################################### # 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 51604 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Mutant human MDMX acidic domain, residues 170-260 W200S/W201G' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 51604 1 2 '3D HNCACB' . . . 51604 1 3 '3D HNCO' . . . 51604 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51604 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 PRO C C 13 177.0072784 . . . . . . . . 166 P CO . 51604 1 2 . 1 . 1 2 2 PRO CA C 13 62.99568176 . . . . . . . . 166 P CA . 51604 1 3 . 1 . 1 2 2 PRO CB C 13 32.13164139 . . . . . . . . 166 P CB . 51604 1 4 . 1 . 1 3 3 LEU H H 1 8.678999901 . . . . . . . . 167 L H . 51604 1 5 . 1 . 1 3 3 LEU C C 13 177.9085541 . . . . . . . . 167 L CO . 51604 1 6 . 1 . 1 3 3 LEU CA C 13 55.27054977 . . . . . . . . 167 L CA . 51604 1 7 . 1 . 1 3 3 LEU CB C 13 41.81739044 . . . . . . . . 167 L CB . 51604 1 8 . 1 . 1 3 3 LEU N N 15 121.9658279 . . . . . . . . 167 L N . 51604 1 9 . 1 . 1 4 4 GLY H H 1 8.515789986 . . . . . . . . 168 G H . 51604 1 10 . 1 . 1 4 4 GLY C C 13 174.2203064 . . . . . . . . 168 G CO . 51604 1 11 . 1 . 1 4 4 GLY CA C 13 45.10000992 . . . . . . . . 168 G CA . 51604 1 12 . 1 . 1 4 4 GLY N N 15 110.6309967 . . . . . . . . 168 G N . 51604 1 13 . 1 . 1 5 5 SER H H 1 8.139010429 . . . . . . . . 169 S H . 51604 1 14 . 1 . 1 5 5 SER C C 13 174.8177338 . . . . . . . . 169 S CO . 51604 1 15 . 1 . 1 5 5 SER CA C 13 58.04513931 . . . . . . . . 169 S CA . 51604 1 16 . 1 . 1 5 5 SER CB C 13 63.74483109 . . . . . . . . 169 S CB . 51604 1 17 . 1 . 1 5 5 SER N N 15 115.692131 . . . . . . . . 169 S N . 51604 1 18 . 1 . 1 6 6 GLU H H 1 8.730070114 . . . . . . . . 170 E H . 51604 1 19 . 1 . 1 6 6 GLU C C 13 176.3573151 . . . . . . . . 170 E CO . 51604 1 20 . 1 . 1 6 6 GLU CA C 13 56.87327957 . . . . . . . . 170 E CA . 51604 1 21 . 1 . 1 6 6 GLU CB C 13 29.64118958 . . . . . . . . 170 E CB . 51604 1 22 . 1 . 1 6 6 GLU N N 15 122.5112762 . . . . . . . . 170 E N . 51604 1 23 . 1 . 1 7 7 ASP H H 1 8.257849693 . . . . . . . . 171 D H . 51604 1 24 . 1 . 1 7 7 ASP C C 13 176.3500061 . . . . . . . . 171 D CO . 51604 1 25 . 1 . 1 7 7 ASP CA C 13 54.40610123 . . . . . . . . 171 D CA . 51604 1 26 . 1 . 1 7 7 ASP CB C 13 40.92858887 . . . . . . . . 171 D CB . 51604 1 27 . 1 . 1 7 7 ASP N N 15 120.3242264 . . . . . . . . 171 D N . 51604 1 28 . 1 . 1 8 8 GLU H H 1 8.240209579 . . . . . . . . 172 E H . 51604 1 29 . 1 . 1 8 8 GLU C C 13 176.2497559 . . . . . . . . 172 E CO . 51604 1 30 . 1 . 1 8 8 GLU CA C 13 56.65969086 . . . . . . . . 172 E CA . 51604 1 31 . 1 . 1 8 8 GLU CB C 13 30.26091003 . . . . . . . . 172 E CB . 51604 1 32 . 1 . 1 8 8 GLU N N 15 121.0808182 . . . . . . . . 172 E N . 51604 1 33 . 1 . 1 9 9 ASP H H 1 8.351530075 . . . . . . . . 173 D H . 51604 1 34 . 1 . 1 9 9 ASP C C 13 176.0267639 . . . . . . . . 173 D CO . 51604 1 35 . 1 . 1 9 9 ASP CA C 13 54.33507919 . . . . . . . . 173 D CA . 51604 1 36 . 1 . 1 9 9 ASP CB C 13 40.77873993 . . . . . . . . 173 D CB . 51604 1 37 . 1 . 1 9 9 ASP N N 15 121.0114975 . . . . . . . . 173 D N . 51604 1 38 . 1 . 1 10 10 LEU H H 1 8.033349991 . . . . . . . . 174 L H . 51604 1 39 . 1 . 1 10 10 LEU C C 13 177.2574921 . . . . . . . . 174 L CO . 51604 1 40 . 1 . 1 10 10 LEU CA C 13 54.98365021 . . . . . . . . 174 L CA . 51604 1 41 . 1 . 1 10 10 LEU CB C 13 41.99713898 . . . . . . . . 174 L CB . 51604 1 42 . 1 . 1 10 10 LEU N N 15 122.2477722 . . . . . . . . 174 L N . 51604 1 43 . 1 . 1 11 11 ILE H H 1 8.062120438 . . . . . . . . 175 I H . 51604 1 44 . 1 . 1 11 11 ILE C C 13 176.3445892 . . . . . . . . 175 I CO . 51604 1 45 . 1 . 1 11 11 ILE CA C 13 61.07341003 . . . . . . . . 175 I CA . 51604 1 46 . 1 . 1 11 11 ILE CB C 13 38.2509613 . . . . . . . . 175 I CB . 51604 1 47 . 1 . 1 11 11 ILE N N 15 122.2253265 . . . . . . . . 175 I N . 51604 1 48 . 1 . 1 12 12 GLU H H 1 8.440970421 . . . . . . . . 176 E H . 51604 1 49 . 1 . 1 12 12 GLU C C 13 175.9920959 . . . . . . . . 176 E CO . 51604 1 50 . 1 . 1 12 12 GLU CA C 13 56.53990936 . . . . . . . . 176 E CA . 51604 1 51 . 1 . 1 12 12 GLU CB C 13 30.2353096 . . . . . . . . 176 E CB . 51604 1 52 . 1 . 1 12 12 GLU N N 15 124.6788788 . . . . . . . . 176 E N . 51604 1 53 . 1 . 1 13 13 ASN H H 1 8.418239594 . . . . . . . . 177 N H . 51604 1 54 . 1 . 