 0.211 . 1 . . 142 . A 113 TRP CB . 34088 3 269 . 1 1 113 113 TRP N N 15 132.863 0.151 . 1 . . 759 . A 113 TRP N . 34088 3 270 . 1 1 114 114 LYS H H 1 9.170 0.054 . 1 . . 1055 . A 114 LYS H . 34088 3 271 . 1 1 114 114 LYS C C 13 175.154 . . 1 . . 1181 . A 114 LYS C . 34088 3 272 . 1 1 114 114 LYS CA C 13 55.401 0.005 . 1 . . 1142 . A 114 LYS CA . 34088 3 273 . 1 1 114 114 LYS CB C 13 39.334 0.076 . 1 . . 1054 . A 114 LYS CB . 34088 3 274 . 1 1 114 114 LYS N N 15 124.432 0.253 . 1 . . 1053 . A 114 LYS N . 34088 3 275 . 1 1 115 115 ILE H H 1 8.680 0.01 . 1 . . 1052 . A 115 ILE H . 34088 3 276 . 1 1 115 115 ILE C C 13 175.269 . . 1 . . 503 . A 115 ILE C . 34088 3 277 . 1 1 115 115 ILE CA C 13 60.077 0.056 . 1 . . 1051 . A 115 ILE CA . 34088 3 278 . 1 1 115 115 ILE CB C 13 41.682 0.131 . 1 . . 199 . A 115 ILE CB . 34088 3 279 . 1 1 115 115 ILE N N 15 123.647 0.02 . 1 . . 632 . A 115 ILE N . 34088 3 280 . 1 1 116 116 ALA H H 1 9.096 0.039 . 1 . . 729 . A 116 ALA H . 34088 3 281 . 1 1 116 116 ALA C C 13 176.561 . . 1 . . 268 . A 116 ALA C . 34088 3 282 . 1 1 116 116 ALA CA C 13 50.378 0.061 . 1 . . 255 . A 116 ALA CA . 34088 3 283 . 1 1 116 116 ALA CB C 13 23.835 0.349 . 1 . . 254 . A 116 ALA CB . 34088 3 284 . 1 1 116 116 ALA N N 15 125.711 0.136 . 1 . . 264 . A 116 ALA N . 34088 3 285 . 1 1 117 117 PRO C C 13 176.076 . . 1 . . 704 . A 117 PRO C . 34088 3 286 . 1 1 117 117 PRO CA C 13 62.811 0.046 . 1 . . 62 . A 117 PRO CA . 34088 3 287 . 1 1 117 117 PRO CB C 13 34.289 0.074 . 1 . . 60 . A 117 PRO CB . 34088 3 288 . 1 1 118 118 ASP H H 1 8.805 0.079 . 1 . . 774 . A 118 ASP H . 34088 3 289 . 1 1 118 118 ASP C C 13 173.902 0.071 . 1 . . 665 . A 118 ASP C . 34088 3 290 . 1 1 118 118 ASP CA C 13 54.198 0.065 . 1 . . 663 . A 118 ASP CA . 34088 3 291 . 1 1 118 118 ASP CB C 13 45.055 . . 1 . . 662 . A 118 ASP CB . 34088 3 292 . 1 1 118 118 ASP N N 15 116.828 0.229 . 1 . . 699 . A 118 ASP N . 34088 3 293 . 1 1 119 119 TRP H H 1 8.251 0.035 . 1 . . 928 . A 119 TRP H . 34088 3 294 . 1 1 119 119 TRP C C 13 175.507 . . 1 . . 191 . A 119 TRP C . 34088 3 295 . 1 1 119 119 TRP CA C 13 57.441 0.118 . 1 . . 151 . A 119 TRP CA . 34088 3 296 . 1 1 119 119 TRP CB C 13 33.164 0.08 . 1 . . 150 . A 119 TRP CB . 34088 3 297 . 1 1 119 119 TRP N N 15 115.279 0.207 . 1 . . 929 . A 119 TRP N . 34088 3 298 . 1 1 120 120 ASP H H 1 8.367 0.067 . 1 . . 1038 . A 120 ASP H . 34088 3 299 . 1 1 120 120 ASP C C 13 174.970 . . 1 . . 1149 . A 120 ASP C . 34088 3 300 . 1 1 120 120 ASP CA C 13 55.554 0.08 . 1 . . 1203 . A 120 ASP CA . 34088 3 301 . 1 1 120 120 ASP CB C 13 43.979 0.121 . 1 . . 1037 . A 120 ASP CB . 34088 3 302 . 1 1 120 120 ASP N N 15 119.570 0.22 . 1 . . 1036 . A 120 ASP N . 34088 3 303 . 1 1 121 121 VAL H H 1 9.790 0.068 . 1 . . 997 . A 121 VAL H . 34088 3 304 . 1 1 121 121 VAL CA C 13 61.210 0.279 . 1 . . 1206 . A 121 VAL CA . 34088 3 305 . 1 1 121 121 VAL CB C 13 35.809 0.001 . 1 . . 1207 . A 121 VAL CB . 34088 3 306 . 1 1 121 121 VAL N N 15 126.806 0.274 . 1 . . 996 . A 121 VAL N . 34088 3 307 . 1 1 122 122 LYS H H 1 8.636 0.043 . 1 . . 783 . A 122 LYS H . 34088 3 308 . 1 1 122 122 LYS CA C 13 58.666 0.112 . 1 . . 782 . A 122 LYS CA . 34088 3 309 . 1 1 122 122 LYS CB C 13 33.819 0.058 . 1 . . 235 . A 122 LYS CB . 34088 3 310 . 1 1 122 122 LYS N N 15 128.383 0.206 . 1 . . 781 . A 122 LYS N . 34088 3 311 . 1 1 123 123 LEU C C 13 177.658 . . 1 . . 93 . A 123 LEU C . 34088 3 312 . 1 1 123 123 LEU CA C 13 56.358 0.215 . 1 . . 98 . A 123 LEU CA . 34088 3 313 . 1 1 123 123 LEU CB C 13 42.675 0.009 . 1 . . 92 . A 123 LEU CB . 34088 3 314 . 1 1 124 124 THR H H 1 8.683 0.037 . 1 . . 710 . A 124 THR H . 34088 3 315 . 1 1 124 124 THR CA C 13 59.976 0.101 . 1 . . 40 . A 124 THR CA . 34088 3 316 . 1 1 124 124 THR CB C 13 72.675 0.033 . 1 . . 41 . A 124 THR CB . 34088 3 317 . 1 1 124 124 THR N N 15 109.374 0.313 . 1 . . 460 . A 124 THR N . 34088 3 318 . 1 1 126 126 ASP C C 13 173.973 . . 1 . . 1281 . A 126 ASP C . 34088 3 319 . 1 1 126 126 ASP CA C 13 54.411 . . 1 . . 1279 . A 126 ASP CA . 34088 3 320 . 1 1 126 126 ASP CB C 13 44.041 . . 1 . . 1280 . A 126 ASP CB . 34088 3 321 . 1 1 127 127 LEU H H 1 7.718 0.035 . 1 . . 810 . A 127 LEU H . 34088 3 322 . 1 1 127 127 LEU C C 13 175.154 0.026 . 1 . . 131 . A 127 LEU C . 34088 3 323 . 1 1 127 127 LEU CA C 13 54.520 0.116 . 1 . . 124 . A 127 LEU CA . 34088 3 324 . 1 1 127 127 LEU CB C 13 46.006 0.035 . 1 . . 111 . A 127 LEU CB . 34088 3 325 . 1 1 127 127 LEU N N 15 122.794 0.28 . 1 . . 706 . A 127 LEU N . 34088 3 326 . 1 1 128 128 ARG H H 1 9.243 0.047 . 1 . . 1147 . A 128 ARG H . 34088 3 327 . 1 1 128 128 ARG C C 13 174.444 0.096 . 1 . . 