################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27399 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details ; Reference offsets by PANAV: CO: -0.40ppm CA: -0.28ppm CB: 0.41ppm N: 0.04ppm ; _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 '15N-1H BEST_TROSY' . . . 27399 1 2 '3D trHNCO' . . . 27399 1 3 '3D trHNCACO' . . . 27399 1 4 '3D trHNCA' . . . 27399 1 5 '3D trHNCOCA' . . . 27399 1 6 '3D trHNCOCACB' . . . 27399 1 7 '3D trHNCACB' . . . 27399 1 8 '3D trHNCANNH' . . . 27399 1 9 '3D trHNCOCANNH' . . . 27399 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 $Topspin . . 27399 1 2 $qMDD . . 27399 1 3 $nmrPipe . . 27399 1 4 $Sparky . . 27399 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY H H 1 8.17 0.02 . 1 . . . . . 282 GLY H . 27399 1 2 . 1 1 1 1 GLY C C 13 173.66 0.1 . 1 . . . . . 282 GLY C . 27399 1 3 . 1 1 1 1 GLY CA C 13 45.09 0.04 . 1 . . . . . 282 GLY CA . 27399 1 4 . 1 1 1 1 GLY N N 15 110.428 0.2 . 1 . . . . . 282 GLY N . 27399 1 5 . 1 1 2 2 ALA H H 1 7.92 0.02 . 1 . . . . . 283 ALA H . 27399 1 6 . 1 1 2 2 ALA C C 13 176.04 0.1 . 1 . . . . . 283 ALA C . 27399 1 7 . 1 1 2 2 ALA CA C 13 52.2 0.04 . 1 . . . . . 283 ALA CA . 27399 1 8 . 1 1 2 2 ALA CB C 13 18.89 0.02 . 1 . . . . . 283 ALA CB . 27399 1 9 . 1 1 2 2 ALA N N 15 123.66 0.2 . 1 . . . . . 283 ALA N . 27399 1 10 . 1 1 8 8 SER C C 13 174.89 0.1 . 1 . . . . . 289 SER C . 27399 1 11 . 1 1 8 8 SER CA C 13 58.95 0.04 . 1 . . . . . 289 SER CA . 27399 1 12 . 1 1 8 8 SER CB C 13 63.8 0.02 . 1 . . . . . 289 SER CB . 27399 1 13 . 1 1 9 9 TYR H H 1 7.94 0.02 . 1 . . . . . 290 TYR H . 27399 1 14 . 1 1 9 9 TYR C C 13 176.06 0.1 . 1 . . . . . 290 TYR C . 27399 1 15 . 1 1 9 9 TYR CA C 13 58.27 0.04 . 1 . . . . . 290 TYR CA . 27399 1 16 . 1 1 9 9 TYR CB C 13 38.06 0.02 . 1 . . . . . 290 TYR CB . 27399 1 17 . 1 1 9 9 TYR N N 15 122.31 0.2 . 1 . . . . . 290 TYR N . 27399 1 18 . 1 1 10 10 LEU H H 1 7.83 0.02 . 1 . . . . . 291 LEU H . 27399 1 19 . 1 1 10 10 LEU C C 13 177.59 0.1 . 1 . . . . . 291 LEU C . 27399 1 20 . 1 1 10 10 LEU CA C 13 55.37 0.04 . 1 . . . . . 291 LEU CA . 27399 1 21 . 1 1 10 10 LEU CB C 13 41.6 0.02 . 1 . . . . . 291 LEU CB . 27399 1 22 . 1 1 10 10 LEU N N 15 123.22 0.2 . 1 . . . . . 291 LEU N . 27399 1 23 . 1 1 11 11 LEU H H 1 7.88 0.02 . 1 . . . . . 292 LEU H . 27399 1 24 . 1 1 11 11 LEU C C 13 177.85 0.1 . 1 . . . . . 292 LEU C . 27399 1 25 . 1 1 11 11 LEU CA C 13 55.14 0.04 . 1 . . . . . 292 LEU CA . 27399 1 26 . 1 1 11 11 LEU CB C 13 41.77 0.02 . 1 . . . . . 292 LEU CB . 27399 1 27 . 1 1 11 11 LEU N N 15 122.47 0.2 . 1 . . . . . 292 LEU N . 27399 1 28 . 1 1 12 12 SER H H 1 8.03 0.02 . 1 . . . . . 293 SER H . 27399 1 29 . 1 1 12 12 SER CA C 13 58.45 0.04 . 1 . . . . . 293 SER CA . 27399 1 30 . 1 1 12 12 SER CB C 13 63.8 0.02 . 1 . . . . . 293 SER CB . 27399 1 31 . 1 1 12 12 SER N N 15 116.21 0.2 . 1 . . . . . 293 SER N . 27399 1 32 . 1 1 16 16 ASN C C 13 175.44 0.1 . 1 . . . . . 297 ASN C . 27399 1 33 . 1 1 16 16 ASN CA C 13 53.65 0.04 . 1 . . . . . 297 ASN CA . 27399 1 34 . 1 1 16 16 ASN CB C 13 38.7 0.02 . 1 . . . . . 297 ASN CB . 27399 1 35 . 1 1 17 17 ASP H H 1 8.16 0.02 . 1 . . . . . 298 ASP H . 27399 1 36 . 1 1 17 17 ASP C C 13 177.07 0.1 . 1 . . . . . 298 ASP C . 27399 1 37 . 1 1 17 17 ASP CA C 13 54.6 0.04 . 1 . . . . . 298 ASP CA . 27399 1 38 . 1 1 17 17 ASP CB C 13 40.83 0.02 . 1 . . . . . 298 ASP CB . 27399 1 39 . 1 1 17 17 ASP N N 15 121.31 0.2 . 1 . . . . . 298 ASP N . 27399 1 40 . 1 1 18 18 SER H H 1 8.18 0.02 . 1 . . . . . 299 SER H . 27399 1 41 . 1 1 18 18 SER C C 13 175.34 0.1 . 1 . . . . . 299 SER C . 27399 1 42 . 1 1 18 18 SER CA C 13 59.32 0.04 . 1 . . . . . 299 SER CA . 27399 1 43 . 1 1 18 18 SER CB C 13 63.85 0.02 . 1 . . . . . 299 SER CB . 27399 1 44 . 1 1 18 18 SER N N 15 116.9 0.2 . 1 . . . . . 299 SER N . 27399 1 45 . 1 1 19 19 ALA H H 1 8.16 0.02 . 1 . . . . . 300 ALA H . 27399 1 46 . 1 1 19 19 ALA C C 13 178.62 0.1 . 1 . . . . . 300 ALA C . 27399 1 47 . 1 1 19 19 ALA CA C 13 53.18 0.04 . 1 . . . . . 300 ALA CA . 27399 1 48 . 1 1 19 19 ALA CB C 13 18.58 0.02 . 1 . . . . . 300 ALA CB . 27399 1 49 . 1 1 19 19 ALA N N 15 125.61 0.2 . 1 . . . . . 300 ALA N . 27399 1 50 . 1 1 20 20 SER H H 1 7.98 0.02 . 1 . . . . . 301 SER H . 27399 1 51 . 1 1 20 20 SER C C 13 175.06 0.1 . 1 . . . . . 301 SER C . 27399 1 52 . 1 1 20 20 SER CA C 13 58.87 0.04 . 1 . . . . . 301 SER CA . 27399 1 53 . 1 1 20 20 SER CB C 13 63.82 0.02 . 1 . . . . . 301 SER CB . 27399 1 54 . 1 1 20 20 SER N N 15 114.6 0.2 . 1 . . . . . 301 SER N . 27399 1 55 . 1 1 21 21 ARG H H 1 8 0.02 . 1 . . . . . 302 ARG H . 27399 1 56 . 1 1 21 21 ARG C C 13 176.55 0.1 . 1 . . . . . 302 ARG C . 27399 1 57 . 1 1 21 21 ARG CA C 13 56.23 0.04 . 1 . . . . . 302 ARG CA . 27399 1 58 . 1 1 21 21 ARG CB C 13 29.89 0.02 . 1 . . . . . 302 ARG CB . 27399 1 59 . 1 1 21 21 ARG N N 15 122.93 0.2 . 1 . . . . . 302 ARG N . 27399 1 60 . 1 1 22 22 LYS H H 1 8.09 0.02 . 1 . . . . . 303 LYS H . 27399 1 61 . 1 1 22 22 LYS C C 13 176.84 0.1 . 1 . . . . . 303 LYS C . 27399 1 62 . 1 1 22 22 LYS CA C 13 59.74 0.04 . 1 . . . . . 303 LYS CA . 27399 1 63 . 1 1 22 22 LYS CB C 13 32.42 0.02 . 1 . . . . . 303 LYS CB . 27399 1 64 . 1 1 22 22 LYS N N 15 122.56 0.2 . 1 . . . . . 303 LYS N . 27399 1 65 . 1 1 25 25 PRO C C 13 177.28 0.1 . 1 . . . . . 306 PRO C . 27399 1 66 . 1 1 25 25 PRO CA C 13 63.14 0.04 . 1 . . . . . 306 PRO CA . 27399 1 67 . 1 1 25 25 PRO CB C 13 31.68 0.02 . 1 . . . . . 306 PRO CB . 27399 1 68 . 1 1 26 26 LYS H H 1 8.29 0.02 . 1 . . . . . 307 LYS H . 27399 1 69 . 1 1 26 26 LYS C C 13 176.77 0.1 . 1 . . . . . 307 LYS C . 27399 1 70 . 1 1 26 26 LYS CA C 13 56.22 0.04 . 1 . . . . . 307 LYS CA . 27399 1 71 . 1 1 26 26 LYS CB C 13 32.86 0.02 . 1 . . . . . 307 LYS CB . 27399 1 72 . 1 1 26 26 LYS N N 15 122.37 0.2 . 1 . . . . . 307 LYS N . 27399 1 73 . 1 1 27 27 ALA H H 1 8.19 0.02 . 1 . . . . . 308 ALA H . 27399 1 74 . 1 1 27 27 ALA C C 13 177.86 0.1 . 1 . . . . . 308 ALA C . 27399 1 75 . 1 1 27 27 ALA CA C 13 52.39 0.04 . 1 . . . . . 308 ALA CA . 27399 1 76 . 1 1 27 27 ALA CB C 13 18.76 0.02 . 