1 13 13 ASN C C 13 175.0405884 . . . . . . . . 177 N CO . 51604 1 55 . 1 . 1 13 13 ASN CA C 13 52.98392105 . . . . . . . . 177 N CA . 51604 1 56 . 1 . 1 13 13 ASN CB C 13 38.61513138 . . . . . . . . 177 N CB . 51604 1 57 . 1 . 1 13 13 ASN N N 15 120.0696411 . . . . . . . . 177 N N . 51604 1 58 . 1 . 1 14 14 LEU H H 1 8.202890396 . . . . . . . . 178 L H . 51604 1 59 . 1 . 1 14 14 LEU C C 13 177.1348724 . . . . . . . . 178 L CO . 51604 1 60 . 1 . 1 14 14 LEU CA C 13 54.97016144 . . . . . . . . 178 L CA . 51604 1 61 . 1 . 1 14 14 LEU CB C 13 42.08330917 . . . . . . . . 178 L CB . 51604 1 62 . 1 . 1 14 14 LEU N N 15 123.103157 . . . . . . . . 178 L N . 51604 1 63 . 1 . 1 15 15 ALA H H 1 8.253930092 . . . . . . . . 179 A H . 51604 1 64 . 1 . 1 15 15 ALA C C 13 177.6603699 . . . . . . . . 179 A CO . 51604 1 65 . 1 . 1 15 15 ALA CA C 13 52.27825928 . . . . . . . . 179 A CA . 51604 1 66 . 1 . 1 15 15 ALA CB C 13 18.81838989 . . . . . . . . 179 A CB . 51604 1 67 . 1 . 1 15 15 ALA N N 15 124.7572403 . . . . . . . . 179 A N . 51604 1 68 . 1 . 1 16 16 GLN H H 1 8.275650024 . . . . . . . . 180 Q H . 51604 1 69 . 1 . 1 16 16 GLN C C 13 175.6769409 . . . . . . . . 180 Q CO . 51604 1 70 . 1 . 1 16 16 GLN CA C 13 55.55014038 . . . . . . . . 180 Q CA . 51604 1 71 . 1 . 1 16 16 GLN CB C 13 29.37768936 . . . . . . . . 180 Q CB . 51604 1 72 . 1 . 1 16 16 GLN N N 15 119.6492462 . . . . . . . . 180 Q N . 51604 1 73 . 1 . 1 17 17 ASP H H 1 8.341230392 . . . . . . . . 181 D H . 51604 1 74 . 1 . 1 17 17 ASP C C 13 176.5152435 . . . . . . . . 181 D CO . 51604 1 75 . 1 . 1 17 17 ASP CA C 13 54.11008072 . . . . . . . . 181 D CA . 51604 1 76 . 1 . 1 17 17 ASP CB C 13 41.02795029 . . . . . . . . 181 D CB . 51604 1 77 . 1 . 1 17 17 ASP N N 15 121.4525986 . . . . . . . . 181 D N . 51604 1 78 . 1 . 1 18 18 GLU H H 1 8.544489861 . . . . . . . . 182 E H . 51604 1 79 . 1 . 1 18 18 GLU C C 13 177.136673 . . . . . . . . 182 E CO . 51604 1 80 . 1 . 1 18 18 GLU CA C 13 56.95878983 . . . . . . . . 182 E CA . 51604 1 81 . 1 . 1 18 18 GLU CB C 13 29.84546089 . . . . . . . . 182 E CB . 51604 1 82 . 1 . 1 18 18 GLU N N 15 121.9712906 . . . . . . . . 182 E N . 51604 1 83 . 1 . 1 19 19 THR H H 1 8.253210068 . . . . . . . . 183 T H . 51604 1 84 . 1 . 1 19 19 THR C C 13 175.0766144 . . . . . . . . 183 T CO . 51604 1 85 . 1 . 1 19 19 THR CA C 13 62.66254044 . . . . . . . . 183 T CA . 51604 1 86 . 1 . 1 19 19 THR CB C 13 69.2431488 . . . . . . . . 183 T CB . 51604 1 87 . 1 . 1 19 19 THR N N 15 114.3845367 . . . . . . . . 183 T N . 51604 1 88 . 1 . 1 20 20 SER H H 1 8.236410141 . . . . . . . . 184 S H . 51604 1 89 . 1 . 1 20 20 SER C C 13 174.5374451 . . . . . . . . 184 S CO . 51604 1 90 . 1 . 1 20 20 SER CA C 13 58.5363884 . . . . . . . . 184 S CA . 51604 1 91 . 1 . 1 20 20 SER CB C 13 63.36429977 . . . . . . . . 184 S CB . 51604 1 92 . 1 . 1 20 20 SER N N 15 118.0535431 . . . . . . . . 184 S N . 51604 1 93 . 1 . 1 21 21 ARG H H 1 8.160730362 . . . . . . . . 185 R H . 51604 1 94 . 1 . 1 21 21 ARG C C 13 176.2727966 . . . . . . . . 185 R CO . 51604 1 95 . 1 . 1 21 21 ARG CA C 13 56.04806137 . . . . . . . . 185 R CA . 51604 1 96 . 1 . 1 21 21 ARG CB C 13 30.42938042 . . . . . . . . 185 R CB . 51604 1 97 . 1 . 1 21 21 ARG N N 15 122.6988831 . . . . . . . . 185 R N . 51604 1 98 . 1 . 1 22 22 LEU H H 1 8.159090042 . . . . . . . . 186 L H . 51604 1 99 . 1 . 1 22 22 LEU C C 13 176.9806366 . . . . . . . . 186 L CO . 51604 1 100 . 1 . 1 22 22 LEU CA C 13 55.11478043 . . . . . . . . 186 L CA . 51604 1 101 . 1 . 1 22 22 LEU CB C 13 42.13666916 . . . . . . . . 186 L CB . 51604 1 102 . 1 . 1 22 22 LEU N N 15 122.6407928 . . . . . . . . 186 L N . 51604 1 103 . 1 . 1 23 23 ASP H H 1 8.296199799 . . . . . . . . 187 D H . 51604 1 104 . 1 . 1 23 23 ASP C C 13 176.0766602 . . . . . . . . 187 D CO . 51604 1 105 . 1 . 1 23 23 ASP CA C 13 53.92472839 . . . . . . . . 187 D CA . 51604 1 106 . 1 . 1 23 23 ASP CB C 13 40.69543839 . . . . . . . . 187 D CB . 51604 1 107 . 1 . 1 23 23 ASP N N 15 120.7699966 . . . . . . . . 187 D N . 51604 1 108 . 1 . 1 24 24 LEU H H 1 8.050999641 . . . . . . . . 188 L H . 51604 1 109 . 1 . 1 24 24 LEU C C 13 177.7986603 . . . . . . . . 188 L CO . 51604 1 110 . 1 . 1 24 24 LEU CA C 13 55.02318954 . . . . . . . . 188 L CA . 51604 1 111 . 1 . 1 24 24 LEU CB C 13 42.04161835 . . . . . . . . 188 L CB . 51604 1 112 . 