1148 . A 128 ARG C . 34088 3 328 . 1 1 128 128 ARG CA C 13 54.975 0.065 . 1 . . 932 . A 128 ARG CA . 34088 3 329 . 1 1 128 128 ARG CB C 13 34.541 0.019 . 1 . . 931 . A 128 ARG CB . 34088 3 330 . 1 1 128 128 ARG N N 15 124.159 0.161 . 1 . . 1146 . A 128 ARG N . 34088 3 331 . 1 1 129 129 PHE H H 1 9.346 0.073 . 1 . . 955 . A 129 PHE H . 34088 3 332 . 1 1 129 129 PHE C C 13 173.613 0.054 . 1 . . 933 . A 129 PHE C . 34088 3 333 . 1 1 129 129 PHE CA C 13 54.900 0.257 . 1 . . 930 . A 129 PHE CA . 34088 3 334 . 1 1 129 129 PHE CB C 13 42.342 0.065 . 1 . . 288 . A 129 PHE CB . 34088 3 335 . 1 1 129 129 PHE N N 15 122.054 0.181 . 1 . . 289 . A 129 PHE N . 34088 3 336 . 1 1 130 130 ASN H H 1 8.996 0.094 . 1 . . 956 . A 130 ASN H . 34088 3 337 . 1 1 130 130 ASN C C 13 173.990 0.11 . 1 . . 877 . A 130 ASN C . 34088 3 338 . 1 1 130 130 ASN CA C 13 51.153 0.052 . 1 . . 878 . A 130 ASN CA . 34088 3 339 . 1 1 130 130 ASN CB C 13 42.378 0.035 . 1 . . 876 . A 130 ASN CB . 34088 3 340 . 1 1 130 130 ASN N N 15 123.787 0.278 . 1 . . 875 . A 130 ASN N . 34088 3 341 . 1 1 131 131 GLY H H 1 7.131 0.062 . 1 . . 836 . A 131 GLY H . 34088 3 342 . 1 1 131 131 GLY C C 13 169.144 0.052 . 1 . . 871 . A 131 GLY C . 34088 3 343 . 1 1 131 131 GLY CA C 13 45.711 0.127 . 1 . . 835 . A 131 GLY CA . 34088 3 344 . 1 1 131 131 GLY N N 15 104.690 0.425 . 1 . . 834 . A 131 GLY N . 34088 3 345 . 1 1 132 132 TRP H H 1 6.905 0.055 . 1 . . 746 . A 132 TRP H . 34088 3 346 . 1 1 132 132 TRP C C 13 174.854 0.068 . 1 . . 188 . A 132 TRP C . 34088 3 347 . 1 1 132 132 TRP CA C 13 55.165 0.076 . 1 . . 137 . A 132 TRP CA . 34088 3 348 . 1 1 132 132 TRP CB C 13 31.854 0.165 . 1 . . 136 . A 132 TRP CB . 34088 3 349 . 1 1 132 132 TRP N N 15 113.240 0.133 . 1 . . 745 . A 132 TRP N . 34088 3 350 . 1 1 133 133 LEU H H 1 8.714 0.051 . 1 . . 916 . A 133 LEU H . 34088 3 351 . 1 1 133 133 LEU C C 13 173.667 . . 1 . . 918 . A 133 LEU C . 34088 3 352 . 1 1 133 133 LEU CA C 13 55.491 0.235 . 1 . . 917 . A 133 LEU CA . 34088 3 353 . 1 1 133 133 LEU CB C 13 45.434 0.045 . 1 . . 915 . A 133 LEU CB . 34088 3 354 . 1 1 133 133 LEU N N 15 124.688 0.255 . 1 . . 536 . A 133 LEU N . 34088 3 355 . 1 1 134 134 SER H H 1 10.277 0.04 . 1 . . 670 . A 134 SER H . 34088 3 356 . 1 1 134 134 SER C C 13 172.918 . . 1 . . 874 . A 134 SER C . 34088 3 357 . 1 1 134 134 SER CA C 13 57.291 0.241 . 1 . . 414 . A 134 SER CA . 34088 3 358 . 1 1 134 134 SER CB C 13 67.632 0.118 . 1 . . 825 . A 134 SER CB . 34088 3 359 . 1 1 134 134 SER N N 15 119.152 0.268 . 1 . . 415 . A 134 SER N . 34088 3 360 . 1 1 135 135 MET H H 1 8.798 0.034 . 1 . . 960 . A 135 MET H . 34088 3 361 . 1 1 135 135 MET CA C 13 54.411 0.044 . 1 . . 1118 . A 135 MET CA . 34088 3 362 . 1 1 135 135 MET N N 15 123.950 0.469 . 1 . . 961 . A 135 MET N . 34088 3 363 . 1 1 136 136 TYR H H 1 9.359 0.042 . 1 . . 1022 . A 136 TYR H . 34088 3 364 . 1 1 136 136 TYR CA C 13 54.796 0.165 . 1 . . 1151 . A 136 TYR CA . 34088 3 365 . 1 1 136 136 TYR CB C 13 42.271 0.122 . 1 . . 1021 . A 136 TYR CB . 34088 3 366 . 1 1 136 136 TYR N N 15 119.566 0.262 . 1 . . 1020 . A 136 TYR N . 34088 3 367 . 1 1 137 137 LYS H H 1 8.934 0.05 . 1 . . 1125 . A 137 LYS H . 34088 3 368 . 1 1 137 137 LYS CA C 13 53.168 0.037 . 1 . . 223 . A 137 LYS CA . 34088 3 369 . 1 1 137 137 LYS CB C 13 34.797 . . 1 . . 237 . A 137 LYS CB . 34088 3 370 . 1 1 137 137 LYS N N 15 119.891 0.134 . 1 . . 1124 . A 137 LYS N . 34088 3 371 . 1 1 138 138 PHE H H 1 9.102 0.027 . 1 . . 1154 . A 138 PHE H . 34088 3 372 . 1 1 138 138 PHE CA C 13 57.243 0.037 . 1 . . 1152 . A 138 PHE CA . 34088 3 373 . 1 1 138 138 PHE CB C 13 41.776 0.123 . 1 . . 1143 . A 138 PHE CB . 34088 3 374 . 1 1 138 138 PHE N N 15 124.901 0.271 . 1 . . 1153 . A 138 PHE N . 34088 3 375 . 1 1 139 139 ALA H H 1 9.223 0.018 . 1 . . 1120 . A 139 ALA H . 34088 3 376 . 1 1 139 139 ALA C C 13 175.584 0.066 . 1 . . 1139 . A 139 ALA C . 34088 3 377 . 1 1 139 139 ALA CA C 13 52.374 0.063 . 1 . . 1137 . A 139 ALA CA . 34088 3 378 . 1 1 139 139 ALA CB C 13 24.041 0.036 . 1 . . 1138 . A 139 ALA CB . 34088 3 379 . 1 1 139 139 ALA N N 15 123.330 0.067 . 1 . . 1119 . A 139 ALA N . 34088 3 380 . 1 1 140 140 ASN H H 1 8.592 0.048 . 1 . . 716 . A 140 ASN H . 34088 3 381 . 1 1 140 140 ASN C C 13 172.446 . . 1 . . 1155 . A 140 ASN C . 34088 3 382 . 1 1 140 140 ASN CA C 13 57.567 0.081 . 1 . . 643 . A 140 ASN CA . 34088 3 383 . 1 1 140 140 ASN CB C 13 38.435 0.112 . 1 . . 642 . A 140 ASN CB . 34088 3 384 . 1 1 140 140 ASN N N 15 111.278 0.335 . 1 . . 644 . A 140 ASN N . 34088 3 385 . 1 1 141 141 ASP H H 1 8.386 0.056 . 1 . . 889 . A 141 ASP H . 34088 3 386 . 1 1 141 141 ASP C C 13 177.802 . . 1 . . 