1 . . . . . 308 ALA CB . 27399 1 77 . 1 1 27 27 ALA N N 15 125.68 0.2 . 1 . . . . . 308 ALA N . 27399 1 78 . 1 1 28 28 ARG H H 1 8.23 0.02 . 1 . . . . . 309 ARG H . 27399 1 79 . 1 1 28 28 ARG CA C 13 55.93 0.04 . 1 . . . . . 309 ARG CA . 27399 1 80 . 1 1 28 28 ARG CB C 13 30.16 0.02 . 1 . . . . . 309 ARG CB . 27399 1 81 . 1 1 28 28 ARG N N 15 121.15 0.2 . 1 . . . . . 309 ARG N . 27399 1 82 . 1 1 29 29 ALA H H 1 7.85 0.02 . 1 . . . . . 310 ALA H . 27399 1 83 . 1 1 29 29 ALA C C 13 176.14 0.1 . 1 . . . . . 310 ALA C . 27399 1 84 . 1 1 29 29 ALA CA C 13 53.69 0.04 . 1 . . . . . 310 ALA CA . 27399 1 85 . 1 1 29 29 ALA CB C 13 19.73 0.02 . 1 . . . . . 310 ALA CB . 27399 1 86 . 1 1 29 29 ALA N N 15 131.45 0.2 . 1 . . . . . 310 ALA N . 27399 1 87 . 1 1 30 30 SER H H 1 6.82 0.02 . 1 . . . . . 311 SER H . 27399 1 88 . 1 1 30 30 SER C C 13 172.44 0.1 . 1 . . . . . 311 SER C . 27399 1 89 . 1 1 30 30 SER CA C 13 59.14 0.04 . 1 . . . . . 311 SER CA . 27399 1 90 . 1 1 30 30 SER CB C 13 64 0.02 . 1 . . . . . 311 SER CB . 27399 1 91 . 1 1 30 30 SER N N 15 118.67 0.2 . 1 . . . . . 311 SER N . 27399 1 92 . 1 1 42 42 GLU H H 1 9.06 0.02 . 1 . . . . . 323 GLU H . 27399 1 93 . 1 1 42 42 GLU C C 13 176.35 0.1 . 1 . . . . . 323 GLU C . 27399 1 94 . 1 1 42 42 GLU CA C 13 55.95 0.04 . 1 . . . . . 323 GLU CA . 27399 1 95 . 1 1 42 42 GLU CB C 13 41.92 0.02 . 1 . . . . . 323 GLU CB . 27399 1 96 . 1 1 42 42 GLU N N 15 121.08 0.2 . 1 . . . . . 323 GLU N . 27399 1 97 . 1 1 43 43 HIS H H 1 7.68 0.02 . 1 . . . . . 324 HIS H . 27399 1 98 . 1 1 43 43 HIS C C 13 173.94 0.1 . 1 . . . . . 324 HIS C . 27399 1 99 . 1 1 43 43 HIS CA C 13 56.71 0.04 . 1 . . . . . 324 HIS CA . 27399 1 100 . 1 1 43 43 HIS CB C 13 29.49 0.02 . 1 . . . . . 324 HIS CB . 27399 1 101 . 1 1 43 43 HIS N N 15 123.36 0.2 . 1 . . . . . 324 HIS N . 27399 1 102 . 1 1 44 44 ARG H H 1 7.75 0.02 . 1 . . . . . 325 ARG H . 27399 1 103 . 1 1 44 44 ARG C C 13 176.78 0.1 . 1 . . . . . 325 ARG C . 27399 1 104 . 1 1 44 44 ARG CA C 13 53.86 0.04 . 1 . . . . . 325 ARG CA . 27399 1 105 . 1 1 44 44 ARG CB C 13 35.04 0.02 . 1 . . . . . 325 ARG CB . 27399 1 106 . 1 1 44 44 ARG N N 15 123.9 0.2 . 1 . . . . . 325 ARG N . 27399 1 107 . 1 1 45 45 ASN H H 1 8.53 0.02 . 1 . . . . . 326 ASN H . 27399 1 108 . 1 1 45 45 ASN C C 13 178.11 0.1 . 1 . . . . . 326 ASN C . 27399 1 109 . 1 1 45 45 ASN CA C 13 50.84 0.04 . 1 . . . . . 326 ASN CA . 27399 1 110 . 1 1 45 45 ASN CB C 13 38.67 0.02 . 1 . . . . . 326 ASN CB . 27399 1 111 . 1 1 45 45 ASN N N 15 118.74 0.2 . 1 . . . . . 326 ASN N . 27399 1 112 . 1 1 46 46 GLU H H 1 9.08 0.02 . 1 . . . . . 327 GLU H . 27399 1 113 . 1 1 46 46 GLU C C 13 177.76 0.1 . 1 . . . . . 327 GLU C . 27399 1 114 . 1 1 46 46 GLU CA C 13 58.95 0.04 . 1 . . . . . 327 GLU CA . 27399 1 115 . 1 1 46 46 GLU CB C 13 28.27 0.02 . 1 . . . . . 327 GLU CB . 27399 1 116 . 1 1 46 46 GLU N N 15 119.34 0.2 . 1 . . . . . 327 GLU N . 27399 1 117 . 1 1 47 47 LYS H H 1 7.39 0.02 . 1 . . . . . 328 LYS H . 27399 1 118 . 1 1 47 47 LYS C C 13 177.19 0.1 . 1 . . . . . 328 LYS C . 27399 1 119 . 1 1 47 47 LYS CA C 13 56.06 0.04 . 1 . . . . . 328 LYS CA . 27399 1 120 . 1 1 47 47 LYS CB C 13 31.89 0.02 . 1 . . . . . 328 LYS CB . 27399 1 121 . 1 1 47 47 LYS N N 15 118.41 0.2 . 1 . . . . . 328 LYS N . 27399 1 122 . 1 1 48 48 GLY H H 1 8.02 0.02 . 1 . . . . . 329 GLY H . 27399 1 123 . 1 1 48 48 GLY C C 13 174.97 0.1 . 1 . . . . . 329 GLY C . 27399 1 124 . 1 1 48 48 GLY CA C 13 45.21 0.04 . 1 . . . . . 329 GLY CA . 27399 1 125 . 1 1 48 48 GLY N N 15 107.59 0.2 . 1 . . . . . 329 GLY N . 27399 1 126 . 1 1 49 49 GLU H H 1 7.94 0.02 . 1 . . . . . 330 GLU H . 27399 1 127 . 1 1 49 49 GLU C C 13 176.63 0.1 . 1 . . . . . 330 GLU C . 27399 1 128 . 1 1 49 49 GLU CA C 13 55.12 0.04 . 1 . . . . . 330 GLU CA . 27399 1 129 . 1 1 49 49 GLU CB C 13 29.34 0.02 . 1 . . . . . 330 GLU CB . 27399 1 130 . 1 1 49 49 GLU N N 15 123.2 0.2 . 1 . . . . . 330 GLU N . 27399 1 131 . 1 1 50 50 ARG H H 1 8.91 0.02 . 1 . . . . . 331 ARG H . 27399 1 132 . 1 1 50 50 ARG C C 13 175.04 0.1 . 1 . . . . . 331 ARG C . 27399 1 133 . 1 1 50 50 ARG CA C 13 57.18 0.04 . 1 . . . . . 331 ARG CA . 27399 1 134 . 1 1 50 50 ARG CB C 13 29.41 0.02 . 1 . . . . . 331 ARG CB . 27399 1 135 . 1 1 50 50 ARG N N 15 124.38 0.2 . 1 . . . . . 331 ARG N . 27399 1 136 . 1 1 51 51 ILE H H 1 7.83 0.02 . 1 . . . . . 332 ILE H . 27399 1 137 . 1 1 51 51 ILE C C 13 176.69 0.1 . 1 . . . . . 332 ILE C . 27399 1 138 . 1 1 51 51 ILE CA C 13 58.48 0.04 . 1 . . . . . 332 ILE CA . 27399 1 139 . 1 1 51 51 ILE CB C 13 41.96 0.02 . 1 . . . . . 332 ILE CB . 27399 1 140 . 1 1 51 51 ILE N N 15 116.41 0.2 . 1 . . . . . 332 ILE N . 27399 1 141 . 1 1 52 52 SER H H 1 7.78 0.02 . 1 . . . . . 333 SER H . 27399 1 142 . 1 1 52 52 SER C C 13 176.07 0.1 . 1 . . . . . 333 SER C . 27399 1 143 . 1 1 52 52 SER CA C 13 57.91 0.04 . 1 . . . . . 333 SER CA . 27399 1 144 . 1 1 52 52 SER CB C 13 63.34 0.02 . 1 . . . . . 333 SER CB . 27399 1 145 . 1 1 52 52 SER N N 15 115.77 0.2 . 1 . . . . . 333 SER N . 27399 1 146 . 1 1 53 53 MET H H 1 10.34 0.02 . 1 . . . . . 334 MET H . 27399 1 147 . 1 1 53 53 MET C C 13 176.85 0.1 . 1 . . . . . 334 MET C . 27399 1 148 . 1 1 53 53 MET CA C 13 57.42 0.04 . 1 . . . . . 334 MET CA . 27399 1 149 . 1 1 53 53 MET CB C 13 33.43 0.02 . 1 . . . . . 334 MET CB . 27399 1 150 . 1 1 53 53 MET N N 15 126.56 0.2 . 1 . . . . . 334 MET N . 27399 1 151 . 1 1 57 57 ARG C C 13 178.22 0.1 . 1 . . . . . 338 ARG C . 27399 1 152 . 1 1 57 57 ARG CA C 13 62.69 0.04 . 1 . . . . . 338 ARG CA . 27399 1 153 . 1 1 57 57 ARG CB C 13 31.49 0.02 . 1 . . . . . 338 ARG CB . 27399 1 154 . 1 1 58 58 VAL H H 1 8.19 0.02 . 1 . . . . . 339 VAL H . 27399 1 155 . 1 1 58 58 VAL C C 13 174.21 0.1 . 1 . . . . . 339 VAL C . 27399 1 156 . 1 1 58 58 VAL CA C 13 63.19 0.04 . 1 . . . . . 339 VAL CA . 27399 1 157 . 1 1 58 58 VAL CB C 13 30.73 0.02 . 1 . . . . . 339 VAL CB . 27399 1 158 . 1 1 58 58 VAL N N 15 122.83 0.2 . 1 . . . . . 339 VAL N . 27399 1 159 . 1 1 59 59 VAL H H 1 7.81 0.02 . 1 . . . . . 340 VAL H . 27399 1 160 . 1 1 59 59 VAL C C 13 176.24 0.1 . 1 . . . . . 