1 . 1 24 24 LEU N N 15 122.3151169 . . . . . . . . 188 L N . 51604 1 113 . 1 . 1 25 25 GLY H H 1 8.361539841 . . . . . . . . 189 G H . 51604 1 114 . 1 . 1 25 25 GLY C C 13 173.8821869 . . . . . . . . 189 G CO . 51604 1 115 . 1 . 1 25 25 GLY CA C 13 45.10248947 . . . . . . . . 189 G CA . 51604 1 116 . 1 . 1 25 25 GLY N N 15 108.8279877 . . . . . . . . 189 G N . 51604 1 117 . 1 . 1 26 26 PHE H H 1 7.906630039 . . . . . . . . 190 F H . 51604 1 118 . 1 . 1 26 26 PHE C C 13 175.6482086 . . . . . . . . 190 F CO . 51604 1 119 . 1 . 1 26 26 PHE CA C 13 57.39408112 . . . . . . . . 190 F CA . 51604 1 120 . 1 . 1 26 26 PHE CB C 13 39.36085892 . . . . . . . . 190 F CB . 51604 1 121 . 1 . 1 26 26 PHE N N 15 119.4625168 . . . . . . . . 190 F N . 51604 1 122 . 1 . 1 27 27 GLU H H 1 8.423959732 . . . . . . . . 191 E H . 51604 1 123 . 1 . 1 27 27 GLU C C 13 177.3835449 . . . . . . . . 191 E CO . 51604 1 124 . 1 . 1 27 27 GLU CA C 13 56.33473969 . . . . . . . . 191 E CA . 51604 1 125 . 1 . 1 27 27 GLU CB C 13 29.89658928 . . . . . . . . 191 E CB . 51604 1 126 . 1 . 1 27 27 GLU N N 15 122.0257416 . . . . . . . . 191 E N . 51604 1 127 . 1 . 1 28 28 GLU H H 1 8.223480225 . . . . . . . . 192 E H . 51604 1 128 . 1 . 1 28 28 GLU C C 13 176.0702972 . . . . . . . . 192 E CO . 51604 1 129 . 1 . 1 28 28 GLU CA C 13 56.42724991 . . . . . . . . 192 E CA . 51604 1 130 . 1 . 1 28 28 GLU CB C 13 30.09247971 . . . . . . . . 192 E CB . 51604 1 131 . 1 . 1 28 28 GLU N N 15 120.9488678 . . . . . . . . 192 E N . 51604 1 132 . 1 . 1 29 29 TRP H H 1 7.867129803 . . . . . . . . 193 W H . 51604 1 133 . 1 . 1 29 29 TRP C C 13 175.8756104 . . . . . . . . 193 W CO . 51604 1 134 . 1 . 1 29 29 TRP CA C 13 56.64236069 . . . . . . . . 193 W CA . 51604 1 135 . 1 . 1 29 29 TRP CB C 13 29.57106018 . . . . . . . . 193 W CB . 51604 1 136 . 1 . 1 29 29 TRP N N 15 120.6950607 . . . . . . . . 193 W N . 51604 1 137 . 1 . 1 30 30 ASP H H 1 8.159110069 . . . . . . . . 194 D H . 51604 1 138 . 1 . 1 30 30 ASP C C 13 176.4595642 . . . . . . . . 194 D CO . 51604 1 139 . 1 . 1 30 30 ASP CA C 13 53.91630936 . . . . . . . . 194 D CA . 51604 1 140 . 1 . 1 30 30 ASP CB C 13 40.81977081 . . . . . . . . 194 D CB . 51604 1 141 . 1 . 1 30 30 ASP N N 15 121.9971771 . . . . . . . . 194 D N . 51604 1 142 . 1 . 1 31 31 VAL H H 1 7.886270046 . . . . . . . . 195 V H . 51604 1 143 . 1 . 1 31 31 VAL C C 13 176.2402649 . . . . . . . . 195 V CO . 51604 1 144 . 1 . 1 31 31 VAL CA C 13 62.38745117 . . . . . . . . 195 V CA . 51604 1 145 . 1 . 1 31 31 VAL CB C 13 32.20320129 . . . . . . . . 195 V CB . 51604 1 146 . 1 . 1 31 31 VAL N N 15 119.8009567 . . . . . . . . 195 V N . 51604 1 147 . 1 . 1 32 32 ALA H H 1 8.2230196 . . . . . . . . 196 A H . 51604 1 148 . 1 . 1 32 32 ALA C C 13 178.1730194 . . . . . . . . 196 A CO . 51604 1 149 . 1 . 1 32 32 ALA CA C 13 52.65903854 . . . . . . . . 196 A CA . 51604 1 150 . 1 . 1 32 32 ALA CB C 13 18.84732056 . . . . . . . . 196 A CB . 51604 1 151 . 1 . 1 32 32 ALA N N 15 125.5402908 . . . . . . . . 196 A N . 51604 1 152 . 1 . 1 33 33 GLY H H 1 8.125349998 . . . . . . . . 197 G H . 51604 1 153 . 1 . 1 33 33 GLY C C 13 173.8032837 . . . . . . . . 197 G CO . 51604 1 154 . 1 . 1 33 33 GLY CA C 13 44.8927803 . . . . . . . . 197 G CA . 51604 1 155 . 1 . 1 33 33 GLY N N 15 107.2342072 . . . . . . . . 197 G N . 51604 1 156 . 1 . 1 34 34 LEU H H 1 7.889009953 . . . . . . . . 198 L H . 51604 1 157 . 1 . 1 34 34 LEU CA C 13 52.75690842 . . . . . . . . 198 L CA . 51604 1 158 . 1 . 1 34 34 LEU CB C 13 41.52441025 . . . . . . . . 198 L CB . 51604 1 159 . 1 . 1 34 34 LEU N N 15 122.4412613 . . . . . . . . 198 L N . 51604 1 160 . 1 . 1 35 35 PRO C C 13 177.0773773 . . . . . . . . 199 P CO . 51604 1 161 . 1 . 1 35 35 PRO CA C 13 62.77136993 . . . . . . . . 199 P CA . 51604 1 162 . 1 . 1 35 35 PRO CB C 13 31.70214081 . . . . . . . . 199 P CB . 51604 1 163 . 1 . 1 36 36 SER H H 1 8.351599693 . . . . . . . . 200 S H . 51604 1 164 . 1 . 1 36 36 SER C C 13 175.4571228 . . . . . . . . 200 S CO . 51604 1 165 . 1 . 1 36 36 SER CA C 13 58.63135147 . . . . . . . . 200 S CA . 51604 1 166 . 1 . 1 36 36 SER CB C 13 63.41196823 . . . . . . . . 200 S CB . 51604 1 167 . 1 . 1 36 36 SER N N 15 115.8816986 . . . . . . . . 200 S N . 51604 1 168 . 1 . 1 37 37 GLY H H 1 8.427539825 . . . . . . . . 201 G H . 51604 1 169 . 1 . 