770 . A 141 ASP C . 34088 3 387 . 1 1 141 141 ASP CA C 13 56.279 0.079 . 1 . . 888 . A 141 ASP CA . 34088 3 388 . 1 1 141 141 ASP N N 15 112.204 0.299 . 1 . . 887 . A 141 ASP N . 34088 3 389 . 1 1 142 142 LEU H H 1 8.290 0.047 . 1 . . 757 . A 142 LEU H . 34088 3 390 . 1 1 142 142 LEU C C 13 181.379 . . 1 . . 90 . A 142 LEU C . 34088 3 391 . 1 1 142 142 LEU CA C 13 58.094 0.092 . 1 . . 97 . A 142 LEU CA . 34088 3 392 . 1 1 142 142 LEU CB C 13 39.789 0.059 . 1 . . 89 . A 142 LEU CB . 34088 3 393 . 1 1 142 142 LEU N N 15 116.591 0.164 . 1 . . 478 . A 142 LEU N . 34088 3 394 . 1 1 143 143 ASN H H 1 8.937 0.033 . 1 . . 722 . A 143 ASN H . 34088 3 395 . 1 1 143 143 ASN C C 13 177.084 . . 1 . . 475 . A 143 ASN C . 34088 3 396 . 1 1 143 143 ASN CA C 13 55.798 0.151 . 1 . . 473 . A 143 ASN CA . 34088 3 397 . 1 1 143 143 ASN CB C 13 37.415 0.376 . 1 . . 472 . A 143 ASN CB . 34088 3 398 . 1 1 143 143 ASN N N 15 115.878 0.335 . 1 . . 474 . A 143 ASN N . 34088 3 399 . 1 1 144 144 THR H H 1 7.621 0.031 . 1 . . 736 . A 144 THR H . 34088 3 400 . 1 1 144 144 THR C C 13 175.421 . . 1 . . 471 . A 144 THR C . 34088 3 401 . 1 1 144 144 THR CA C 13 65.632 0.163 . 1 . . 1 . A 144 THR CA . 34088 3 402 . 1 1 144 144 THR CB C 13 69.337 0.03 . 1 . . 2 . A 144 THR CB . 34088 3 403 . 1 1 144 144 THR N N 15 116.189 0.105 . 1 . . 463 . A 144 THR N . 34088 3 404 . 1 1 145 145 THR H H 1 8.599 0.069 . 1 . . 748 . A 145 THR H . 34088 3 405 . 1 1 145 145 THR C C 13 177.406 . . 1 . . 483 . A 145 THR C . 34088 3 406 . 1 1 145 145 THR CA C 13 63.031 0.047 . 1 . . 13 . A 145 THR CA . 34088 3 407 . 1 1 145 145 THR CB C 13 69.965 0.071 . 1 . . 14 . A 145 THR CB . 34088 3 408 . 1 1 145 145 THR N N 15 110.152 0.314 . 1 . . 464 . A 145 THR N . 34088 3 409 . 1 1 146 146 GLY H H 1 8.272 0.04 . 1 . . 744 . A 146 GLY H . 34088 3 410 . 1 1 146 146 GLY C C 13 174.108 0.187 . 1 . . 375 . A 146 GLY C . 34088 3 411 . 1 1 146 146 GLY CA C 13 46.111 0.153 . 1 . . 376 . A 146 GLY CA . 34088 3 412 . 1 1 146 146 GLY N N 15 109.146 0.199 . 1 . . 377 . A 146 GLY N . 34088 3 413 . 1 1 147 147 TYR H H 1 7.090 0.034 . 1 . . 719 . A 147 TYR H . 34088 3 414 . 1 1 147 147 TYR CA C 13 58.575 0.06 . 1 . . 584 . A 147 TYR CA . 34088 3 415 . 1 1 147 147 TYR CB C 13 39.192 0.006 . 1 . . 583 . A 147 TYR CB . 34088 3 416 . 1 1 147 147 TYR N N 15 120.290 0.233 . 1 . . 585 . A 147 TYR N . 34088 3 417 . 1 1 148 148 ALA H H 1 8.186 0.019 . 1 . . 919 . A 148 ALA H . 34088 3 418 . 1 1 148 148 ALA C C 13 178.941 0.011 . 1 . . 280 . A 148 ALA C . 34088 3 419 . 1 1 148 148 ALA CA C 13 51.354 0.093 . 1 . . 247 . A 148 ALA CA . 34088 3 420 . 1 1 148 148 ALA CB C 13 18.071 0.022 . 1 . . 246 . A 148 ALA CB . 34088 3 421 . 1 1 148 148 ALA N N 15 122.780 0.235 . 1 . . 553 . A 148 ALA N . 34088 3 422 . 1 1 149 149 ASP H H 1 8.260 0.042 . 1 . . 749 . A 149 ASP H . 34088 3 423 . 1 1 149 149 ASP C C 13 176.823 . . 1 . . 767 . A 149 ASP C . 34088 3 424 . 1 1 149 149 ASP CA C 13 56.910 0.244 . 1 . . 555 . A 149 ASP CA . 34088 3 425 . 1 1 149 149 ASP CB C 13 41.713 0.174 . 1 . . 554 . A 149 ASP CB . 34088 3 426 . 1 1 149 149 ASP N N 15 115.492 0.187 . 1 . . 556 . A 149 ASP N . 34088 3 427 . 1 1 150 150 THR H H 1 8.440 0.037 . 1 . . 711 . A 150 THR H . 34088 3 428 . 1 1 150 150 THR C C 13 173.373 . . 1 . . 603 . A 150 THR C . 34088 3 429 . 1 1 150 150 THR CA C 13 62.437 0.065 . 1 . . 22 . A 150 THR CA . 34088 3 430 . 1 1 150 150 THR CB C 13 71.321 0.02 . 1 . . 23 . A 150 THR CB . 34088 3 431 . 1 1 150 150 THR N N 15 118.110 0.252 . 1 . . 461 . A 150 THR N . 34088 3 432 . 1 1 151 151 ARG H H 1 8.939 0.027 . 1 . . 813 . A 151 ARG H . 34088 3 433 . 1 1 151 151 ARG C C 13 173.799 . . 1 . . 552 . A 151 ARG C . 34088 3 434 . 1 1 151 151 ARG CA C 13 54.908 0.156 . 1 . . 812 . A 151 ARG CA . 34088 3 435 . 1 1 151 151 ARG CB C 13 31.402 0.007 . 1 . . 457 . A 151 ARG CB . 34088 3 436 . 1 1 151 151 ARG N N 15 124.849 0.193 . 1 . . 811 . A 151 ARG N . 34088 3 437 . 1 1 152 152 VAL C C 13 173.566 . . 1 . . 964 . A 152 VAL C . 34088 3 438 . 1 1 152 152 VAL CA C 13 59.958 0.034 . 1 . . 1217 . A 152 VAL CA . 34088 3 439 . 1 1 152 152 VAL CB C 13 35.676 . . 1 . . 977 . A 152 VAL CB . 34088 3 440 . 1 1 153 153 GLU H H 1 9.113 0.045 . 1 . . 963 . A 153 GLU H . 34088 3 441 . 1 1 153 153 GLU C C 13 173.673 0.073 . 1 . . 775 . A 153 GLU C . 34088 3 442 . 1 1 153 153 GLU CA C 13 54.102 0.151 . 1 . . 666 . A 153 GLU CA . 34088 3 443 . 1 1 153 153 GLU CB C 13 36.252 0.123 . 1 . . 621 . A 153 GLU CB . 34088 3 444 . 1 1 153 153 GLU N N 15 127.780 0.262 . 1 . . 962 . A 153 GLU N . 34088 3 445 . 1 1 154 154 THR H H 1 9.017 0.033 . 1 . . 737 . A 154 THR H . 34088 3 446 . 