340 VAL C . 27399 1 161 . 1 1 59 59 VAL CA C 13 62.53 0.04 . 1 . . . . . 340 VAL CA . 27399 1 162 . 1 1 59 59 VAL CB C 13 31.8 0.02 . 1 . . . . . 340 VAL CB . 27399 1 163 . 1 1 59 59 VAL N N 15 128.32 0.2 . 1 . . . . . 340 VAL N . 27399 1 164 . 1 1 60 60 LEU H H 1 8.87 0.02 . 1 . . . . . 341 LEU H . 27399 1 165 . 1 1 60 60 LEU C C 13 176.93 0.1 . 1 . . . . . 341 LEU C . 27399 1 166 . 1 1 60 60 LEU CA C 13 52.36 0.04 . 1 . . . . . 341 LEU CA . 27399 1 167 . 1 1 60 60 LEU CB C 13 44.95 0.02 . 1 . . . . . 341 LEU CB . 27399 1 168 . 1 1 60 60 LEU N N 15 128.75 0.2 . 1 . . . . . 341 LEU N . 27399 1 169 . 1 1 61 61 ASP H H 1 8.29 0.02 . 1 . . . . . 342 ASP H . 27399 1 170 . 1 1 61 61 ASP C C 13 178.23 0.1 . 1 . . . . . 342 ASP C . 27399 1 171 . 1 1 61 61 ASP CA C 13 52.54 0.04 . 1 . . . . . 342 ASP CA . 27399 1 172 . 1 1 61 61 ASP CB C 13 40.73 0.02 . 1 . . . . . 342 ASP CB . 27399 1 173 . 1 1 61 61 ASP N N 15 119.64 0.2 . 1 . . . . . 342 ASP N . 27399 1 174 . 1 1 62 62 GLU H H 1 8.44 0.02 . 1 . . . . . 343 GLU H . 27399 1 175 . 1 1 62 62 GLU C C 13 177.74 0.1 . 1 . . . . . 343 GLU C . 27399 1 176 . 1 1 62 62 GLU CA C 13 58.19 0.04 . 1 . . . . . 343 GLU CA . 27399 1 177 . 1 1 62 62 GLU CB C 13 28.3 0.02 . 1 . . . . . 343 GLU CB . 27399 1 178 . 1 1 62 62 GLU N N 15 114.81 0.2 . 1 . . . . . 343 GLU N . 27399 1 179 . 1 1 63 63 ASN H H 1 8.27 0.02 . 1 . . . . . 344 ASN H . 27399 1 180 . 1 1 63 63 ASN C C 13 176 0.1 . 1 . . . . . 344 ASN C . 27399 1 181 . 1 1 63 63 ASN CA C 13 52.97 0.04 . 1 . . . . . 344 ASN CA . 27399 1 182 . 1 1 63 63 ASN CB C 13 39.23 0.02 . 1 . . . . . 344 ASN CB . 27399 1 183 . 1 1 63 63 ASN N N 15 116.9 0.2 . 1 . . . . . 344 ASN N . 27399 1 184 . 1 1 64 64 GLY H H 1 8.3 0.02 . 1 . . . . . 345 GLY H . 27399 1 185 . 1 1 64 64 GLY C C 13 173.97 0.1 . 1 . . . . . 345 GLY C . 27399 1 186 . 1 1 64 64 GLY CA C 13 46.49 0.04 . 1 . . . . . 345 GLY CA . 27399 1 187 . 1 1 64 64 GLY N N 15 107.94 0.2 . 1 . . . . . 345 GLY N . 27399 1 188 . 1 1 65 65 ILE H H 1 8.39 0.02 . 1 . . . . . 346 ILE H . 27399 1 189 . 1 1 65 65 ILE C C 13 177.05 0.1 . 1 . . . . . 346 ILE C . 27399 1 190 . 1 1 65 65 ILE CA C 13 61.06 0.04 . 1 . . . . . 346 ILE CA . 27399 1 191 . 1 1 65 65 ILE CB C 13 38.4 0.02 . 1 . . . . . 346 ILE CB . 27399 1 192 . 1 1 65 65 ILE N N 15 125.94 0.2 . 1 . . . . . 346 ILE N . 27399 1 193 . 1 1 66 66 SER H H 1 9.91 0.02 . 1 . . . . . 347 SER H . 27399 1 194 . 1 1 66 66 SER C C 13 174.86 0.1 . 1 . . . . . 347 SER C . 27399 1 195 . 1 1 66 66 SER CA C 13 55.93 0.04 . 1 . . . . . 347 SER CA . 27399 1 196 . 1 1 66 66 SER CB C 13 64.68 0.02 . 1 . . . . . 347 SER CB . 27399 1 197 . 1 1 66 66 SER N N 15 123.82 0.2 . 1 . . . . . 347 SER N . 27399 1 198 . 1 1 67 67 HIS H H 1 8.47 0.02 . 1 . . . . . 348 HIS H . 27399 1 199 . 1 1 67 67 HIS C C 13 175.8 0.1 . 1 . . . . . 348 HIS C . 27399 1 200 . 1 1 67 67 HIS CA C 13 57.99 0.04 . 1 . . . . . 348 HIS CA . 27399 1 201 . 1 1 67 67 HIS CB C 13 29.42 0.02 . 1 . . . . . 348 HIS CB . 27399 1 202 . 1 1 67 67 HIS N N 15 123.91 0.2 . 1 . . . . . 348 HIS N . 27399 1 203 . 1 1 68 68 ARG H H 1 7.19 0.02 . 1 . . . . . 349 ARG H . 27399 1 204 . 1 1 68 68 ARG C C 13 177.98 0.1 . 1 . . . . . 349 ARG C . 27399 1 205 . 1 1 68 68 ARG CA C 13 56.31 0.04 . 1 . . . . . 349 ARG CA . 27399 1 206 . 1 1 68 68 ARG CB C 13 31.83 0.02 . 1 . . . . . 349 ARG CB . 27399 1 207 . 1 1 68 68 ARG N N 15 115.59 0.2 . 1 . . . . . 349 ARG N . 27399 1 208 . 1 1 69 69 SER H H 1 6.89 0.02 . 1 . . . . . 350 SER H . 27399 1 209 . 1 1 69 69 SER C C 13 171.27 0.1 . 1 . . . . . 350 SER C . 27399 1 210 . 1 1 69 69 SER CA C 13 57.73 0.04 . 1 . . . . . 350 SER CA . 27399 1 211 . 1 1 69 69 SER CB C 13 65.53 0.02 . 1 . . . . . 350 SER CB . 27399 1 212 . 1 1 69 69 SER N N 15 117.31 0.2 . 1 . . . . . 350 SER N . 27399 1 213 . 1 1 70 70 ARG H H 1 9.03 0.02 . 1 . . . . . 351 ARG H . 27399 1 214 . 1 1 70 70 ARG CA C 13 55.67 0.04 . 1 . . . . . 351 ARG CA . 27399 1 215 . 1 1 70 70 ARG CB C 13 33.44 0.02 . 1 . . . . . 351 ARG CB . 27399 1 216 . 1 1 70 70 ARG N N 15 125.51 0.2 . 1 . . . . . 351 ARG N . 27399 1 217 . 1 1 71 71 TYR H H 1 9.18 0.02 . 1 . . . . . 352 TYR H . 27399 1 218 . 1 1 71 71 TYR CA C 13 57.77 0.04 . 1 . . . . . 352 TYR CA . 27399 1 219 . 1 1 71 71 TYR CB C 13 42.05 0.02 . 1 . . . . . 352 TYR CB . 27399 1 220 . 1 1 71 71 TYR N N 15 121.42 0.2 . 1 . . . . . 352 TYR N . 27399 1 221 . 1 1 72 72 PHE H H 1 9.06 0.02 . 1 . . . . . 353 PHE H . 27399 1 222 . 1 1 72 72 PHE CA C 13 55.95 0.04 . 1 . . . . . 353 PHE CA . 27399 1 223 . 1 1 72 72 PHE CB C 13 41.92 0.02 . 1 . . . . . 353 PHE CB . 27399 1 224 . 1 1 72 72 PHE N N 15 121.08 0.2 . 1 . . . . . 353 PHE N . 27399 1 225 . 1 1 74 74 MET C C 13 175.37 0.1 . 1 . . . . . 355 MET C . 27399 1 226 . 1 1 74 74 MET CA C 13 51.64 0.04 . 1 . . . . . 355 MET CA . 27399 1 227 . 1 1 74 74 MET CB C 13 32.31 0.02 . 1 . . . . . 355 MET CB . 27399 1 228 . 1 1 75 75 LEU H H 1 9.13 0.02 . 1 . . . . . 356 LEU H . 27399 1 229 . 1 1 75 75 LEU C C 13 178 0.1 . 1 . . . . . 356 LEU C . 27399 1 230 . 1 1 75 75 LEU CA C 13 53.28 0.04 . 1 . . . . . 356 LEU CA . 27399 1 231 . 1 1 75 75 LEU CB C 13 42.33 0.02 . 1 . . . . . 356 LEU CB . 27399 1 232 . 1 1 75 75 LEU N N 15 126.03 0.2 . 1 . . . . . 356 LEU N . 27399 1 233 . 1 1 76 76 CYS H H 1 9.01 0.02 . 1 . . . . . 357 CYS H . 27399 1 234 . 1 1 76 76 CYS C C 13 175.8 0.1 . 1 . . . . . 357 CYS C . 27399 1 235 . 1 1 76 76 CYS CA C 13 59.74 0.04 . 1 . . . . . 357 CYS CA . 27399 1 236 . 1 1 76 76 CYS CB C 13 29.02 0.02 . 1 . . . . . 357 CYS CB . 27399 1 237 . 1 1 76 76 CYS N N 15 122.96 0.2 . 1 . . . . . 357 CYS N . 27399 1 238 . 1 1 77 77 ASP H H 1 9.01 0.02 . 1 . . . . . 358 ASP H . 27399 1 239 . 1 1 77 77 ASP C C 13 175.34 0.1 . 1 . . . . . 358 ASP C . 27399 1 240 . 1 1 77 77 ASP CA C 13 53.26 0.04 . 1 . . . . . 358 ASP CA . 27399 1 241 . 1 1 77 77 ASP CB C 13 41.48 0.02 . 1 . . . . . 358 ASP CB . 27399 1 242 . 1 1 77 77 ASP N N 15 128.5 0.2 . 1 . . . . . 358 ASP N . 27399 1 243 . 1 1 78 78 ASN H H 1 7.95 0.02 . 1 . . . . . 359 ASN H . 27399 1 244 . 1 1 78 78 ASN C C 13 176.13 0.1 . 1 . . . . . 