1 37 37 GLY C C 13 174.0218658 . . . . . . . . 201 G CO . 51604 1 170 . 1 . 1 37 37 GLY CA C 13 45.14545059 . . . . . . . . 201 G CA . 51604 1 171 . 1 . 1 37 37 GLY N N 15 110.9379272 . . . . . . . . 201 G N . 51604 1 172 . 1 . 1 38 38 PHE H H 1 7.980810165 . . . . . . . . 202 F H . 51604 1 173 . 1 . 1 38 38 PHE C C 13 175.9137726 . . . . . . . . 202 F CO . 51604 1 174 . 1 . 1 38 38 PHE CA C 13 58.00836945 . . . . . . . . 202 F CA . 51604 1 175 . 1 . 1 38 38 PHE CB C 13 39.32817841 . . . . . . . . 202 F CB . 51604 1 176 . 1 . 1 38 38 PHE N N 15 120.2969894 . . . . . . . . 202 F N . 51604 1 177 . 1 . 1 39 39 LEU H H 1 8.174730301 . . . . . . . . 203 L H . 51604 1 178 . 1 . 1 39 39 LEU C C 13 177.5882416 . . . . . . . . 203 L CO . 51604 1 179 . 1 . 1 39 39 LEU CA C 13 55.04394913 . . . . . . . . 203 L CA . 51604 1 180 . 1 . 1 39 39 LEU CB C 13 41.97080994 . . . . . . . . 203 L CB . 51604 1 181 . 1 . 1 39 39 LEU N N 15 123.6206131 . . . . . . . . 203 L N . 51604 1 182 . 1 . 1 40 40 GLY H H 1 7.676129818 . . . . . . . . 204 G H . 51604 1 183 . 1 . 1 40 40 GLY C C 13 173.839325 . . . . . . . . 204 G CO . 51604 1 184 . 1 . 1 40 40 GLY CA C 13 45.37277985 . . . . . . . . 204 G CA . 51604 1 185 . 1 . 1 40 40 GLY N N 15 107.9648438 . . . . . . . . 204 G N . 51604 1 186 . 1 . 1 41 41 ASN H H 1 8.19810009 . . . . . . . . 205 N H . 51604 1 187 . 1 . 1 41 41 ASN C C 13 175.2591248 . . . . . . . . 205 N CO . 51604 1 188 . 1 . 1 41 41 ASN CA C 13 53.0582695 . . . . . . . . 205 N CA . 51604 1 189 . 1 . 1 41 41 ASN CB C 13 38.55538177 . . . . . . . . 205 N CB . 51604 1 190 . 1 . 1 41 41 ASN N N 15 118.3777466 . . . . . . . . 205 N N . 51604 1 191 . 1 . 1 42 42 LEU H H 1 8.102109909 . . . . . . . . 206 L H . 51604 1 192 . 1 . 1 42 42 LEU C C 13 176.2770233 . . . . . . . . 206 L CO . 51604 1 193 . 1 . 1 42 42 LEU CA C 13 55.29553986 . . . . . . . . 206 L CA . 51604 1 194 . 1 . 1 42 42 LEU CB C 13 42.01588058 . . . . . . . . 206 L CB . 51604 1 195 . 1 . 1 42 42 LEU N N 15 122.0053864 . . . . . . . . 206 L N . 51604 1 196 . 1 . 1 43 43 ARG H H 1 8.225839615 . . . . . . . . 207 R H . 51604 1 197 . 1 . 1 43 43 ARG C C 13 176.3583221 . . . . . . . . 207 R CO . 51604 1 198 . 1 . 1 43 43 ARG CA C 13 55.90745163 . . . . . . . . 207 R CA . 51604 1 199 . 1 . 1 43 43 ARG CB C 13 30.38265991 . . . . . . . . 207 R CB . 51604 1 200 . 1 . 1 43 43 ARG N N 15 120.9475784 . . . . . . . . 207 R N . 51604 1 201 . 1 . 1 44 44 SER H H 1 8.193050385 . . . . . . . . 208 S H . 51604 1 202 . 1 . 1 44 44 SER C C 13 174.1601105 . . . . . . . . 208 S CO . 51604 1 203 . 1 . 1 44 44 SER CA C 13 58.24779892 . . . . . . . . 208 S CA . 51604 1 204 . 1 . 1 44 44 SER CB C 13 63.4928093 . . . . . . . . 208 S CB . 51604 1 205 . 1 . 1 44 44 SER N N 15 116.0307465 . . . . . . . . 208 S N . 51604 1 206 . 1 . 1 45 45 ASN H H 1 8.351019859 . . . . . . . . 209 N H . 51604 1 207 . 1 . 1 45 45 ASN C C 13 174.4873657 . . . . . . . . 209 N CO . 51604 1 208 . 1 . 1 45 45 ASN CA C 13 52.97692108 . . . . . . . . 209 N CA . 51604 1 209 . 1 . 1 45 45 ASN CB C 13 38.55783081 . . . . . . . . 209 N CB . 51604 1 210 . 1 . 1 45 45 ASN N N 15 120.0316467 . . . . . . . . 209 N N . 51604 1 211 . 1 . 1 46 46 TYR H H 1 8.058710098 . . . . . . . . 210 Y H . 51604 1 212 . 1 . 1 46 46 TYR C C 13 175.1527557 . . . . . . . . 210 Y CO . 51604 1 213 . 1 . 1 46 46 TYR CA C 13 57.68355179 . . . . . . . . 210 Y CA . 51604 1 214 . 1 . 1 46 46 TYR CB C 13 38.76319885 . . . . . . . . 210 Y CB . 51604 1 215 . 1 . 1 46 46 TYR N N 15 120.8331604 . . . . . . . . 210 Y N . 51604 1 216 . 1 . 1 47 47 THR H H 1 7.973149776 . . . . . . . . 211 T H . 51604 1 217 . 1 . 1 47 47 THR CA C 13 59.04125977 . . . . . . . . 211 T CA . 51604 1 218 . 1 . 1 47 47 THR CB C 13 69.78018188 . . . . . . . . 211 T CB . 51604 1 219 . 1 . 1 47 47 THR N N 15 120.4421387 . . . . . . . . 211 T N . 51604 1 220 . 1 . 1 48 48 PRO C C 13 176.6749268 . . . . . . . . 212 P CO . 51604 1 221 . 1 . 1 48 48 PRO CA C 13 62.74372101 . . . . . . . . 212 P CA . 51604 1 222 . 1 . 1 48 48 PRO CB C 13 31.91922951 . . . . . . . . 212 P CB . 51604 1 223 . 1 . 1 49 49 ARG H H 1 8.395910263 . . . . . . . . 213 R H . 51604 1 224 . 1 . 1 49 49 ARG C C 13 176.4010315 . . . . . . . . 213 R CO . 51604 1 225 . 1 . 1 49 49 ARG CA C 13 55.79632187 . . . . . . . . 213 R CA . 51604 1 226 . 1 . 