1 1 154 154 THR C C 13 169.434 0.101 . 1 . . 481 . A 154 THR C . 34088 3 447 . 1 1 154 154 THR CA C 13 59.985 0.151 . 1 . . 28 . A 154 THR CA . 34088 3 448 . 1 1 154 154 THR CB C 13 70.206 0.02 . 1 . . 29 . A 154 THR CB . 34088 3 449 . 1 1 154 154 THR N N 15 122.099 0.196 . 1 . . 469 . A 154 THR N . 34088 3 450 . 1 1 155 155 GLU H H 1 5.427 0.09 . 1 . . 738 . A 155 GLU H . 34088 3 451 . 1 1 155 155 GLU C C 13 175.891 0.02 . 1 . . 870 . A 155 GLU C . 34088 3 452 . 1 1 155 155 GLU CA C 13 56.231 0.166 . 1 . . 619 . A 155 GLU CA . 34088 3 453 . 1 1 155 155 GLU CB C 13 31.004 0.058 . 1 . . 678 . A 155 GLU CB . 34088 3 454 . 1 1 155 155 GLU N N 15 123.928 0.127 . 1 . . 620 . A 155 GLU N . 34088 3 455 . 1 1 156 156 THR H H 1 8.938 0.081 . 1 . . 976 . A 156 THR H . 34088 3 456 . 1 1 156 156 THR C C 13 171.855 0.12 . 1 . . 482 . A 156 THR C . 34088 3 457 . 1 1 156 156 THR CA C 13 60.247 0.109 . 1 . . 33 . A 156 THR CA . 34088 3 458 . 1 1 156 156 THR CB C 13 70.938 0.037 . 1 . . 32 . A 156 THR CB . 34088 3 459 . 1 1 156 156 THR N N 15 122.628 0.443 . 1 . . 468 . A 156 THR N . 34088 3 460 . 1 1 157 157 GLY H H 1 8.728 0.037 . 1 . . 751 . A 157 GLY H . 34088 3 461 . 1 1 157 157 GLY C C 13 172.017 0.095 . 1 . . 361 . A 157 GLY C . 34088 3 462 . 1 1 157 157 GLY CA C 13 47.902 0.083 . 1 . . 362 . A 157 GLY CA . 34088 3 463 . 1 1 157 157 GLY N N 15 113.814 0.166 . 1 . . 363 . A 157 GLY N . 34088 3 464 . 1 1 158 158 LEU H H 1 8.533 0.03 . 1 . . 732 . A 158 LEU H . 34088 3 465 . 1 1 158 158 LEU C C 13 176.077 0.052 . 1 . . 134 . A 158 LEU C . 34088 3 466 . 1 1 158 158 LEU CA C 13 53.091 0.106 . 1 . . 125 . A 158 LEU CA . 34088 3 467 . 1 1 158 158 LEU CB C 13 46.114 0.064 . 1 . . 113 . A 158 LEU CB . 34088 3 468 . 1 1 158 158 LEU N N 15 118.442 0.109 . 1 . . 490 . A 158 LEU N . 34088 3 469 . 1 1 159 159 GLN H H 1 9.100 0.053 . 1 . . 822 . A 159 GLN H . 34088 3 470 . 1 1 159 159 GLN C C 13 174.775 0.107 . 1 . . 772 . A 159 GLN C . 34088 3 471 . 1 1 159 159 GLN CA C 13 54.016 0.054 . 1 . . 652 . A 159 GLN CA . 34088 3 472 . 1 1 159 159 GLN CB C 13 32.698 0.146 . 1 . . 653 . A 159 GLN CB . 34088 3 473 . 1 1 159 159 GLN N N 15 120.294 0.202 . 1 . . 821 . A 159 GLN N . 34088 3 474 . 1 1 160 160 TYR H H 1 9.924 0.079 . 1 . . 1169 . A 160 TYR H . 34088 3 475 . 1 1 160 160 TYR C C 13 174.700 0.027 . 1 . . 909 . A 160 TYR C . 34088 3 476 . 1 1 160 160 TYR CA C 13 56.592 0.189 . 1 . . 339 . A 160 TYR CA . 34088 3 477 . 1 1 160 160 TYR CB C 13 42.223 0.239 . 1 . . 338 . A 160 TYR CB . 34088 3 478 . 1 1 160 160 TYR N N 15 130.769 0.166 . 1 . . 340 . A 160 TYR N . 34088 3 479 . 1 1 161 161 THR H H 1 8.329 0.019 . 1 . . 900 . A 161 THR H . 34088 3 480 . 1 1 161 161 THR C C 13 173.817 0.238 . 1 . . 570 . A 161 THR C . 34088 3 481 . 1 1 161 161 THR CA C 13 63.058 0.273 . 1 . . 11 . A 161 THR CA . 34088 3 482 . 1 1 161 161 THR CB C 13 70.046 0.076 . 1 . . 12 . A 161 THR CB . 34088 3 483 . 1 1 161 161 THR N N 15 124.297 0.556 . 1 . . 462 . A 161 THR N . 34088 3 484 . 1 1 162 162 PHE H H 1 8.416 0.095 . 1 . . 924 . A 162 PHE H . 34088 3 485 . 1 1 162 162 PHE C C 13 176.535 . . 1 . . 616 . A 162 PHE C . 34088 3 486 . 1 1 162 162 PHE CA C 13 61.362 0.121 . 1 . . 335 . A 162 PHE CA . 34088 3 487 . 1 1 162 162 PHE CB C 13 39.714 0.001 . 1 . . 334 . A 162 PHE CB . 34088 3 488 . 1 1 162 162 PHE N N 15 125.662 0.49 . 1 . . 336 . A 162 PHE N . 34088 3 489 . 1 1 163 163 ASN H H 1 8.240 0.052 . 1 . . 739 . A 163 ASN H . 34088 3 490 . 1 1 163 163 ASN C C 13 174.168 . . 1 . . 617 . A 163 ASN C . 34088 3 491 . 1 1 163 163 ASN CA C 13 52.962 0.095 . 1 . . 614 . A 163 ASN CA . 34088 3 492 . 1 1 163 163 ASN CB C 13 38.496 . . 1 . . 613 . A 163 ASN CB . 34088 3 493 . 1 1 163 163 ASN N N 15 111.279 0.26 . 1 . . 615 . A 163 ASN N . 34088 3 494 . 1 1 164 164 GLU H H 1 8.931 0.059 . 1 . . 750 . A 164 GLU H . 34088 3 495 . 1 1 164 164 GLU C C 13 176.562 . . 1 . . 611 . A 164 GLU C . 34088 3 496 . 1 1 164 164 GLU CA C 13 59.434 0.082 . 1 . . 567 . A 164 GLU CA . 34088 3 497 . 1 1 164 164 GLU CB C 13 29.117 0.086 . 1 . . 569 . A 164 GLU CB . 34088 3 498 . 1 1 164 164 GLU N N 15 114.643 0.185 . 1 . . 568 . A 164 GLU N . 34088 3 499 . 1 1 165 165 THR H H 1 8.759 0.039 . 1 . . 1213 . A 165 THR H . 34088 3 500 . 1 1 165 165 THR C C 13 173.906 0.075 . 1 . . 612 . A 165 THR C . 34088 3 501 . 1 1 165 165 THR CA C 13 64.578 0.238 . 1 . . 4 . A 165 THR CA . 34088 3 502 . 1 1 165 165 THR CB C 13 70.375 0.066 . 1 . . 5 . A 165 THR CB . 34088 3 503 . 1 1 165 165 THR N N 15 115.985 0.452 . 1 . . 1212 . A 165 THR N . 34088 3 504 . 1 1 166 166 VAL H H 1 7.965 0.046 . 1 . . 920 . A 166 VAL H . 34088 3 505 . 1 1 166 166 VAL C C 13 174.166 . . 1 . . 