359 ASN C . 27399 1 245 . 1 1 78 78 ASN CA C 13 52.43 0.04 . 1 . . . . . 359 ASN CA . 27399 1 246 . 1 1 78 78 ASN CB C 13 39.75 0.02 . 1 . . . . . 359 ASN CB . 27399 1 247 . 1 1 78 78 ASN N N 15 118.21 0.2 . 1 . . . . . 359 ASN N . 27399 1 248 . 1 1 79 79 GLU C C 13 178.5 0.1 . 1 . . . . . 360 GLU C . 27399 1 249 . 1 1 79 79 GLU CA C 13 59.02 0.04 . 1 . . . . . 360 GLU CA . 27399 1 250 . 1 1 79 79 GLU CB C 13 29.2 0.02 . 1 . . . . . 360 GLU CB . 27399 1 251 . 1 1 80 80 THR H H 1 7.97 0.02 . 1 . . . . . 361 THR H . 27399 1 252 . 1 1 80 80 THR C C 13 176.49 0.1 . 1 . . . . . 361 THR C . 27399 1 253 . 1 1 80 80 THR CA C 13 66.19 0.04 . 1 . . . . . 361 THR CA . 27399 1 254 . 1 1 80 80 THR CB C 13 68.35 0.02 . 1 . . . . . 361 THR CB . 27399 1 255 . 1 1 80 80 THR N N 15 117.45 0.2 . 1 . . . . . 361 THR N . 27399 1 256 . 1 1 81 81 ALA H H 1 7.22 0.02 . 1 . . . . . 362 ALA H . 27399 1 257 . 1 1 81 81 ALA C C 13 179.5 0.1 . 1 . . . . . 362 ALA C . 27399 1 258 . 1 1 81 81 ALA CA C 13 54.73 0.04 . 1 . . . . . 362 ALA CA . 27399 1 259 . 1 1 81 81 ALA CB C 13 16.4 0.02 . 1 . . . . . 362 ALA CB . 27399 1 260 . 1 1 81 81 ALA N N 15 124.35 0.2 . 1 . . . . . 362 ALA N . 27399 1 261 . 1 1 82 82 ILE H H 1 7.2 0.02 . 1 . . . . . 363 ILE H . 27399 1 262 . 1 1 82 82 ILE C C 13 176.88 0.1 . 1 . . . . . 363 ILE C . 27399 1 263 . 1 1 82 82 ILE CA C 13 61.16 0.04 . 1 . . . . . 363 ILE CA . 27399 1 264 . 1 1 82 82 ILE CB C 13 37.27 0.02 . 1 . . . . . 363 ILE CB . 27399 1 265 . 1 1 82 82 ILE N N 15 115.26 0.2 . 1 . . . . . 363 ILE N . 27399 1 266 . 1 1 83 83 ALA H H 1 7.67 0.02 . 1 . . . . . 364 ALA H . 27399 1 267 . 1 1 83 83 ALA C C 13 181.79 0.1 . 1 . . . . . 364 ALA C . 27399 1 268 . 1 1 83 83 ALA CA C 13 55.31 0.04 . 1 . . . . . 364 ALA CA . 27399 1 269 . 1 1 83 83 ALA CB C 13 17.39 0.02 . 1 . . . . . 364 ALA CB . 27399 1 270 . 1 1 83 83 ALA N N 15 125.28 0.2 . 1 . . . . . 364 ALA N . 27399 1 271 . 1 1 84 84 HIS H H 1 8.07 0.02 . 1 . . . . . 365 HIS H . 27399 1 272 . 1 1 84 84 HIS C C 13 180.03 0.1 . 1 . . . . . 365 HIS C . 27399 1 273 . 1 1 84 84 HIS CA C 13 60.84 0.04 . 1 . . . . . 365 HIS CA . 27399 1 274 . 1 1 84 84 HIS CB C 13 30.73 0.02 . 1 . . . . . 365 HIS CB . 27399 1 275 . 1 1 84 84 HIS N N 15 119.21 0.2 . 1 . . . . . 365 HIS N . 27399 1 276 . 1 1 85 85 ALA H H 1 9.09 0.02 . 1 . . . . . 366 ALA H . 27399 1 277 . 1 1 85 85 ALA C C 13 182.98 0.1 . 1 . . . . . 366 ALA C . 27399 1 278 . 1 1 85 85 ALA CA C 13 55.99 0.04 . 1 . . . . . 366 ALA CA . 27399 1 279 . 1 1 85 85 ALA CB C 13 19.99 0.02 . 1 . . . . . 366 ALA CB . 27399 1 280 . 1 1 85 85 ALA N N 15 126.47 0.2 . 1 . . . . . 366 ALA N . 27399 1 281 . 1 1 86 86 LYS H H 1 8.53 0.02 . 1 . . . . . 367 LYS H . 27399 1 282 . 1 1 86 86 LYS C C 13 177.51 0.1 . 1 . . . . . 367 LYS C . 27399 1 283 . 1 1 86 86 LYS CA C 13 60.28 0.04 . 1 . . . . . 367 LYS CA . 27399 1 284 . 1 1 86 86 LYS CB C 13 31.65 0.02 . 1 . . . . . 367 LYS CB . 27399 1 285 . 1 1 86 86 LYS N N 15 121.46 0.2 . 1 . . . . . 367 LYS N . 27399 1 286 . 1 1 87 87 LYS H H 1 7.4 0.02 . 1 . . . . . 368 LYS H . 27399 1 287 . 1 1 87 87 LYS C C 13 179.17 0.1 . 1 . . . . . 368 LYS C . 27399 1 288 . 1 1 87 87 LYS CA C 13 58.27 0.04 . 1 . . . . . 368 LYS CA . 27399 1 289 . 1 1 87 87 LYS CB C 13 33.22 0.02 . 1 . . . . . 368 LYS CB . 27399 1 290 . 1 1 87 87 LYS N N 15 118.17 0.2 . 1 . . . . . 368 LYS N . 27399 1 291 . 1 1 88 88 THR H H 1 8.51 0.02 . 1 . . . . . 369 THR H . 27399 1 292 . 1 1 88 88 THR C C 13 175.55 0.1 . 1 . . . . . 369 THR C . 27399 1 293 . 1 1 88 88 THR CA C 13 63.04 0.04 . 1 . . . . . 369 THR CA . 27399 1 294 . 1 1 88 88 THR CB C 13 71.32 0.02 . 1 . . . . . 369 THR CB . 27399 1 295 . 1 1 88 88 THR N N 15 108.72 0.2 . 1 . . . . . 369 THR N . 27399 1 296 . 1 1 89 89 SER H H 1 8.53 0.02 . 1 . . . . . 370 SER H . 27399 1 297 . 1 1 89 89 SER C C 13 173.35 0.1 . 1 . . . . . 370 SER C . 27399 1 298 . 1 1 89 89 SER CA C 13 61.09 0.04 . 1 . . . . . 370 SER CA . 27399 1 299 . 1 1 89 89 SER CB C 13 60.03 0.02 . 1 . . . . . 370 SER CB . 27399 1 300 . 1 1 89 89 SER N N 15 113.84 0.2 . 1 . . . . . 370 SER N . 27399 1 301 . 1 1 90 90 ILE H H 1 7.13 0.02 . 1 . . . . . 371 ILE H . 27399 1 302 . 1 1 90 90 ILE C C 13 174.98 0.1 . 1 . . . . . 371 ILE C . 27399 1 303 . 1 1 90 90 ILE CA C 13 59.28 0.04 . 1 . . . . . 371 ILE CA . 27399 1 304 . 1 1 90 90 ILE CB C 13 40.76 0.02 . 1 . . . . . 371 ILE CB . 27399 1 305 . 1 1 90 90 ILE N N 15 117.5 0.2 . 1 . . . . . 371 ILE N . 27399 1 306 . 1 1 92 92 ALA C C 13 174.36 0.1 . 1 . . . . . 373 ALA C . 27399 1 307 . 1 1 92 92 ALA CA C 13 50.69 0.04 . 1 . . . . . 373 ALA CA . 27399 1 308 . 1 1 92 92 ALA CB C 13 18.91 0.02 . 1 . . . . . 373 ALA CB . 27399 1 309 . 1 1 93 93 VAL H H 1 8.03 0.02 . 1 . . . . . 374 VAL H . 27399 1 310 . 1 1 93 93 VAL C C 13 176.75 0.1 . 1 . . . . . 374 VAL C . 27399 1 311 . 1 1 93 93 VAL CA C 13 60.45 0.04 . 1 . . . . . 374 VAL CA . 27399 1 312 . 1 1 93 93 VAL CB C 13 33.3 0.02 . 1 . . . . . 374 VAL CB . 27399 1 313 . 1 1 93 93 VAL N N 15 120.1 0.2 . 1 . . . . . 374 VAL N . 27399 1 314 . 1 1 96 96 ASP C C 13 177.2 0.1 . 1 . . . . . 377 ASP C . 27399 1 315 . 1 1 96 96 ASP CA C 13 56.66 0.04 . 1 . . . . . 377 ASP CA . 27399 1 316 . 1 1 96 96 ASP CB C 13 39.9 0.02 . 1 . . . . . 377 ASP CB . 27399 1 317 . 1 1 97 97 SER H H 1 7.26 0.02 . 1 . . . . . 378 SER H . 27399 1 318 . 1 1 97 97 SER C C 13 175.78 0.1 . 1 . . . . . 378 SER C . 27399 1 319 . 1 1 97 97 SER CA C 13 57.95 0.04 . 1 . . . . . 378 SER CA . 27399 1 320 . 1 1 97 97 SER CB C 13 64.45 0.02 . 1 . . . . . 378 SER CB . 27399 1 321 . 1 1 97 97 SER N N 15 112.05 0.2 . 1 . . . . . 378 SER N . 27399 1 322 . 1 1 98 98 SER H H 1 7.54 0.02 . 1 . . . . . 379 SER H . 27399 1 323 . 1 1 98 98 SER C C 13 175.8 0.1 . 1 . . . . . 379 SER C . 27399 1 324 . 1 1 98 98 SER CA C 13 62.42 0.04 . 1 . . . . . 379 SER CA . 27399 1 325 . 1 1 98 98 SER CB C 13 62.47 0.02 . 1 . . . . . 379 SER CB . 27399 1 326 . 1 1 98 98 SER N N 15 117.22 0.2 . 1 . . . . . 379 SER N . 27399 1 327 . 1 1 99 99 LYS H H 1 8.34 0.02 . 1 . . . . . 380 LYS H . 27399 1 328 . 1 1 99 99 LYS C C 13 178.85 0.1 . 1 . . . . . 