1 49 49 ARG CB C 13 30.66576958 . . . . . . . . 213 R CB . 51604 1 227 . 1 . 1 49 49 ARG N N 15 121.2632065 . . . . . . . . 213 R N . 51604 1 228 . 1 . 1 50 50 SER H H 1 8.369370461 . . . . . . . . 214 S H . 51604 1 229 . 1 . 1 50 50 SER CA C 13 57.91640854 . . . . . . . . 214 S CA . 51604 1 230 . 1 . 1 50 50 SER CB C 13 63.58982086 . . . . . . . . 214 S CB . 51604 1 231 . 1 . 1 50 50 SER N N 15 116.9732285 . . . . . . . . 214 S N . 51604 1 232 . 1 . 1 51 51 ASN C C 13 175.6789551 . . . . . . . . 215 N CO . 51604 1 233 . 1 . 1 51 51 ASN CA C 13 53.07440948 . . . . . . . . 215 N CA . 51604 1 234 . 1 . 1 51 51 ASN CB C 13 38.62765121 . . . . . . . . 215 N CB . 51604 1 235 . 1 . 1 52 52 GLY H H 1 8.39937973 . . . . . . . . 216 G H . 51604 1 236 . 1 . 1 52 52 GLY C C 13 174.210907 . . . . . . . . 216 G CO . 51604 1 237 . 1 . 1 52 52 GLY CA C 13 45.19252014 . . . . . . . . 216 G CA . 51604 1 238 . 1 . 1 52 52 GLY N N 15 109.2490616 . . . . . . . . 216 G N . 51604 1 239 . 1 . 1 53 53 SER H H 1 8.222399712 . . . . . . . . 217 S H . 51604 1 240 . 1 . 1 53 53 SER C C 13 175.0064545 . . . . . . . . 217 S CO . 51604 1 241 . 1 . 1 53 53 SER CA C 13 58.19099045 . . . . . . . . 217 S CA . 51604 1 242 . 1 . 1 53 53 SER CB C 13 63.64731979 . . . . . . . . 217 S CB . 51604 1 243 . 1 . 1 53 53 SER N N 15 115.6299973 . . . . . . . . 217 S N . 51604 1 244 . 1 . 1 54 54 THR H H 1 8.247810364 . . . . . . . . 218 T H . 51604 1 245 . 1 . 1 54 54 THR C C 13 174.2726288 . . . . . . . . 218 T CO . 51604 1 246 . 1 . 1 54 54 THR CA C 13 61.70949173 . . . . . . . . 218 T CA . 51604 1 247 . 1 . 1 54 54 THR CB C 13 69.34745789 . . . . . . . . 218 T CB . 51604 1 248 . 1 . 1 54 54 THR N N 15 115.4432678 . . . . . . . . 218 T N . 51604 1 249 . 1 . 1 55 55 ASP H H 1 8.29708004 . . . . . . . . 219 D H . 51604 1 250 . 1 . 1 55 55 ASP C C 13 176.0559845 . . . . . . . . 219 D CO . 51604 1 251 . 1 . 1 55 55 ASP CA C 13 54.25043106 . . . . . . . . 219 D CA . 51604 1 252 . 1 . 1 55 55 ASP CB C 13 40.84957886 . . . . . . . . 219 D CB . 51604 1 253 . 1 . 1 55 55 ASP N N 15 122.6937714 . . . . . . . . 219 D N . 51604 1 254 . 1 . 1 56 56 LEU H H 1 8.142510414 . . . . . . . . 220 L H . 51604 1 255 . 1 . 1 56 56 LEU C C 13 177.4014282 . . . . . . . . 220 L CO . 51604 1 256 . 1 . 1 56 56 LEU CA C 13 55.1396904 . . . . . . . . 220 L CA . 51604 1 257 . 1 . 1 56 56 LEU CB C 13 42.06293106 . . . . . . . . 220 L CB . 51604 1 258 . 1 . 1 56 56 LEU N N 15 122.3015137 . . . . . . . . 220 L N . 51604 1 259 . 1 . 1 57 57 GLN H H 1 8.374230385 . . . . . . . . 221 Q H . 51604 1 260 . 1 . 1 57 57 GLN C C 13 176.2039032 . . . . . . . . 221 Q CO . 51604 1 261 . 1 . 1 57 57 GLN CA C 13 55.76517868 . . . . . . . . 221 Q CA . 51604 1 262 . 1 . 1 57 57 GLN CB C 13 29.02173042 . . . . . . . . 221 Q CB . 51604 1 263 . 1 . 1 57 57 GLN N N 15 120.7917404 . . . . . . . . 221 Q N . 51604 1 264 . 1 . 1 58 58 THR H H 1 8.133930206 . . . . . . . . 222 T H . 51604 1 265 . 1 . 1 58 58 THR C C 13 174.3158264 . . . . . . . . 222 T CO . 51604 1 266 . 1 . 1 58 58 THR CA C 13 61.64664841 . . . . . . . . 222 T CA . 51604 1 267 . 1 . 1 58 58 THR CB C 13 69.49716949 . . . . . . . . 222 T CB . 51604 1 268 . 1 . 1 58 58 THR N N 15 114.7120667 . . . . . . . . 222 T N . 51604 1 269 . 1 . 1 59 59 ASN H H 1 8.441749573 . . . . . . . . 223 N H . 51604 1 270 . 1 . 1 59 59 ASN C C 13 175.0688324 . . . . . . . . 223 N CO . 51604 1 271 . 1 . 1 59 59 ASN CA C 13 53.18692017 . . . . . . . . 223 N CA . 51604 1 272 . 1 . 1 59 59 ASN CB C 13 38.58229065 . . . . . . . . 223 N CB . 51604 1 273 . 1 . 1 59 59 ASN N N 15 120.8228836 . . . . . . . . 223 N N . 51604 1 274 . 1 . 1 60 60 GLN H H 1 8.35958004 . . . . . . . . 224 Q H . 51604 1 275 . 1 . 1 60 60 GLN C C 13 175.5263824 . . . . . . . . 224 Q CO . 51604 1 276 . 1 . 1 60 60 GLN CA C 13 55.6554718 . . . . . . . . 224 Q CA . 51604 1 277 . 1 . 1 60 60 GLN CB C 13 29.29466057 . . . . . . . . 224 Q CB . 51604 1 278 . 1 . 1 60 60 GLN N N 15 120.5664368 . . . . . . . . 224 Q N . 51604 1 279 . 1 . 1 61 61 ASP H H 1 8.38669014 . . . . . . . . 225 D H . 51604 1 280 . 1 . 1 61 61 ASP C C 13 176.3415527 . . . . . . . . 225 D CO . 51604 1 281 . 1 . 1 61 61 ASP CA C 13 54.18743896 . . . . . . . . 225 D CA . 51604 1 282 . 1 . 1 61 61 ASP CB C 13 40.92102051 . . . . . . . . 225 D CB . 51604 1 283 . 1 . 1 61 61 ASP N N 15 121.7844772 . . . . . . . . 