563 . A 166 VAL C . 34088 3 506 . 1 1 166 166 VAL CA C 13 63.169 0.0 . 1 . . 1385 . A 166 VAL CA . 34088 3 507 . 1 1 166 166 VAL CB C 13 35.006 0.051 . 1 . . 560 . A 166 VAL CB . 34088 3 508 . 1 1 166 166 VAL N N 15 118.966 0.117 . 1 . . 561 . A 166 VAL N . 34088 3 509 . 1 1 167 167 ALA H H 1 8.185 0.032 . 1 . . 672 . A 167 ALA H . 34088 3 510 . 1 1 167 167 ALA C C 13 172.971 0.169 . 1 . . 269 . A 167 ALA C . 34088 3 511 . 1 1 167 167 ALA CA C 13 50.858 0.077 . 1 . . 253 . A 167 ALA CA . 34088 3 512 . 1 1 167 167 ALA CB C 13 23.231 0.125 . 1 . . 252 . A 167 ALA CB . 34088 3 513 . 1 1 167 167 ALA N N 15 128.798 0.237 . 1 . . 263 . A 167 ALA N . 34088 3 514 . 1 1 168 168 LEU H H 1 9.051 0.078 . 1 . . 742 . A 168 LEU H . 34088 3 515 . 1 1 168 168 LEU C C 13 175.678 0.037 . 1 . . 133 . A 168 LEU C . 34088 3 516 . 1 1 168 168 LEU CA C 13 54.262 0.076 . 1 . . 122 . A 168 LEU CA . 34088 3 517 . 1 1 168 168 LEU CB C 13 47.703 0.037 . 1 . . 121 . A 168 LEU CB . 34088 3 518 . 1 1 168 168 LEU N N 15 116.784 0.233 . 1 . . 587 . A 168 LEU N . 34088 3 519 . 1 1 169 169 ARG H H 1 9.418 0.058 . 1 . . 773 . A 169 ARG H . 34088 3 520 . 1 1 169 169 ARG HE H 1 7.140 . . 1 . . 914 . A 169 ARG HE . 34088 3 521 . 1 1 169 169 ARG C C 13 175.680 0.165 . 1 . . 588 . A 169 ARG C . 34088 3 522 . 1 1 169 169 ARG CA C 13 54.829 0.112 . 1 . . 454 . A 169 ARG CA . 34088 3 523 . 1 1 169 169 ARG CB C 13 34.189 0.046 . 1 . . 456 . A 169 ARG CB . 34088 3 524 . 1 1 169 169 ARG CG C 13 27.731 . . 1 . . 453 . A 169 ARG CG . 34088 3 525 . 1 1 169 169 ARG N N 15 124.624 0.236 . 1 . . 589 . A 169 ARG N . 34088 3 526 . 1 1 170 170 VAL H H 1 8.941 0.04 . 1 . . 713 . A 170 VAL H . 34088 3 527 . 1 1 170 170 VAL C C 13 172.992 . . 1 . . 562 . A 170 VAL C . 34088 3 528 . 1 1 170 170 VAL CA C 13 63.064 0.131 . 1 . . 558 . A 170 VAL CA . 34088 3 529 . 1 1 170 170 VAL CB C 13 33.999 0.119 . 1 . . 557 . A 170 VAL CB . 34088 3 530 . 1 1 170 170 VAL N N 15 122.650 0.26 . 1 . . 559 . A 170 VAL N . 34088 3 531 . 1 1 171 171 ASN H H 1 9.640 0.011 . 1 . . 942 . A 171 ASN H . 34088 3 532 . 1 1 171 171 ASN C C 13 174.717 0.018 . 1 . . 1264 . A 171 ASN C . 34088 3 533 . 1 1 171 171 ASN CA C 13 51.333 0.094 . 1 . . 945 . A 171 ASN CA . 34088 3 534 . 1 1 171 171 ASN CB C 13 42.890 0.226 . 1 . . 943 . A 171 ASN CB . 34088 3 535 . 1 1 171 171 ASN N N 15 121.895 0.125 . 1 . . 944 . A 171 ASN N . 34088 3 536 . 1 1 172 172 TYR H H 1 9.686 0.034 . 1 . . 948 . A 172 TYR H . 34088 3 537 . 1 1 172 172 TYR C C 13 173.081 0.117 . 1 . . 946 . A 172 TYR C . 34088 3 538 . 1 1 172 172 TYR CA C 13 57.510 0.103 . 1 . . 861 . A 172 TYR CA . 34088 3 539 . 1 1 172 172 TYR CB C 13 41.857 0.007 . 1 . . 947 . A 172 TYR CB . 34088 3 540 . 1 1 172 172 TYR N N 15 122.296 0.133 . 1 . . 1160 . A 172 TYR N . 34088 3 541 . 1 1 173 173 TYR H H 1 8.486 0.038 . 1 . . 938 . A 173 TYR H . 34088 3 542 . 1 1 173 173 TYR C C 13 172.100 0.051 . 1 . . 939 . A 173 TYR C . 34088 3 543 . 1 1 173 173 TYR CA C 13 56.134 0.114 . 1 . . 937 . A 173 TYR CA . 34088 3 544 . 1 1 173 173 TYR CB C 13 43.142 0.063 . 1 . . 940 . A 173 TYR CB . 34088 3 545 . 1 1 173 173 TYR N N 15 127.923 0.21 . 1 . . 936 . A 173 TYR N . 34088 3 546 . 1 1 174 174 LEU H H 1 7.563 0.051 . 1 . . 756 . A 174 LEU H . 34088 3 547 . 1 1 174 174 LEU C C 13 174.168 0.054 . 1 . . 130 . A 174 LEU C . 34088 3 548 . 1 1 174 174 LEU CA C 13 52.987 0.107 . 1 . . 109 . A 174 LEU CA . 34088 3 549 . 1 1 174 174 LEU CB C 13 45.817 0.086 . 1 . . 108 . A 174 LEU CB . 34088 3 550 . 1 1 174 174 LEU N N 15 126.579 0.133 . 1 . . 491 . A 174 LEU N . 34088 3 551 . 1 1 175 175 GLU H H 1 8.756 0.014 . 1 . . 965 . A 175 GLU H . 34088 3 552 . 1 1 175 175 GLU CA C 13 55.081 0.125 . 1 . . 966 . A 175 GLU CA . 34088 3 553 . 1 1 175 175 GLU CB C 13 32.826 0.002 . 1 . . 968 . A 175 GLU CB . 34088 3 554 . 1 1 175 175 GLU N N 15 124.205 0.131 . 1 . . 967 . A 175 GLU N . 34088 3 555 . 1 1 194 194 ILE H H 1 8.841 0.031 . 1 . . 1216 . A 194 ILE H . 34088 3 556 . 1 1 194 194 ILE C C 13 175.447 . . 1 . . 971 . A 194 ILE C . 34088 3 557 . 1 1 194 194 ILE CA C 13 59.583 0.066 . 1 . . 1215 . A 194 ILE CA . 34088 3 558 . 1 1 194 194 ILE CB C 13 39.175 0.061 . 1 . . 959 . A 194 ILE CB . 34088 3 559 . 1 1 194 194 ILE N N 15 117.563 0.078 . 1 . . 1214 . A 194 ILE N . 34088 3 560 . 1 1 195 195 ARG H H 1 9.480 0.028 . 1 . . 846 . A 195 ARG H . 34088 3 561 . 1 1 195 195 ARG C C 13 173.609 0.092 . 1 . . 548 . A 195 ARG C . 34088 3 562 . 1 1 195 195 ARG CA C 13 55.127 0.085 . 1 . . 451 . A 195 ARG CA . 34088 3 563 . 1 1 195 195 ARG CB C 13 33.356 0.107 . 1 . . 452 . A 195 ARG CB . 34088 3 564 . 1 1 195 195 ARG N N 15 126.346 0.227 . 1 . . 