380 LYS C . 27399 1 329 . 1 1 99 99 LYS CA C 13 59.75 0.04 . 1 . . . . . 380 LYS CA . 27399 1 330 . 1 1 99 99 LYS CB C 13 31.18 0.02 . 1 . . . . . 380 LYS CB . 27399 1 331 . 1 1 99 99 LYS N N 15 124.8 0.2 . 1 . . . . . 380 LYS N . 27399 1 332 . 1 1 100 100 ARG H H 1 8.05 0.02 . 1 . . . . . 381 ARG H . 27399 1 333 . 1 1 100 100 ARG C C 13 179.8 0.1 . 1 . . . . . 381 ARG C . 27399 1 334 . 1 1 100 100 ARG CA C 13 59.27 0.04 . 1 . . . . . 381 ARG CA . 27399 1 335 . 1 1 100 100 ARG CB C 13 29.52 0.02 . 1 . . . . . 381 ARG CB . 27399 1 336 . 1 1 100 100 ARG N N 15 119.58 0.2 . 1 . . . . . 381 ARG N . 27399 1 337 . 1 1 101 101 ILE H H 1 7.39 0.02 . 1 . . . . . 382 ILE H . 27399 1 338 . 1 1 101 101 ILE C C 13 177.15 0.1 . 1 . . . . . 382 ILE C . 27399 1 339 . 1 1 101 101 ILE CA C 13 65.54 0.04 . 1 . . . . . 382 ILE CA . 27399 1 340 . 1 1 101 101 ILE CB C 13 37.52 0.02 . 1 . . . . . 382 ILE CB . 27399 1 341 . 1 1 101 101 ILE N N 15 119.29 0.2 . 1 . . . . . 382 ILE N . 27399 1 342 . 1 1 102 102 SER H H 1 8.25 0.02 . 1 . . . . . 383 SER H . 27399 1 343 . 1 1 102 102 SER C C 13 178.08 0.1 . 1 . . . . . 383 SER C . 27399 1 344 . 1 1 102 102 SER CA C 13 61.78 0.04 . 1 . . . . . 383 SER CA . 27399 1 345 . 1 1 102 102 SER CB C 13 63.18 0.02 . 1 . . . . . 383 SER CB . 27399 1 346 . 1 1 102 102 SER N N 15 115.04 0.2 . 1 . . . . . 383 SER N . 27399 1 347 . 1 1 103 103 ASP H H 1 8.34 0.02 . 1 . . . . . 384 ASP H . 27399 1 348 . 1 1 103 103 ASP C C 13 179.35 0.1 . 1 . . . . . 384 ASP C . 27399 1 349 . 1 1 103 103 ASP CA C 13 57.45 0.04 . 1 . . . . . 384 ASP CA . 27399 1 350 . 1 1 103 103 ASP CB C 13 40.62 0.02 . 1 . . . . . 384 ASP CB . 27399 1 351 . 1 1 103 103 ASP N N 15 119.71 0.2 . 1 . . . . . 384 ASP N . 27399 1 352 . 1 1 104 104 ALA H H 1 7.94 0.02 . 1 . . . . . 385 ALA H . 27399 1 353 . 1 1 104 104 ALA C C 13 178.82 0.1 . 1 . . . . . 385 ALA C . 27399 1 354 . 1 1 104 104 ALA CA C 13 55.88 0.04 . 1 . . . . . 385 ALA CA . 27399 1 355 . 1 1 104 104 ALA CB C 13 17.93 0.02 . 1 . . . . . 385 ALA CB . 27399 1 356 . 1 1 104 104 ALA N N 15 121.97 0.2 . 1 . . . . . 385 ALA N . 27399 1 357 . 1 1 105 105 TYR H H 1 8.35 0.02 . 1 . . . . . 386 TYR H . 27399 1 358 . 1 1 105 105 TYR C C 13 176.2 0.1 . 1 . . . . . 386 TYR C . 27399 1 359 . 1 1 105 105 TYR CA C 13 60.36 0.04 . 1 . . . . . 386 TYR CA . 27399 1 360 . 1 1 105 105 TYR CB C 13 38.32 0.02 . 1 . . . . . 386 TYR CB . 27399 1 361 . 1 1 105 105 TYR N N 15 118.02 0.2 . 1 . . . . . 386 TYR N . 27399 1 362 . 1 1 106 106 LYS H H 1 7.2 0.02 . 1 . . . . . 387 LYS H . 27399 1 363 . 1 1 106 106 LYS C C 13 178.03 0.1 . 1 . . . . . 387 LYS C . 27399 1 364 . 1 1 106 106 LYS CA C 13 58.22 0.04 . 1 . . . . . 387 LYS CA . 27399 1 365 . 1 1 106 106 LYS CB C 13 32.46 0.02 . 1 . . . . . 387 LYS CB . 27399 1 366 . 1 1 106 106 LYS N N 15 114.74 0.2 . 1 . . . . . 387 LYS N . 27399 1 367 . 1 1 107 107 LYS H H 1 7.28 0.02 . 1 . . . . . 388 LYS H . 27399 1 368 . 1 1 107 107 LYS C C 13 175.33 0.1 . 1 . . . . . 388 LYS C . 27399 1 369 . 1 1 107 107 LYS CA C 13 56.24 0.04 . 1 . . . . . 388 LYS CA . 27399 1 370 . 1 1 107 107 LYS CB C 13 35.38 0.02 . 1 . . . . . 388 LYS CB . 27399 1 371 . 1 1 107 107 LYS N N 15 115.2 0.2 . 1 . . . . . 388 LYS N . 27399 1 372 . 1 1 108 108 ALA H H 1 8.11 0.02 . 1 . . . . . 389 ALA H . 27399 1 373 . 1 1 108 108 ALA C C 13 177.52 0.1 . 1 . . . . . 389 ALA C . 27399 1 374 . 1 1 108 108 ALA CA C 13 51.09 0.04 . 1 . . . . . 389 ALA CA . 27399 1 375 . 1 1 108 108 ALA CB C 13 21.53 0.02 . 1 . . . . . 389 ALA CB . 27399 1 376 . 1 1 108 108 ALA N N 15 123.39 0.2 . 1 . . . . . 389 ALA N . 27399 1 377 . 1 1 109 109 SER H H 1 7.59 0.02 . 1 . . . . . 390 SER H . 27399 1 378 . 1 1 109 109 SER C C 13 172.47 0.1 . 1 . . . . . 390 SER C . 27399 1 379 . 1 1 109 109 SER CA C 13 59.66 0.04 . 1 . . . . . 390 SER CA . 27399 1 380 . 1 1 109 109 SER CB C 13 63.8 0.02 . 1 . . . . . 390 SER CB . 27399 1 381 . 1 1 109 109 SER N N 15 115.89 0.2 . 1 . . . . . 390 SER N . 27399 1 382 . 1 1 110 110 VAL H H 1 8.98 0.02 . 1 . . . . . 391 VAL H . 27399 1 383 . 1 1 110 110 VAL C C 13 173.5 0.1 . 1 . . . . . 391 VAL C . 27399 1 384 . 1 1 110 110 VAL CA C 13 61.07 0.04 . 1 . . . . . 391 VAL CA . 27399 1 385 . 1 1 110 110 VAL CB C 13 34.02 0.02 . 1 . . . . . 391 VAL CB . 27399 1 386 . 1 1 110 110 VAL N N 15 126.74 0.2 . 1 . . . . . 391 VAL N . 27399 1 387 . 1 1 111 111 TYR H H 1 8.97 0.02 . 1 . . . . . 392 TYR H . 27399 1 388 . 1 1 111 111 TYR CA C 13 56.02 0.04 . 1 . . . . . 392 TYR CA . 27399 1 389 . 1 1 111 111 TYR CB C 13 40.77 0.02 . 1 . . . . . 392 TYR CB . 27399 1 390 . 1 1 111 111 TYR N N 15 125.01 0.2 . 1 . . . . . 392 TYR N . 27399 1 391 . 1 1 115 115 VAL CA C 13 59.17 0.04 . 1 . . . . . 396 VAL CA . 27399 1 392 . 1 1 116 116 ALA H H 1 9.47 0.02 . 1 . . . . . 397 ALA H . 27399 1 393 . 1 1 116 116 ALA C C 13 178.51 0.1 . 1 . . . . . 397 ALA C . 27399 1 394 . 1 1 116 116 ALA CA C 13 52.04 0.04 . 1 . . . . . 397 ALA CA . 27399 1 395 . 1 1 116 116 ALA CB C 13 18.89 0.02 . 1 . . . . . 397 ALA CB . 27399 1 396 . 1 1 116 116 ALA N N 15 130.3 0.2 . 1 . . . . . 397 ALA N . 27399 1 397 . 1 1 117 117 GLN H H 1 8.12 0.02 . 1 . . . . . 398 GLN H . 27399 1 398 . 1 1 117 117 GLN C C 13 177.13 0.1 . 1 . . . . . 398 GLN C . 27399 1 399 . 1 1 117 117 GLN CA C 13 58.63 0.04 . 1 . . . . . 398 GLN CA . 27399 1 400 . 1 1 117 117 GLN CB C 13 28.68 0.02 . 1 . . . . . 398 GLN CB . 27399 1 401 . 1 1 117 117 GLN N N 15 124.15 0.2 . 1 . . . . . 398 GLN N . 27399 1 402 . 1 1 118 118 GLN H H 1 8.85 0.02 . 1 . . . . . 399 GLN H . 27399 1 403 . 1 1 118 118 GLN C C 13 177.52 0.1 . 1 . . . . . 399 GLN C . 27399 1 404 . 1 1 118 118 GLN CA C 13 59.73 0.04 . 1 . . . . . 399 GLN CA . 27399 1 405 . 1 1 118 118 GLN CB C 13 28.21 0.02 . 1 . . . . . 399 GLN CB . 27399 1 406 . 1 1 118 118 GLN N N 15 115.18 0.2 . 1 . . . . . 399 GLN N . 27399 1 407 . 1 1 119 119 THR C C 13 175.74 0.1 . 1 . . . . . 400 THR C . 27399 1 408 . 1 1 119 119 THR CA C 13 61.37 0.04 . 1 . . . . . 400 THR CA . 27399 1 409 . 1 1 119 119 THR CB C 13 70.39 0.02 . 1 . . . . . 400 THR CB . 27399 1 410 . 1 1 120 120 TYR H H 1 7.67 0.02 . 