225 D N . 51604 1 284 . 1 . 1 62 62 VAL H H 1 8.072930336 . . . . . . . . 226 V H . 51604 1 285 . 1 . 1 62 62 VAL C C 13 176.7769623 . . . . . . . . 226 V CO . 51604 1 286 . 1 . 1 62 62 VAL CA C 13 62.20848846 . . . . . . . . 226 V CA . 51604 1 287 . 1 . 1 62 62 VAL CB C 13 32.27072144 . . . . . . . . 226 V CB . 51604 1 288 . 1 . 1 62 62 VAL N N 15 119.8202133 . . . . . . . . 226 V N . 51604 1 289 . 1 . 1 63 63 GLY H H 1 8.46216011 . . . . . . . . 227 G H . 51604 1 290 . 1 . 1 63 63 GLY C C 13 174.274704 . . . . . . . . 227 G CO . 51604 1 291 . 1 . 1 63 63 GLY CA C 13 45.17782974 . . . . . . . . 227 G CA . 51604 1 292 . 1 . 1 63 63 GLY N N 15 111.7663193 . . . . . . . . 227 G N . 51604 1 293 . 1 . 1 64 64 THR H H 1 7.969309807 . . . . . . . . 228 T H . 51604 1 294 . 1 . 1 64 64 THR C C 13 174.1280975 . . . . . . . . 228 T CO . 51604 1 295 . 1 . 1 64 64 THR CA C 13 61.51343155 . . . . . . . . 228 T CA . 51604 1 296 . 1 . 1 64 64 THR CB C 13 69.50853729 . . . . . . . . 228 T CB . 51604 1 297 . 1 . 1 64 64 THR N N 15 113.8830795 . . . . . . . . 228 T N . 51604 1 298 . 1 . 1 65 65 ALA H H 1 8.260100365 . . . . . . . . 229 A H . 51604 1 299 . 1 . 1 65 65 ALA C C 13 177.2736511 . . . . . . . . 229 A CO . 51604 1 300 . 1 . 1 65 65 ALA CA C 13 52.1457901 . . . . . . . . 229 A CA . 51604 1 301 . 1 . 1 65 65 ALA CB C 13 19.04026985 . . . . . . . . 229 A CB . 51604 1 302 . 1 . 1 65 65 ALA N N 15 126.917717 . . . . . . . . 229 A N . 51604 1 303 . 1 . 1 66 66 ILE H H 1 8.15528965 . . . . . . . . 230 I H . 51604 1 304 . 1 . 1 66 66 ILE C C 13 176.2242584 . . . . . . . . 230 I CO . 51604 1 305 . 1 . 1 66 66 ILE CA C 13 60.71120071 . . . . . . . . 230 I CA . 51604 1 306 . 1 . 1 66 66 ILE CB C 13 38.35673904 . . . . . . . . 230 I CB . 51604 1 307 . 1 . 1 66 66 ILE N N 15 121.1461182 . . . . . . . . 230 I N . 51604 1 308 . 1 . 1 67 67 VAL H H 1 8.273320198 . . . . . . . . 231 V H . 51604 1 309 . 1 . 1 67 67 VAL C C 13 175.8526764 . . . . . . . . 231 V CO . 51604 1 310 . 1 . 1 67 67 VAL CA C 13 61.78527069 . . . . . . . . 231 V CA . 51604 1 311 . 1 . 1 67 67 VAL CB C 13 32.62253952 . . . . . . . . 231 V CB . 51604 1 312 . 1 . 1 67 67 VAL N N 15 125.4358063 . . . . . . . . 231 V N . 51604 1 313 . 1 . 1 68 68 SER H H 1 8.402190208 . . . . . . . . 232 S H . 51604 1 314 . 1 . 1 68 68 SER C C 13 173.9797821 . . . . . . . . 232 S CO . 51604 1 315 . 1 . 1 68 68 SER CA C 13 57.73876953 . . . . . . . . 232 S CA . 51604 1 316 . 1 . 1 68 68 SER CB C 13 63.7530899 . . . . . . . . 232 S CB . 51604 1 317 . 1 . 1 68 68 SER N N 15 120.240387 . . . . . . . . 232 S N . 51604 1 318 . 1 . 1 69 69 ASP H H 1 8.415109634 . . . . . . . . 233 D H . 51604 1 319 . 1 . 1 69 69 ASP C C 13 176.3554993 . . . . . . . . 233 D CO . 51604 1 320 . 1 . 1 69 69 ASP CA C 13 54.12322998 . . . . . . . . 233 D CA . 51604 1 321 . 1 . 1 69 69 ASP CB C 13 41.03506851 . . . . . . . . 233 D CB . 51604 1 322 . 1 . 1 69 69 ASP N N 15 122.9984665 . . . . . . . . 233 D N . 51604 1 323 . 1 . 1 70 70 THR H H 1 8.172189713 . . . . . . . . 234 T H . 51604 1 324 . 1 . 1 70 70 THR C C 13 174.7498474 . . . . . . . . 234 T CO . 51604 1 325 . 1 . 1 70 70 THR CA C 13 61.34320068 . . . . . . . . 234 T CA . 51604 1 326 . 1 . 1 70 70 THR CB C 13 69.47515869 . . . . . . . . 234 T CB . 51604 1 327 . 1 . 1 70 70 THR N N 15 114.0984116 . . . . . . . . 234 T N . 51604 1 328 . 1 . 1 71 71 THR H H 1 8.197509766 . . . . . . . . 235 T H . 51604 1 329 . 1 . 1 71 71 THR C C 13 174.3638611 . . . . . . . . 235 T CO . 51604 1 330 . 1 . 1 71 71 THR CA C 13 61.76050949 . . . . . . . . 235 T CA . 51604 1 331 . 1 . 1 71 71 THR CB C 13 69.45966339 . . . . . . . . 235 T CB . 51604 1 332 . 1 . 1 71 71 THR N N 15 116.005043 . . . . . . . . 235 T N . 51604 1 333 . 1 . 1 72 72 ASP H H 1 8.261039734 . . . . . . . . 236 D H . 51604 1 334 . 1 . 1 72 72 ASP C C 13 175.980011 . . . . . . . . 236 D CO . 51604 1 335 . 1 . 1 72 72 ASP CA C 13 54.3155899 . . . . . . . . 236 D CA . 51604 1 336 . 1 . 1 72 72 ASP CB C 13 41.07041931 . . . . . . . . 236 D CB . 51604 1 337 . 1 . 1 72 72 ASP N N 15 122.6883926 . . . . . . . . 236 D N . 51604 1 338 . 1 . 1 73 73 ASP H H 1 8.275710106 . . . . . . . . 237 D H . 51604 1 339 . 1 . 1 73 73 ASP C C 13 176.4868317 . . . . . . . . 237 D CO . 51604 1 340 . 1 . 1 73 73 ASP CA C 13 54.51897049 . . . . . . . . 