845 . A 195 ARG N . 34088 3 565 . 1 1 196 196 ALA H H 1 8.567 0.037 . 1 . . 715 . A 196 ALA H . 34088 3 566 . 1 1 196 196 ALA C C 13 175.421 0.103 . 1 . . 272 . A 196 ALA C . 34088 3 567 . 1 1 196 196 ALA CA C 13 49.907 0.045 . 1 . . 245 . A 196 ALA CA . 34088 3 568 . 1 1 196 196 ALA CB C 13 22.106 0.128 . 1 . . 244 . A 196 ALA CB . 34088 3 569 . 1 1 196 196 ALA N N 15 124.497 0.239 . 1 . . 258 . A 196 ALA N . 34088 3 570 . 1 1 197 197 TYR H H 1 9.637 0.062 . 1 . . 671 . A 197 TYR H . 34088 3 571 . 1 1 197 197 TYR C C 13 174.554 0.074 . 1 . . 496 . A 197 TYR C . 34088 3 572 . 1 1 197 197 TYR CA C 13 56.272 0.057 . 1 . . 296 . A 197 TYR CA . 34088 3 573 . 1 1 197 197 TYR CB C 13 42.687 0.066 . 1 . . 295 . A 197 TYR CB . 34088 3 574 . 1 1 197 197 TYR N N 15 117.497 0.222 . 1 . . 297 . A 197 TYR N . 34088 3 575 . 1 1 198 198 LEU H H 1 8.349 0.039 . 1 . . 723 . A 198 LEU H . 34088 3 576 . 1 1 198 198 LEU CA C 13 51.747 0.12 . 1 . . 102 . A 198 LEU CA . 34088 3 577 . 1 1 198 198 LEU CB C 13 44.599 0.046 . 1 . . 80 . A 198 LEU CB . 34088 3 578 . 1 1 198 198 LEU N N 15 123.729 0.182 . 1 . . 494 . A 198 LEU N . 34088 3 579 . 1 1 199 199 PRO C C 13 177.671 . . 1 . . 488 . A 199 PRO C . 34088 3 580 . 1 1 199 199 PRO CA C 13 64.443 0.195 . 1 . . 51 . A 199 PRO CA . 34088 3 581 . 1 1 199 199 PRO CB C 13 31.999 0.025 . 1 . . 49 . A 199 PRO CB . 34088 3 582 . 1 1 200 200 LEU H H 1 9.513 0.044 . 1 . . 790 . A 200 LEU H . 34088 3 583 . 1 1 200 200 LEU C C 13 178.940 0.087 . 1 . . 86 . A 200 LEU C . 34088 3 584 . 1 1 200 200 LEU CA C 13 53.551 0.131 . 1 . . 791 . A 200 LEU CA . 34088 3 585 . 1 1 200 200 LEU CB C 13 43.297 0.097 . 1 . . 789 . A 200 LEU CB . 34088 3 586 . 1 1 200 200 LEU N N 15 127.164 0.494 . 1 . . 788 . A 200 LEU N . 34088 3 587 . 1 1 201 201 THR H H 1 9.599 0.068 . 1 . . 769 . A 201 THR H . 34088 3 588 . 1 1 201 201 THR C C 13 174.113 . . 1 . . 493 . A 201 THR C . 34088 3 589 . 1 1 201 201 THR CA C 13 61.913 0.101 . 1 . . 16 . A 201 THR CA . 34088 3 590 . 1 1 201 201 THR CB C 13 70.291 0.106 . 1 . . 17 . A 201 THR CB . 34088 3 591 . 1 1 201 201 THR N N 15 122.027 0.35 . 1 . . 135 . A 201 THR N . 34088 3 592 . 1 1 202 202 LEU H H 1 8.459 0.039 . 1 . . 760 . A 202 LEU H . 34088 3 593 . 1 1 202 202 LEU C C 13 176.493 0.032 . 1 . . 96 . A 202 LEU C . 34088 3 594 . 1 1 202 202 LEU CA C 13 52.413 0.068 . 1 . . 99 . A 202 LEU CA . 34088 3 595 . 1 1 202 202 LEU CB C 13 42.902 0.192 . 1 . . 95 . A 202 LEU CB . 34088 3 596 . 1 1 202 202 LEU N N 15 128.363 0.311 . 1 . . 489 . A 202 LEU N . 34088 3 597 . 1 1 203 203 GLY H H 1 8.567 0.068 . 1 . . 740 . A 203 GLY H . 34088 3 598 . 1 1 203 203 GLY C C 13 175.996 0.122 . 1 . . 364 . A 203 GLY C . 34088 3 599 . 1 1 203 203 GLY CA C 13 47.531 0.075 . 1 . . 365 . A 203 GLY CA . 34088 3 600 . 1 1 203 203 GLY N N 15 111.679 0.243 . 1 . . 366 . A 203 GLY N . 34088 3 601 . 1 1 204 204 ASN H H 1 9.375 0.056 . 1 . . 1173 . A 204 ASN H . 34088 3 602 . 1 1 204 204 ASN C C 13 174.414 0.147 . 1 . . 1251 . A 204 ASN C . 34088 3 603 . 1 1 204 204 ASN CA C 13 54.735 0.139 . 1 . . 703 . A 204 ASN CA . 34088 3 604 . 1 1 204 204 ASN CB C 13 38.939 0.09 . 1 . . 702 . A 204 ASN CB . 34088 3 605 . 1 1 204 204 ASN N N 15 126.723 0.143 . 1 . . 1174 . A 204 ASN N . 34088 3 606 . 1 1 205 205 HIS H H 1 8.530 0.107 . 1 . . 957 . A 205 HIS H . 34088 3 607 . 1 1 205 205 HIS C C 13 176.159 . . 1 . . 186 . A 205 HIS C . 34088 3 608 . 1 1 205 205 HIS CA C 13 55.894 0.161 . 1 . . 177 . A 205 HIS CA . 34088 3 609 . 1 1 205 205 HIS CB C 13 32.996 0.04 . 1 . . 176 . A 205 HIS CB . 34088 3 610 . 1 1 205 205 HIS N N 15 121.163 0.214 . 1 . . 353 . A 205 HIS N . 34088 3 611 . 1 1 206 206 SER H H 1 9.399 0.036 . 1 . . 823 . A 206 SER H . 34088 3 612 . 1 1 206 206 SER C C 13 173.062 0.019 . 1 . . 972 . A 206 SER C . 34088 3 613 . 1 1 206 206 SER CA C 13 57.956 0.07 . 1 . . 412 . A 206 SER CA . 34088 3 614 . 1 1 206 206 SER CB C 13 65.228 0.041 . 1 . . 411 . A 206 SER CB . 34088 3 615 . 1 1 206 206 SER N N 15 120.258 0.202 . 1 . . 413 . A 206 SER N . 34088 3 616 . 1 1 207 207 VAL H H 1 8.734 0.092 . 1 . . 958 . A 207 VAL H . 34088 3 617 . 1 1 207 207 VAL C C 13 175.207 . . 1 . . 768 . A 207 VAL C . 34088 3 618 . 1 1 207 207 VAL CA C 13 61.296 0.049 . 1 . . 743 . A 207 VAL CA . 34088 3 619 . 1 1 207 207 VAL CB C 13 35.054 0.073 . 1 . . 1218 . A 207 VAL CB . 34088 3 620 . 1 1 207 207 VAL N N 15 124.315 0.251 . 1 . . 912 . A 207 VAL N . 34088 3 621 . 1 1 208 208 THR H H 1 9.985 0.059 . 1 . . 709 . A 208 THR H . 34088 3 622 . 1 1 208 208 THR CA C 13 59.382 0.029 . 1 . . 35 . A 208 THR CA . 34088 3 623 . 1 1 208 208 THR CB C 13 71.266 0.002 . 1 . . 36 . A 208 THR CB . 