1 . . . . . 401 TYR H . 27399 1 411 . 1 1 120 120 TYR C C 13 175.49 0.1 . 1 . . . . . 401 TYR C . 27399 1 412 . 1 1 120 120 TYR CA C 13 56.62 0.04 . 1 . . . . . 401 TYR CA . 27399 1 413 . 1 1 120 120 TYR CB C 13 33.38 0.02 . 1 . . . . . 401 TYR CB . 27399 1 414 . 1 1 120 120 TYR N N 15 113.36 0.2 . 1 . . . . . 401 TYR N . 27399 1 415 . 1 1 121 121 ASN H H 1 7.89 0.02 . 1 . . . . . 402 ASN H . 27399 1 416 . 1 1 121 121 ASN C C 13 176.75 0.1 . 1 . . . . . 402 ASN C . 27399 1 417 . 1 1 121 121 ASN CA C 13 54.19 0.04 . 1 . . . . . 402 ASN CA . 27399 1 418 . 1 1 121 121 ASN CB C 13 36.94 0.02 . 1 . . . . . 402 ASN CB . 27399 1 419 . 1 1 121 121 ASN N N 15 117.33 0.2 . 1 . . . . . 402 ASN N . 27399 1 420 . 1 1 122 122 ALA C C 13 177.85 0.1 . 1 . . . . . 403 ALA C . 27399 1 421 . 1 1 122 122 ALA CA C 13 52.24 0.04 . 1 . . . . . 403 ALA CA . 27399 1 422 . 1 1 122 122 ALA CB C 13 18.93 0.02 . 1 . . . . . 403 ALA CB . 27399 1 423 . 1 1 123 123 LEU H H 1 8.17 0.02 . 1 . . . . . 404 LEU H . 27399 1 424 . 1 1 123 123 LEU C C 13 175.35 0.1 . 1 . . . . . 404 LEU C . 27399 1 425 . 1 1 123 123 LEU CA C 13 51.11 0.04 . 1 . . . . . 404 LEU CA . 27399 1 426 . 1 1 123 123 LEU N N 15 121.33 0.2 . 1 . . . . . 404 LEU N . 27399 1 427 . 1 1 124 124 GLY H H 1 7.18 0.02 . 1 . . . . . 405 GLY H . 27399 1 428 . 1 1 124 124 GLY CA C 13 44.63 0.04 . 1 . . . . . 405 GLY CA . 27399 1 429 . 1 1 124 124 GLY N N 15 106.5 0.2 . 1 . . . . . 405 GLY N . 27399 1 430 . 1 1 125 125 TYR H H 1 9.14 0.02 . 1 . . . . . 406 TYR H . 27399 1 431 . 1 1 125 125 TYR CA C 13 57.67 0.04 . 1 . . . . . 406 TYR CA . 27399 1 432 . 1 1 125 125 TYR CB C 13 41.34 0.02 . 1 . . . . . 406 TYR CB . 27399 1 433 . 1 1 125 125 TYR N N 15 113.86 0.2 . 1 . . . . . 406 TYR N . 27399 1 434 . 1 1 126 126 ALA H H 1 9.22 0.02 . 1 . . . . . 407 ALA H . 27399 1 435 . 1 1 126 126 ALA CA C 13 50.72 0.04 . 1 . . . . . 407 ALA CA . 27399 1 436 . 1 1 126 126 ALA CB C 13 24.62 0.02 . 1 . . . . . 407 ALA CB . 27399 1 437 . 1 1 126 126 ALA N N 15 122.86 0.2 . 1 . . . . . 407 ALA N . 27399 1 438 . 1 1 127 127 GLN H H 1 8.83 0.02 . 1 . . . . . 408 GLN H . 27399 1 439 . 1 1 127 127 GLN CA C 13 53.96 0.04 . 1 . . . . . 408 GLN CA . 27399 1 440 . 1 1 127 127 GLN CB C 13 29.77 0.02 . 1 . . . . . 408 GLN CB . 27399 1 441 . 1 1 127 127 GLN N N 15 122.56 0.2 . 1 . . . . . 408 GLN N . 27399 1 442 . 1 1 128 128 VAL H H 1 8.53 0.02 . 1 . . . . . 409 VAL H . 27399 1 443 . 1 1 128 128 VAL C C 13 176.91 0.1 . 1 . . . . . 409 VAL C . 27399 1 444 . 1 1 128 128 VAL CA C 13 64.08 0.04 . 1 . . . . . 409 VAL CA . 27399 1 445 . 1 1 128 128 VAL CB C 13 31.07 0.02 . 1 . . . . . 409 VAL CB . 27399 1 446 . 1 1 128 128 VAL N N 15 128.79 0.2 . 1 . . . . . 409 VAL N . 27399 1 447 . 1 1 129 129 VAL H H 1 8.47 0.02 . 1 . . . . . 410 VAL H . 27399 1 448 . 1 1 129 129 VAL C C 13 175.43 0.1 . 1 . . . . . 410 VAL C . 27399 1 449 . 1 1 129 129 VAL CA C 13 60.63 0.04 . 1 . . . . . 410 VAL CA . 27399 1 450 . 1 1 129 129 VAL CB C 13 31.68 0.02 . 1 . . . . . 410 VAL CB . 27399 1 451 . 1 1 129 129 VAL N N 15 118.85 0.2 . 1 . . . . . 410 VAL N . 27399 1 452 . 1 1 130 130 SER H H 1 7.34 0.02 . 1 . . . . . 411 SER H . 27399 1 453 . 1 1 130 130 SER C C 13 183.82 0.1 . 1 . . . . . 411 SER C . 27399 1 454 . 1 1 130 130 SER CA C 13 58.24 0.04 . 1 . . . . . 411 SER CA . 27399 1 455 . 1 1 130 130 SER CB C 13 66.38 0.02 . 1 . . . . . 411 SER CB . 27399 1 456 . 1 1 130 130 SER N N 15 116.98 0.2 . 1 . . . . . 411 SER N . 27399 1 457 . 1 1 131 131 ASP H H 1 7.69 0.02 . 1 . . . . . 412 ASP H . 27399 1 458 . 1 1 131 131 ASP C C 13 177.15 0.1 . 1 . . . . . 412 ASP C . 27399 1 459 . 1 1 131 131 ASP CA C 13 51.8 0.04 . 1 . . . . . 412 ASP CA . 27399 1 460 . 1 1 131 131 ASP CB C 13 41.36 0.02 . 1 . . . . . 412 ASP CB . 27399 1 461 . 1 1 131 131 ASP N N 15 114.85 0.2 . 1 . . . . . 412 ASP N . 27399 1 462 . 1 1 132 132 LEU H H 1 8.85 0.02 . 1 . . . . . 413 LEU H . 27399 1 463 . 1 1 132 132 LEU C C 13 177.67 0.1 . 1 . . . . . 413 LEU C . 27399 1 464 . 1 1 132 132 LEU CA C 13 55.98 0.04 . 1 . . . . . 413 LEU CA . 27399 1 465 . 1 1 132 132 LEU CB C 13 42.11 0.02 . 1 . . . . . 413 LEU CB . 27399 1 466 . 1 1 132 132 LEU N N 15 123.27 0.2 . 1 . . . . . 413 LEU N . 27399 1 467 . 1 1 133 133 ASN H H 1 8.9 0.02 . 1 . . . . . 414 ASN H . 27399 1 468 . 1 1 133 133 ASN C C 13 177.1 0.1 . 1 . . . . . 414 ASN C . 27399 1 469 . 1 1 133 133 ASN CA C 13 52.56 0.04 . 1 . . . . . 414 ASN CA . 27399 1 470 . 1 1 133 133 ASN CB C 13 39.69 0.02 . 1 . . . . . 414 ASN CB . 27399 1 471 . 1 1 133 133 ASN N N 15 122.07 0.2 . 1 . . . . . 414 ASN N . 27399 1 472 . 1 1 134 134 SER C C 13 174.88 0.1 . 1 . . . . . 415 SER C . 27399 1 473 . 1 1 134 134 SER CA C 13 60.53 0.04 . 1 . . . . . 415 SER CA . 27399 1 474 . 1 1 134 134 SER CB C 13 63.23 0.02 . 1 . . . . . 415 SER CB . 27399 1 475 . 1 1 135 135 THR H H 1 7.98 0.02 . 1 . . . . . 416 THR H . 27399 1 476 . 1 1 135 135 THR C C 13 174.7 0.1 . 1 . . . . . 416 THR C . 27399 1 477 . 1 1 135 135 THR CA C 13 62.39 0.04 . 1 . . . . . 416 THR CA . 27399 1 478 . 1 1 135 135 THR CB C 13 69.23 0.02 . 1 . . . . . 416 THR CB . 27399 1 479 . 1 1 135 135 THR N N 15 112.48 0.2 . 1 . . . . . 416 THR N . 27399 1 480 . 1 1 136 136 GLU H H 1 7.21 0.02 . 1 . . . . . 417 GLU H . 27399 1 481 . 1 1 136 136 GLU C C 13 174.72 0.1 . 1 . . . . . 417 GLU C . 27399 1 482 . 1 1 136 136 GLU CA C 13 55.24 0.04 . 1 . . . . . 417 GLU CA . 27399 1 483 . 1 1 136 136 GLU CB C 13 29.28 0.02 . 1 . . . . . 417 GLU CB . 27399 1 484 . 1 1 136 136 GLU N N 15 123.44 0.2 . 1 . . . . . 417 GLU N . 27399 1 485 . 1 1 137 137 LEU H H 1 7.46 0.02 . 1 . . . . . 418 LEU H . 27399 1 486 . 1 1 137 137 LEU C C 13 175.69 0.1 . 1 . . . . . 418 LEU C . 27399 1 487 . 1 1 137 137 LEU CA C 13 52 0.04 . 1 . . . . . 418 LEU CA . 27399 1 488 . 1 1 137 137 LEU CB C 13 41.39 0.02 . 1 . . . . . 418 LEU CB . 27399 1 489 . 1 1 137 137 LEU N N 15 122.92 0.2 . 1 . . . . . 418 LEU N . 27399 1 490 . 1 1 142 142 ASP C C 13 177.89 0.1 . 1 . . . . . 423 ASP C . 27399 1 491 . 1 1 142 142 ASP CA C 13 53.44 0.04 . 1 . . . . . 423 ASP CA . 27399 1 492 . 