237 D CA . 51604 1 341 . 1 . 1 73 73 ASP CB C 13 40.78395081 . . . . . . . . 237 D CB . 51604 1 342 . 1 . 1 73 73 ASP N N 15 120.7195663 . . . . . . . . 237 D N . 51604 1 343 . 1 . 1 74 74 LEU H H 1 8.066329956 . . . . . . . . 238 L H . 51604 1 344 . 1 . 1 74 74 LEU C C 13 177.5596008 . . . . . . . . 238 L CO . 51604 1 345 . 1 . 1 74 74 LEU CA C 13 55.20127869 . . . . . . . . 238 L CA . 51604 1 346 . 1 . 1 74 74 LEU CB C 13 41.36162949 . . . . . . . . 238 L CB . 51604 1 347 . 1 . 1 74 74 LEU N N 15 121.4345093 . . . . . . . . 238 L N . 51604 1 348 . 1 . 1 75 75 TRP H H 1 7.880740166 . . . . . . . . 239 W H . 51604 1 349 . 1 . 1 75 75 TRP C C 13 176.2060089 . . . . . . . . 239 W CO . 51604 1 350 . 1 . 1 75 75 TRP CA C 13 57.71033859 . . . . . . . . 239 W CA . 51604 1 351 . 1 . 1 75 75 TRP CB C 13 29.04552078 . . . . . . . . 239 W CB . 51604 1 352 . 1 . 1 75 75 TRP N N 15 120.6952667 . . . . . . . . 239 W N . 51604 1 353 . 1 . 1 76 76 PHE H H 1 7.414999962 . . . . . . . . 240 F H . 51604 1 354 . 1 . 1 76 76 PHE C C 13 175.4604492 . . . . . . . . 240 F CO . 51604 1 355 . 1 . 1 76 76 PHE CA C 13 57.57809067 . . . . . . . . 240 F CA . 51604 1 356 . 1 . 1 76 76 PHE CB C 13 38.80968857 . . . . . . . . 240 F CB . 51604 1 357 . 1 . 1 76 76 PHE N N 15 119.5234528 . . . . . . . . 240 F N . 51604 1 358 . 1 . 1 77 77 LEU H H 1 7.736480236 . . . . . . . . 241 L H . 51604 1 359 . 1 . 1 77 77 LEU C C 13 176.894165 . . . . . . . . 241 L CO . 51604 1 360 . 1 . 1 77 77 LEU CA C 13 55.13830185 . . . . . . . . 241 L CA . 51604 1 361 . 1 . 1 77 77 LEU CB C 13 41.96554184 . . . . . . . . 241 L CB . 51604 1 362 . 1 . 1 77 77 LEU N N 15 122.5399399 . . . . . . . . 241 L N . 51604 1 363 . 1 . 1 78 78 ASN H H 1 8.12195015 . . . . . . . . 242 N H . 51604 1 364 . 1 . 1 78 78 ASN C C 13 175.2492218 . . . . . . . . 242 N CO . 51604 1 365 . 1 . 1 78 78 ASN CA C 13 53.2005806 . . . . . . . . 242 N CA . 51604 1 366 . 1 . 1 78 78 ASN CB C 13 38.77622986 . . . . . . . . 242 N CB . 51604 1 367 . 1 . 1 78 78 ASN N N 15 119.2285233 . . . . . . . . 242 N N . 51604 1 368 . 1 . 1 79 79 GLU H H 1 8.304699898 . . . . . . . . 243 E H . 51604 1 369 . 1 . 1 79 79 GLU C C 13 176.5255127 . . . . . . . . 243 E CO . 51604 1 370 . 1 . 1 79 79 GLU CA C 13 56.68709183 . . . . . . . . 243 E CA . 51604 1 371 . 1 . 1 79 79 GLU CB C 13 30.07677078 . . . . . . . . 243 E CB . 51604 1 372 . 1 . 1 79 79 GLU N N 15 121.2981796 . . . . . . . . 243 E N . 51604 1 373 . 1 . 1 80 80 SER H H 1 8.284749985 . . . . . . . . 244 S H . 51604 1 374 . 1 . 1 80 80 SER C C 13 174.69841 . . . . . . . . 244 S CO . 51604 1 375 . 1 . 1 80 80 SER CA C 13 58.35071182 . . . . . . . . 244 S CA . 51604 1 376 . 1 . 1 80 80 SER CB C 13 63.40829849 . . . . . . . . 244 S CB . 51604 1 377 . 1 . 1 80 80 SER N N 15 116.5516968 . . . . . . . . 244 S N . 51604 1 378 . 1 . 1 81 81 VAL H H 1 8.07131958 . . . . . . . . 245 V H . 51604 1 379 . 1 . 1 81 81 VAL C C 13 176.365387 . . . . . . . . 245 V CO . 51604 1 380 . 1 . 1 81 81 VAL CA C 13 62.29822922 . . . . . . . . 245 V CA . 51604 1 381 . 1 . 1 81 81 VAL CB C 13 32.44097137 . . . . . . . . 245 V CB . 51604 1 382 . 1 . 1 81 81 VAL N N 15 121.4859467 . . . . . . . . 245 V N . 51604 1 383 . 1 . 1 82 82 SER H H 1 8.280960083 . . . . . . . . 246 S H . 51604 1 384 . 1 . 1 82 82 SER C C 13 174.8178406 . . . . . . . . 246 S CO . 51604 1 385 . 1 . 1 82 82 SER CA C 13 58.48801041 . . . . . . . . 246 S CA . 51604 1 386 . 1 . 1 82 82 SER CB C 13 63.4561615 . . . . . . . . 246 S CB . 51604 1 387 . 1 . 1 82 82 SER N N 15 118.7784271 . . . . . . . . 246 S N . 51604 1 388 . 1 . 1 83 83 GLU H H 1 8.39511013 . . . . . . . . 247 E H . 51604 1 389 . 1 . 1 83 83 GLU C C 13 176.5288086 . . . . . . . . 247 E CO . 51604 1 390 . 1 . 1 83 83 GLU CA C 13 56.7239418 . . . . . . . . 247 E CA . 51604 1 391 . 1 . 1 83 83 GLU CB C 13 29.9887104 . . . . . . . . 247 E CB . 51604 1 392 . 1 . 1 83 83 GLU N N 15 122.9952316 . . . . . . . . 247 E N . 51604 1 393 . 1 . 1 84 84 GLN H H 1 8.308919907 . . . . . . . . 248 Q H . 51604 1 394 . 1 . 1 84 84 GLN C C 13 175.9940643 . . . . . . . . 248 Q CO . 51604 1 395 . 1 . 1 84 84 GLN CA C 13 55.69939041 . . . . . . . . 248 Q CA . 51604 1 396 . 1 . 1 84 84 GLN CB C 13 29.01098061 . . . . . . . . 248 Q CB . 51604 1 397 . 1 . 1 84 84 GLN N N 15 120.853157 . . . . . . . . 248 Q N . 51604 1 398 . 