34088 3 624 . 1 1 208 208 THR N N 15 121.837 0.179 . 1 . . 467 . A 208 THR N . 34088 3 625 . 1 1 209 209 PRO C C 13 176.111 . . 1 . . 598 . A 209 PRO C . 34088 3 626 . 1 1 209 209 PRO CA C 13 62.397 0.087 . 1 . . 56 . A 209 PRO CA . 34088 3 627 . 1 1 209 209 PRO CB C 13 32.717 0.006 . 1 . . 54 . A 209 PRO CB . 34088 3 628 . 1 1 210 210 TYR H H 1 9.024 0.074 . 1 . . 901 . A 210 TYR H . 34088 3 629 . 1 1 210 210 TYR C C 13 172.953 0.016 . 1 . . 1133 . A 210 TYR C . 34088 3 630 . 1 1 210 210 TYR CA C 13 57.127 0.085 . 1 . . 595 . A 210 TYR CA . 34088 3 631 . 1 1 210 210 TYR CB C 13 42.557 0.126 . 1 . . 594 . A 210 TYR CB . 34088 3 632 . 1 1 210 210 TYR N N 15 118.758 0.282 . 1 . . 596 . A 210 TYR N . 34088 3 633 . 1 1 211 211 THR H H 1 9.010 0.044 . 1 . . 753 . A 211 THR H . 34088 3 634 . 1 1 211 211 THR CA C 13 59.473 0.046 . 1 . . 39 . A 211 THR CA . 34088 3 635 . 1 1 211 211 THR CB C 13 71.335 0.054 . 1 . . 38 . A 211 THR CB . 34088 3 636 . 1 1 211 211 THR N N 15 111.453 0.121 . 1 . . 752 . A 211 THR N . 34088 3 637 . 1 1 237 237 VAL C C 13 173.453 . . 1 . . 1101 . A 237 VAL C . 34088 3 638 . 1 1 237 237 VAL CA C 13 61.087 0.127 . 1 . . 1100 . A 237 VAL CA . 34088 3 639 . 1 1 238 238 GLY H H 1 8.257 0.02 . 1 . . 885 . A 238 GLY H . 34088 3 640 . 1 1 238 238 GLY C C 13 170.438 0.019 . 1 . . 886 . A 238 GLY C . 34088 3 641 . 1 1 238 238 GLY CA C 13 45.855 0.145 . 1 . . 884 . A 238 GLY CA . 34088 3 642 . 1 1 238 238 GLY N N 15 110.275 0.336 . 1 . . 883 . A 238 GLY N . 34088 3 643 . 1 1 239 239 LEU H H 1 9.218 0.029 . 1 . . 776 . A 239 LEU H . 34088 3 644 . 1 1 239 239 LEU C C 13 174.471 . . 1 . . 537 . A 239 LEU C . 34088 3 645 . 1 1 239 239 LEU CA C 13 55.178 0.084 . 1 . . 127 . A 239 LEU CA . 34088 3 646 . 1 1 239 239 LEU CB C 13 46.505 0.081 . 1 . . 115 . A 239 LEU CB . 34088 3 647 . 1 1 239 239 LEU N N 15 117.915 0.144 . 1 . . 535 . A 239 LEU N . 34088 3 648 . 1 1 240 240 PHE H H 1 8.262 0.029 . 1 . . 985 . A 240 PHE H . 34088 3 649 . 1 1 240 240 PHE C C 13 173.557 0.022 . 1 . . 1157 . A 240 PHE C . 34088 3 650 . 1 1 240 240 PHE CA C 13 57.111 0.089 . 1 . . 1156 . A 240 PHE CA . 34088 3 651 . 1 1 240 240 PHE CB C 13 42.491 0.028 . 1 . . 1233 . A 240 PHE CB . 34088 3 652 . 1 1 240 240 PHE N N 15 124.232 0.175 . 1 . . 984 . A 240 PHE N . 34088 3 653 . 1 1 241 241 TYR H H 1 9.423 0.075 . 1 . . 787 . A 241 TYR H . 34088 3 654 . 1 1 241 241 TYR C C 13 173.446 0.138 . 1 . . 926 . A 241 TYR C . 34088 3 655 . 1 1 241 241 TYR CA C 13 56.832 0.123 . 1 . . 910 . A 241 TYR CA . 34088 3 656 . 1 1 241 241 TYR CB C 13 42.698 0.235 . 1 . . 911 . A 241 TYR CB . 34088 3 657 . 1 1 241 241 TYR N N 15 130.017 0.316 . 1 . . 342 . A 241 TYR N . 34088 3 658 . 1 1 242 242 GLY H H 1 8.661 0.04 . 1 . . 830 . A 242 GLY H . 34088 3 659 . 1 1 242 242 GLY C C 13 170.737 0.086 . 1 . . 869 . A 242 GLY C . 34088 3 660 . 1 1 242 242 GLY CA C 13 44.462 0.133 . 1 . . 389 . A 242 GLY CA . 34088 3 661 . 1 1 242 242 GLY N N 15 113.974 0.324 . 1 . . 390 . A 242 GLY N . 34088 3 662 . 1 1 243 243 TYR H H 1 8.183 0.054 . 1 . . 718 . A 243 TYR H . 34088 3 663 . 1 1 243 243 TYR C C 13 173.760 . . 1 . . 1158 . A 243 TYR C . 34088 3 664 . 1 1 243 243 TYR CA C 13 58.452 0.038 . 1 . . 600 . A 243 TYR CA . 34088 3 665 . 1 1 243 243 TYR CB C 13 42.101 0.011 . 1 . . 601 . A 243 TYR CB . 34088 3 666 . 1 1 243 243 TYR N N 15 118.942 0.199 . 1 . . 599 . A 243 TYR N . 34088 3 667 . 1 1 244 244 ASP H H 1 6.578 0.043 . 1 . . 1057 . A 244 ASP H . 34088 3 668 . 1 1 244 244 ASP CA C 13 52.752 0.07 . 1 . . 814 . A 244 ASP CA . 34088 3 669 . 1 1 244 244 ASP CB C 13 42.882 0.169 . 1 . . 850 . A 244 ASP CB . 34088 3 670 . 1 1 244 244 ASP N N 15 125.923 0.174 . 1 . . 1056 . A 244 ASP N . 34088 3 671 . 1 1 245 245 PHE H H 1 8.672 0.028 . 1 . . 1106 . A 245 PHE H . 34088 3 672 . 1 1 245 245 PHE CA C 13 60.487 0.127 . 1 . . 324 . A 245 PHE CA . 34088 3 673 . 1 1 245 245 PHE N N 15 121.073 0.086 . 1 . . 323 . A 245 PHE N . 34088 3 674 . 1 1 249 249 LEU C C 13 176.046 0.16 . 1 . . 683 . A 249 LEU C . 34088 3 675 . 1 1 249 249 LEU CA C 13 55.279 . . 1 . . 105 . A 249 LEU CA . 34088 3 676 . 1 1 249 249 LEU CB C 13 44.386 . . 1 . . 104 . A 249 LEU CB . 34088 3 677 . 1 1 250 250 SER H H 1 9.778 0.029 . 1 . . 881 . A 250 SER H . 34088 3 678 . 1 1 250 250 SER C C 13 172.088 . . 1 . . 540 . A 250 SER C . 34088 3 679 . 1 1 250 250 SER CA C 13 58.257 0.073 . 1 . . 523 . A 250 SER CA . 34088 3 680 . 1 1 250 250 SER CB C 13 66.825 0.306 . 1 . . 524 . A 250 SER CB . 34088 3 681 . 1 1 250 250 SER N N 15 119.501 0.388 . 1 . . 880 . A 250 SER N . 34088 3 682 . 1 1 251 251 VAL H H 1 8.950 0.027 . 1 . . 978 . A 251 VAL H . 34088 3 683 . 