1 1 142 142 ASP CB C 13 42.76 0.02 . 1 . . . . . 423 ASP CB . 27399 1 493 . 1 1 143 143 SER H H 1 8.16 0.02 . 1 . . . . . 424 SER H . 27399 1 494 . 1 1 143 143 SER C C 13 175.15 0.1 . 1 . . . . . 424 SER C . 27399 1 495 . 1 1 143 143 SER CA C 13 60.81 0.04 . 1 . . . . . 424 SER CA . 27399 1 496 . 1 1 143 143 SER CB C 13 62.96 0.02 . 1 . . . . . 424 SER CB . 27399 1 497 . 1 1 143 143 SER N N 15 113.93 0.2 . 1 . . . . . 424 SER N . 27399 1 498 . 1 1 144 144 SER H H 1 9.28 0.02 . 1 . . . . . 425 SER H . 27399 1 499 . 1 1 144 144 SER C C 13 175.54 0.1 . 1 . . . . . 425 SER C . 27399 1 500 . 1 1 144 144 SER CA C 13 59.97 0.04 . 1 . . . . . 425 SER CA . 27399 1 501 . 1 1 144 144 SER CB C 13 63.65 0.02 . 1 . . . . . 425 SER CB . 27399 1 502 . 1 1 144 144 SER N N 15 118.69 0.2 . 1 . . . . . 425 SER N . 27399 1 503 . 1 1 145 145 HIS H H 1 7.96 0.02 . 1 . . . . . 426 HIS H . 27399 1 504 . 1 1 145 145 HIS C C 13 174.81 0.1 . 1 . . . . . 426 HIS C . 27399 1 505 . 1 1 145 145 HIS CA C 13 59.89 0.04 . 1 . . . . . 426 HIS CA . 27399 1 506 . 1 1 145 145 HIS CB C 13 32.32 0.02 . 1 . . . . . 426 HIS CB . 27399 1 507 . 1 1 145 145 HIS N N 15 122.88 0.2 . 1 . . . . . 426 HIS N . 27399 1 508 . 1 1 146 146 ALA H H 1 9.15 0.02 . 1 . . . . . 427 ALA H . 27399 1 509 . 1 1 146 146 ALA C C 13 177.91 0.1 . 1 . . . . . 427 ALA C . 27399 1 510 . 1 1 146 146 ALA CA C 13 52.03 0.04 . 1 . . . . . 427 ALA CA . 27399 1 511 . 1 1 146 146 ALA CB C 13 21.11 0.02 . 1 . . . . . 427 ALA CB . 27399 1 512 . 1 1 146 146 ALA N N 15 123.45 0.2 . 1 . . . . . 427 ALA N . 27399 1 513 . 1 1 147 147 GLY H H 1 7.04 0.02 . 1 . . . . . 428 GLY H . 27399 1 514 . 1 1 147 147 GLY C C 13 171 0.1 . 1 . . . . . 428 GLY C . 27399 1 515 . 1 1 147 147 GLY CA C 13 45.08 0.04 . 1 . . . . . 428 GLY CA . 27399 1 516 . 1 1 147 147 GLY N N 15 100.5 0.2 . 1 . . . . . 428 GLY N . 27399 1 517 . 1 1 148 148 GLY H H 1 8.26 0.02 . 1 . . . . . 429 GLY H . 27399 1 518 . 1 1 148 148 GLY C C 13 173.2 0.1 . 1 . . . . . 429 GLY C . 27399 1 519 . 1 1 148 148 GLY CA C 13 43.34 0.04 . 1 . . . . . 429 GLY CA . 27399 1 520 . 1 1 148 148 GLY N N 15 108.48 0.2 . 1 . . . . . 429 GLY N . 27399 1 521 . 1 1 149 149 VAL H H 1 8.43 0.02 . 1 . . . . . 430 VAL H . 27399 1 522 . 1 1 149 149 VAL C C 13 174.52 0.1 . 1 . . . . . 430 VAL C . 27399 1 523 . 1 1 149 149 VAL CA C 13 59.24 0.04 . 1 . . . . . 430 VAL CA . 27399 1 524 . 1 1 149 149 VAL CB C 13 34.18 0.02 . 1 . . . . . 430 VAL CB . 27399 1 525 . 1 1 149 149 VAL N N 15 113.13 0.2 . 1 . . . . . 430 VAL N . 27399 1 526 . 1 1 150 150 ARG H H 1 8.02 0.02 . 1 . . . . . 431 ARG H . 27399 1 527 . 1 1 150 150 ARG C C 13 176.22 0.1 . 1 . . . . . 431 ARG C . 27399 1 528 . 1 1 150 150 ARG CA C 13 55.26 0.04 . 1 . . . . . 431 ARG CA . 27399 1 529 . 1 1 150 150 ARG CB C 13 30.05 0.02 . 1 . . . . . 431 ARG CB . 27399 1 530 . 1 1 150 150 ARG N N 15 122.92 0.2 . 1 . . . . . 431 ARG N . 27399 1 531 . 1 1 151 151 ILE H H 1 7.92 0.02 . 1 . . . . . 432 ILE H . 27399 1 532 . 1 1 151 151 ILE CA C 13 58.11 0.04 . 1 . . . . . 432 ILE CA . 27399 1 533 . 1 1 151 151 ILE CB C 13 40.61 0.02 . 1 . . . . . 432 ILE CB . 27399 1 534 . 1 1 151 151 ILE N N 15 115.25 0.2 . 1 . . . . . 432 ILE N . 27399 1 535 . 1 1 155 155 LYS C C 13 176.4 0.1 . 1 . . . . . 436 LYS C . 27399 1 536 . 1 1 155 155 LYS CA C 13 52.81 0.04 . 1 . . . . . 436 LYS CA . 27399 1 537 . 1 1 155 155 LYS CB C 13 36.16 0.02 . 1 . . . . . 436 LYS CB . 27399 1 538 . 1 1 156 156 THR H H 1 8.32 0.02 . 1 . . . . . 437 THR H . 27399 1 539 . 1 1 156 156 THR C C 13 173.37 0.1 . 1 . . . . . 437 THR C . 27399 1 540 . 1 1 156 156 THR CA C 13 60.1 0.04 . 1 . . . . . 437 THR CA . 27399 1 541 . 1 1 156 156 THR CB C 13 69.43 0.02 . 1 . . . . . 437 THR CB . 27399 1 542 . 1 1 156 156 THR N N 15 109.38 0.2 . 1 . . . . . 437 THR N . 27399 1 543 . 1 1 157 157 CYS H H 1 7.55 0.02 . 1 . . . . . 438 CYS H . 27399 1 544 . 1 1 157 157 CYS C C 13 172.53 0.1 . 1 . . . . . 438 CYS C . 27399 1 545 . 1 1 157 157 CYS CA C 13 57.16 0.04 . 1 . . . . . 438 CYS CA . 27399 1 546 . 1 1 157 157 CYS CB C 13 30.57 0.02 . 1 . . . . . 438 CYS CB . 27399 1 547 . 1 1 157 157 CYS N N 15 115.62 0.2 . 1 . . . . . 438 CYS N . 27399 1 548 . 1 1 158 158 ASN H H 1 8.55 0.02 . 1 . . . . . 439 ASN H . 27399 1 549 . 1 1 158 158 ASN C C 13 174.34 0.1 . 1 . . . . . 439 ASN C . 27399 1 550 . 1 1 158 158 ASN CA C 13 54.12 0.04 . 1 . . . . . 439 ASN CA . 27399 1 551 . 1 1 158 158 ASN CB C 13 36.67 0.02 . 1 . . . . . 439 ASN CB . 27399 1 552 . 1 1 158 158 ASN N N 15 114.67 0.2 . 1 . . . . . 439 ASN N . 27399 1 553 . 1 1 159 159 LEU H H 1 8.45 0.02 . 1 . . . . . 440 LEU H . 27399 1 554 . 1 1 159 159 LEU C C 13 174.16 0.1 . 1 . . . . . 440 LEU C . 27399 1 555 . 1 1 159 159 LEU CA C 13 54.19 0.04 . 1 . . . . . 440 LEU CA . 27399 1 556 . 1 1 159 159 LEU CB C 13 45.72 0.02 . 1 . . . . . 440 LEU CB . 27399 1 557 . 1 1 159 159 LEU N N 15 123.39 0.2 . 1 . . . . . 440 LEU N . 27399 1 558 . 1 1 160 160 PHE H H 1 8.85 0.02 . 1 . . . . . 441 PHE H . 27399 1 559 . 1 1 160 160 PHE C C 13 175.06 0.1 . 1 . . . . . 441 PHE C . 27399 1 560 . 1 1 160 160 PHE CA C 13 57.67 0.04 . 1 . . . . . 441 PHE CA . 27399 1 561 . 1 1 160 160 PHE CB C 13 39.62 0.02 . 1 . . . . . 441 PHE CB . 27399 1 562 . 1 1 160 160 PHE N N 15 126.51 0.2 . 1 . . . . . 441 PHE N . 27399 1 563 . 1 1 161 161 SER H H 1 8.11 0.02 . 1 . . . . . 442 SER H . 27399 1 564 . 1 1 161 161 SER C C 13 174.64 0.1 . 1 . . . . . 442 SER C . 27399 1 565 . 1 1 161 161 SER CA C 13 55.53 0.04 . 1 . . . . . 442 SER CA . 27399 1 566 . 1 1 161 161 SER CB C 13 64.3 0.02 . 1 . . . . . 442 SER CB . 27399 1 567 . 1 1 161 161 SER N N 15 123.55 0.2 . 1 . . . . . 442 SER N . 27399 1 568 . 1 1 162 162 ALA C C 13 180.07 0.1 . 1 . . . . . 443 ALA C . 27399 1 569 . 1 1 162 162 ALA CA C 13 55.12 0.04 . 1 . . . . . 443 ALA CA . 27399 1 570 . 1 1 162 162 ALA CB C 13 17.25 0.02 . 1 . . . . . 443 ALA CB . 27399 1 571 . 1 1 163 163 GLU H H 1 8.22 0.02 . 1 . . . . . 444 GLU H . 27399 1 572 . 1 1 163 163 GLU C C 13 179.05 0.1 . 1 . . . . . 444 GLU C . 27399 1 573 . 1 1 163 163 GLU CA C 13 59.58 0.04 . 1 . . . . . 