1 . 1 85 85 LEU H H 1 8.220020294 . . . . . . . . 249 L H . 51604 1 399 . 1 . 1 85 85 LEU C C 13 177.9326782 . . . . . . . . 249 L CO . 51604 1 400 . 1 . 1 85 85 LEU CA C 13 55.06317902 . . . . . . . . 249 L CA . 51604 1 401 . 1 . 1 85 85 LEU CB C 13 42.09999847 . . . . . . . . 249 L CB . 51604 1 402 . 1 . 1 85 85 LEU N N 15 123.0075607 . . . . . . . . 249 L N . 51604 1 403 . 1 . 1 86 86 GLY H H 1 8.363690376 . . . . . . . . 250 G H . 51604 1 404 . 1 . 1 86 86 GLY C C 13 174.1147614 . . . . . . . . 250 G CO . 51604 1 405 . 1 . 1 86 86 GLY CA C 13 45.17153931 . . . . . . . . 250 G CA . 51604 1 406 . 1 . 1 86 86 GLY N N 15 109.4680328 . . . . . . . . 250 G N . 51604 1 407 . 1 . 1 87 87 VAL H H 1 7.914259911 . . . . . . . . 251 V H . 51604 1 408 . 1 . 1 87 87 VAL C C 13 176.6636047 . . . . . . . . 251 V CO . 51604 1 409 . 1 . 1 87 87 VAL CA C 13 62.11275101 . . . . . . . . 251 V CA . 51604 1 410 . 1 . 1 87 87 VAL CB C 13 32.39925003 . . . . . . . . 251 V CB . 51604 1 411 . 1 . 1 87 87 VAL N N 15 118.7687378 . . . . . . . . 251 V N . 51604 1 412 . 1 . 1 88 88 GLY H H 1 8.466190338 . . . . . . . . 252 G H . 51604 1 413 . 1 . 1 88 88 GLY C C 13 173.7471161 . . . . . . . . 252 G CO . 51604 1 414 . 1 . 1 88 88 GLY CA C 13 44.93692017 . . . . . . . . 252 G CA . 51604 1 415 . 1 . 1 88 88 GLY N N 15 112.3437195 . . . . . . . . 252 G N . 51604 1 416 . 1 . 1 89 89 ILE H H 1 7.893660069 . . . . . . . . 253 I H . 51604 1 417 . 1 . 1 89 89 ILE C C 13 175.9355469 . . . . . . . . 253 I CO . 51604 1 418 . 1 . 1 89 89 ILE CA C 13 60.65539932 . . . . . . . . 253 I CA . 51604 1 419 . 1 . 1 89 89 ILE CB C 13 38.58555984 . . . . . . . . 253 I CB . 51604 1 420 . 1 . 1 89 89 ILE N N 15 120.2675323 . . . . . . . . 253 I N . 51604 1 421 . 1 . 1 90 90 LYS H H 1 8.397500038 . . . . . . . . 254 K H . 51604 1 422 . 1 . 1 90 90 LYS C C 13 176.0363617 . . . . . . . . 254 K CO . 51604 1 423 . 1 . 1 90 90 LYS CA C 13 55.74002838 . . . . . . . . 254 K CA . 51604 1 424 . 1 . 1 90 90 LYS CB C 13 32.87778091 . . . . . . . . 254 K CB . 51604 1 425 . 1 . 1 90 90 LYS N N 15 126.5043488 . . . . . . . . 254 K N . 51604 1 426 . 1 . 1 91 91 VAL H H 1 8.281979561 . . . . . . . . 255 V H . 51604 1 427 . 1 . 1 91 91 VAL C C 13 175.9853973 . . . . . . . . 255 V CO . 51604 1 428 . 1 . 1 91 91 VAL CA C 13 61.92507172 . . . . . . . . 255 V CA . 51604 1 429 . 1 . 1 91 91 VAL CB C 13 32.73707962 . . . . . . . . 255 V CB . 51604 1 430 . 1 . 1 91 91 VAL N N 15 123.5300064 . . . . . . . . 255 V N . 51604 1 431 . 1 . 1 92 92 GLU H H 1 8.530819893 . . . . . . . . 256 E H . 51604 1 432 . 1 . 1 92 92 GLU C C 13 175.8668976 . . . . . . . . 256 E CO . 51604 1 433 . 1 . 1 92 92 GLU CA C 13 55.98511887 . . . . . . . . 256 E CA . 51604 1 434 . 1 . 1 92 92 GLU CB C 13 30.14764977 . . . . . . . . 256 E CB . 51604 1 435 . 1 . 1 92 92 GLU N N 15 125.5737762 . . . . . . . . 256 E N . 51604 1 436 . 1 . 1 93 93 ALA H H 1 8.367409706 . . . . . . . . 257 A H . 51604 1 437 . 1 . 1 93 93 ALA C C 13 177.1146545 . . . . . . . . 257 A CO . 51604 1 438 . 1 . 1 93 93 ALA CA C 13 52.0572319 . . . . . . . . 257 A CA . 51604 1 439 . 1 . 1 93 93 ALA CB C 13 19.18568039 . . . . . . . . 257 A CB . 51604 1 440 . 1 . 1 93 93 ALA N N 15 125.8205338 . . . . . . . . 257 A N . 51604 1 441 . 1 . 1 94 94 ALA H H 1 8.305740356 . . . . . . . . 258 A H . 51604 1 442 . 1 . 1 94 94 ALA C C 13 177.2992859 . . . . . . . . 258 A CO . 51604 1 443 . 1 . 1 94 94 ALA CA C 13 52.04124832 . . . . . . . . 258 A CA . 51604 1 444 . 1 . 1 94 94 ALA CB C 13 19.29496002 . . . . . . . . 258 A CB . 51604 1 445 . 1 . 1 94 94 ALA N N 15 123.7580566 . . . . . . . . 258 A N . 51604 1 446 . 1 . 1 95 95 ASP H H 1 8.347800255 . . . . . . . . 259 D H . 51604 1 447 . 1 . 1 95 95 ASP C C 13 175.5296478 . . . . . . . . 259 D CO . 51604 1 448 . 1 . 1 95 95 ASP CA C 13 54.19218826 . . . . . . . . 259 D CA . 51604 1 449 . 1 . 1 95 95 ASP CB C 13 40.78390884 . . . . . . . . 259 D CB . 51604 1 450 . 1 . 1 95 95 ASP N N 15 120.0038605 . . . . . . . . 259 D N . 51604 1 451 . 1 . 1 96 96 THR H H 1 7.662909985 . . . . . . . . 260 T H . 51604 1 452 . 1 . 1 96 96 THR CA C 13 62.85887909 . . . . . . . . 260 T CA . 51604 1 453 . 1 . 1 96 96 THR CB C 13 70.58779907 . . . . . . . . 260 T CB . 51604 1 454 . 1 . 1 96 96 THR N N 15 118.6948624 . . . . . . . . 260 T N . 51604 1 stop_ save_