1 1 251 251 VAL C C 13 175.429 0.02 . 1 . . 541 . A 251 VAL C . 34088 3 684 . 1 1 251 251 VAL CA C 13 59.383 0.088 . 1 . . 526 . A 251 VAL CA . 34088 3 685 . 1 1 251 251 VAL CB C 13 36.639 0.26 . 1 . . 525 . A 251 VAL CB . 34088 3 686 . 1 1 251 251 VAL N N 15 115.107 0.739 . 1 . . 527 . A 251 VAL N . 34088 3 687 . 1 1 252 252 SER H H 1 9.462 0.026 . 1 . . 741 . A 252 SER H . 34088 3 688 . 1 1 252 252 SER C C 13 172.824 0.159 . 1 . . 538 . A 252 SER C . 34088 3 689 . 1 1 252 252 SER CA C 13 57.402 0.13 . 1 . . 409 . A 252 SER CA . 34088 3 690 . 1 1 252 252 SER CB C 13 68.039 0.147 . 1 . . 408 . A 252 SER CB . 34088 3 691 . 1 1 252 252 SER N N 15 119.442 0.197 . 1 . . 410 . A 252 SER N . 34088 3 692 . 1 1 253 253 LEU H H 1 9.675 0.025 . 1 . . 925 . A 253 LEU H . 34088 3 693 . 1 1 253 253 LEU C C 13 175.191 . . 1 . . 132 . A 253 LEU C . 34088 3 694 . 1 1 253 253 LEU CA C 13 54.768 0.242 . 1 . . 123 . A 253 LEU CA . 34088 3 695 . 1 1 253 253 LEU CB C 13 47.086 0.061 . 1 . . 117 . A 253 LEU CB . 34088 3 696 . 1 1 253 253 LEU N N 15 121.809 0.229 . 1 . . 539 . A 253 LEU N . 34088 3 697 . 1 1 254 254 GLU H H 1 9.220 0.0 . 1 . . 1191 . A 254 GLU H . 34088 3 698 . 1 1 254 254 GLU CA C 13 55.430 0.024 . 1 . . 1189 . A 254 GLU CA . 34088 3 699 . 1 1 254 254 GLU N N 15 122.308 0.016 . 1 . . 1190 . A 254 GLU N . 34088 3 700 . 1 1 255 255 TYR H H 1 8.534 0.012 . 1 . . 1085 . A 255 TYR H . 34088 3 701 . 1 1 255 255 TYR CA C 13 57.065 0.099 . 1 . . 1084 . A 255 TYR CA . 34088 3 702 . 1 1 255 255 TYR N N 15 123.708 0.157 . 1 . . 1083 . A 255 TYR N . 34088 3 703 . 1 1 273 273 ALA C C 13 175.886 . . 1 . . 631 . A 273 ALA C . 34088 3 704 . 1 1 273 273 ALA CA C 13 51.258 0.184 . 1 . . 275 . A 273 ALA CA . 34088 3 705 . 1 1 274 274 GLY H H 1 8.929 0.033 . 1 . . 667 . A 274 GLY H . 34088 3 706 . 1 1 274 274 GLY C C 13 172.310 . . 1 . . 378 . A 274 GLY C . 34088 3 707 . 1 1 274 274 GLY CA C 13 46.371 0.054 . 1 . . 379 . A 274 GLY CA . 34088 3 708 . 1 1 274 274 GLY N N 15 105.184 0.265 . 1 . . 380 . A 274 GLY N . 34088 3 709 . 1 1 275 275 VAL H H 1 8.939 0.024 . 1 . . 1162 . A 275 VAL H . 34088 3 710 . 1 1 275 275 VAL C C 13 173.777 . . 1 . . 637 . A 275 VAL C . 34088 3 711 . 1 1 275 275 VAL CA C 13 59.717 0.028 . 1 . . 636 . A 275 VAL CA . 34088 3 712 . 1 1 275 275 VAL CB C 13 35.594 0.054 . 1 . . 1132 . A 275 VAL CB . 34088 3 713 . 1 1 275 275 VAL N N 15 119.842 0.314 . 1 . . 635 . A 275 VAL N . 34088 3 714 . 1 1 276 276 GLY H H 1 9.232 0.048 . 1 . . 975 . A 276 GLY H . 34088 3 715 . 1 1 276 276 GLY C C 13 172.012 0.075 . 1 . . 1159 . A 276 GLY C . 34088 3 716 . 1 1 276 276 GLY CA C 13 45.920 0.063 . 1 . . 370 . A 276 GLY CA . 34088 3 717 . 1 1 276 276 GLY N N 15 112.001 0.259 . 1 . . 371 . A 276 GLY N . 34088 3 718 . 1 1 277 277 VAL H H 1 8.884 0.02 . 1 . . 1129 . A 277 VAL H . 34088 3 719 . 1 1 277 277 VAL CA C 13 60.176 0.054 . 1 . . 1208 . A 277 VAL CA . 34088 3 720 . 1 1 277 277 VAL CB C 13 35.867 0.155 . 1 . . 1209 . A 277 VAL CB . 34088 3 721 . 1 1 277 277 VAL N N 15 115.955 0.274 . 1 . . 998 . A 277 VAL N . 34088 3 722 . 1 1 278 278 ASN H H 1 9.052 0.032 . 1 . . 1131 . A 278 ASN H . 34088 3 723 . 1 1 278 278 ASN HD21 H 1 7.247 . . 1 . . 1275 . A 278 ASN HD21 . 34088 3 724 . 1 1 278 278 ASN C C 13 172.885 0.093 . 1 . . 1150 . A 278 ASN C . 34088 3 725 . 1 1 278 278 ASN CA C 13 53.499 0.019 . 1 . . 1200 . A 278 ASN CA . 34088 3 726 . 1 1 278 278 ASN CB C 13 44.680 0.168 . 1 . . 1201 . A 278 ASN CB . 34088 3 727 . 1 1 278 278 ASN N N 15 123.379 0.267 . 1 . . 1130 . A 278 ASN N . 34088 3 728 . 1 1 278 278 ASN ND2 N 15 114.717 . . 1 . . 1274 . A 278 ASN ND2 . 34088 3 729 . 1 1 279 279 TYR H H 1 10.088 0.049 . 1 . . 980 . A 279 TYR H . 34088 3 730 . 1 1 279 279 TYR C C 13 173.687 0.063 . 1 . . 1102 . A 279 TYR C . 34088 3 731 . 1 1 279 279 TYR CA C 13 57.299 0.033 . 1 . . 1210 . A 279 TYR CA . 34088 3 732 . 1 1 279 279 TYR CB C 13 41.944 . . 1 . . 1211 . A 279 TYR CB . 34088 3 733 . 1 1 279 279 TYR N N 15 126.780 0.166 . 1 . . 979 . A 279 TYR N . 34088 3 734 . 1 1 280 280 SER H H 1 8.330 0.024 . 1 . . 986 . A 280 SER H . 34088 3 735 . 1 1 280 280 SER C C 13 173.647 0.068 . 1 . . 1221 . A 280 SER C . 34088 3 736 . 1 1 280 280 SER CA C 13 56.442 . . 1 . . 407 . A 280 SER CA . 34088 3 737 . 1 1 280 280 SER CB C 13 66.361 0.04 . 1 . . 406 . A 280 SER CB . 34088 3 738 . 1 1 280 280 SER N N 15 123.965 0.106 . 1 . . 1223 . A 280 SER N . 34088 3 739 . 1 1 281 281 PHE H H 1 8.694 0.082 . 1 . . 1222 . A 281 PHE H . 34088 3 740 . 1 1 281 281 PHE CA C 13 58.776 0.005 . 1 . . 1248 . A 281 PHE CA . 34088 3 741 . 1 1 281 281 PHE N N 15 127.113 0.063 . 1 . . 1250 . A 281 PHE N . 34088 3 stop_ save_