444 GLU CA . 27399 1 574 . 1 1 163 163 GLU CB C 13 29.08 0.02 . 1 . . . . . 444 GLU CB . 27399 1 575 . 1 1 163 163 GLU N N 15 119.37 0.2 . 1 . . . . . 444 GLU N . 27399 1 576 . 1 1 164 164 ILE H H 1 7.1 0.02 . 1 . . . . . 445 ILE H . 27399 1 577 . 1 1 164 164 ILE C C 13 177.81 0.1 . 1 . . . . . 445 ILE C . 27399 1 578 . 1 1 164 164 ILE CA C 13 66.33 0.04 . 1 . . . . . 445 ILE CA . 27399 1 579 . 1 1 164 164 ILE CB C 13 36.16 0.02 . 1 . . . . . 445 ILE CB . 27399 1 580 . 1 1 164 164 ILE N N 15 119.5 0.2 . 1 . . . . . 445 ILE N . 27399 1 581 . 1 1 165 165 SER H H 1 7.77 0.02 . 1 . . . . . 446 SER H . 27399 1 582 . 1 1 165 165 SER C C 13 176.75 0.1 . 1 . . . . . 446 SER C . 27399 1 583 . 1 1 165 165 SER CA C 13 61.87 0.04 . 1 . . . . . 446 SER CA . 27399 1 584 . 1 1 165 165 SER CB C 13 62.87 0.02 . 1 . . . . . 446 SER CB . 27399 1 585 . 1 1 165 165 SER N N 15 112.91 0.2 . 1 . . . . . 446 SER N . 27399 1 586 . 1 1 168 168 VAL C C 13 178.1 0.1 . 1 . . . . . 449 VAL C . 27399 1 587 . 1 1 168 168 VAL CA C 13 67.06 0.04 . 1 . . . . . 449 VAL CA . 27399 1 588 . 1 1 168 168 VAL CB C 13 31.23 0.02 . 1 . . . . . 449 VAL CB . 27399 1 589 . 1 1 169 169 SER H H 1 8.26 0.02 . 1 . . . . . 450 SER H . 27399 1 590 . 1 1 169 169 SER C C 13 172.84 0.1 . 1 . . . . . 450 SER C . 27399 1 591 . 1 1 169 169 SER CA C 13 61.42 0.04 . 1 . . . . . 450 SER CA . 27399 1 592 . 1 1 169 169 SER CB C 13 63.23 0.02 . 1 . . . . . 450 SER CB . 27399 1 593 . 1 1 169 169 SER N N 15 113.92 0.2 . 1 . . . . . 450 SER N . 27399 1 594 . 1 1 170 170 HIS H H 1 6.73 0.02 . 1 . . . . . 451 HIS H . 27399 1 595 . 1 1 170 170 HIS C C 13 175.74 0.1 . 1 . . . . . 451 HIS C . 27399 1 596 . 1 1 170 170 HIS CA C 13 54.81 0.04 . 1 . . . . . 451 HIS CA . 27399 1 597 . 1 1 170 170 HIS CB C 13 29.51 0.02 . 1 . . . . . 451 HIS CB . 27399 1 598 . 1 1 170 170 HIS N N 15 114.99 0.2 . 1 . . . . . 451 HIS N . 27399 1 599 . 1 1 171 171 MET H H 1 6.82 0.02 . 1 . . . . . 452 MET H . 27399 1 600 . 1 1 171 171 MET C C 13 176.1 0.1 . 1 . . . . . 452 MET C . 27399 1 601 . 1 1 171 171 MET CA C 13 58.75 0.04 . 1 . . . . . 452 MET CA . 27399 1 602 . 1 1 171 171 MET CB C 13 35.52 0.02 . 1 . . . . . 452 MET CB . 27399 1 603 . 1 1 171 171 MET N N 15 122.45 0.2 . 1 . . . . . 452 MET N . 27399 1 604 . 1 1 172 172 ASP H H 1 8.63 0.02 . 1 . . . . . 453 ASP H . 27399 1 605 . 1 1 172 172 ASP C C 13 176.91 0.1 . 1 . . . . . 453 ASP C . 27399 1 606 . 1 1 172 172 ASP CA C 13 51.34 0.04 . 1 . . . . . 453 ASP CA . 27399 1 607 . 1 1 172 172 ASP CB C 13 39.7 0.02 . 1 . . . . . 453 ASP CB . 27399 1 608 . 1 1 172 172 ASP N N 15 116.39 0.2 . 1 . . . . . 453 ASP N . 27399 1 609 . 1 1 173 173 HIS H H 1 8.29 0.02 . 1 . . . . . 454 HIS H . 27399 1 610 . 1 1 173 173 HIS CA C 13 56.85 0.04 . 1 . . . . . 454 HIS CA . 27399 1 611 . 1 1 173 173 HIS CB C 13 26.56 0.02 . 1 . . . . . 454 HIS CB . 27399 1 612 . 1 1 173 173 HIS N N 15 119.78 0.2 . 1 . . . . . 454 HIS N . 27399 1 613 . 1 1 174 174 GLY H H 1 7.43 0.02 . 1 . . . . . 455 GLY H . 27399 1 614 . 1 1 174 174 GLY C C 13 174.54 0.1 . 1 . . . . . 455 GLY C . 27399 1 615 . 1 1 174 174 GLY CA C 13 45.68 0.04 . 1 . . . . . 455 GLY CA . 27399 1 616 . 1 1 174 174 GLY N N 15 104.78 0.2 . 1 . . . . . 455 GLY N . 27399 1 617 . 1 1 175 175 SER H H 1 7.45 0.02 . 1 . . . . . 456 SER H . 27399 1 618 . 1 1 175 175 SER C C 13 172.9 0.1 . 1 . . . . . 456 SER C . 27399 1 619 . 1 1 175 175 SER CA C 13 57.41 0.04 . 1 . . . . . 456 SER CA . 27399 1 620 . 1 1 175 175 SER CB C 13 64.25 0.02 . 1 . . . . . 456 SER CB . 27399 1 621 . 1 1 175 175 SER N N 15 118.31 0.2 . 1 . . . . . 456 SER N . 27399 1 622 . 1 1 176 176 GLU H H 1 8.43 0.02 . 1 . . . . . 457 GLU H . 27399 1 623 . 1 1 176 176 GLU C C 13 176.02 0.1 . 1 . . . . . 457 GLU C . 27399 1 624 . 1 1 176 176 GLU CA C 13 57.71 0.04 . 1 . . . . . 457 GLU CA . 27399 1 625 . 1 1 176 176 GLU CB C 13 29.35 0.02 . 1 . . . . . 457 GLU CB . 27399 1 626 . 1 1 176 176 GLU N N 15 120.75 0.2 . 1 . . . . . 457 GLU N . 27399 1 627 . 1 1 177 177 ALA H H 1 7.26 0.02 . 1 . . . . . 458 ALA H . 27399 1 628 . 1 1 177 177 ALA C C 13 176.12 0.1 . 1 . . . . . 458 ALA C . 27399 1 629 . 1 1 177 177 ALA CA C 13 53.13 0.04 . 1 . . . . . 458 ALA CA . 27399 1 630 . 1 1 177 177 ALA CB C 13 21.27 0.02 . 1 . . . . . 458 ALA CB . 27399 1 631 . 1 1 177 177 ALA N N 15 118.5 0.2 . 1 . . . . . 458 ALA N . 27399 1 632 . 1 1 178 178 ARG H H 1 6.52 0.02 . 1 . . . . . 459 ARG H . 27399 1 633 . 1 1 178 178 ARG C C 13 176.05 0.1 . 1 . . . . . 459 ARG C . 27399 1 634 . 1 1 178 178 ARG CA C 13 53.75 0.04 . 1 . . . . . 459 ARG CA . 27399 1 635 . 1 1 178 178 ARG CB C 13 31.7 0.02 . 1 . . . . . 459 ARG CB . 27399 1 636 . 1 1 178 178 ARG N N 15 118.58 0.2 . 1 . . . . . 459 ARG N . 27399 1 637 . 1 1 179 179 ASP H H 1 8.64 0.02 . 1 . . . . . 460 ASP H . 27399 1 638 . 1 1 179 179 ASP C C 13 177.71 0.1 . 1 . . . . . 460 ASP C . 27399 1 639 . 1 1 179 179 ASP CA C 13 57.01 0.04 . 1 . . . . . 460 ASP CA . 27399 1 640 . 1 1 179 179 ASP CB C 13 41.62 0.02 . 1 . . . . . 460 ASP CB . 27399 1 641 . 1 1 179 179 ASP N N 15 121.45 0.2 . 1 . . . . . 460 ASP N . 27399 1 642 . 1 1 180 180 GLY H H 1 8.74 0.02 . 1 . . . . . 461 GLY H . 27399 1 643 . 1 1 180 180 GLY C C 13 173.53 0.1 . 1 . . . . . 461 GLY C . 27399 1 644 . 1 1 180 180 GLY CA C 13 45.92 0.04 . 1 . . . . . 461 GLY CA . 27399 1 645 . 1 1 180 180 GLY N N 15 118.84 0.2 . 1 . . . . . 461 GLY N . 27399 1 646 . 1 1 181 181 MET H H 1 7.65 0.02 . 1 . . . . . 462 MET H . 27399 1 647 . 1 1 181 181 MET C C 13 173.74 0.1 . 1 . . . . . 462 MET C . 27399 1 648 . 1 1 181 181 MET CA C 13 56.01 0.04 . 1 . . . . . 462 MET CA . 27399 1 649 . 1 1 181 181 MET CB C 13 32.77 0.02 . 1 . . . . . 462 MET CB . 27399 1 650 . 1 1 181 181 MET N N 15 117.81 0.2 . 1 . . . . . 462 MET N . 27399 1 651 . 1 1 182 182 GLU H H 1 8.24 0.02 . 1 . . . . . 463 GLU H . 27399 1 652 . 1 1 182 182 GLU C C 13 176.5 0.1 . 1 . . . . . 463 GLU C . 27399 1 653 . 1 1 182 182 GLU CA C 13 55.35 0.04 . 1 . . . . . 463 GLU CA . 27399 1 654 . 1 1 182 182 GLU CB C 13 28.91 0.02 . 1 . . . . . 463 GLU CB . 27399 1 655 . 1 1 182 182 GLU N N 15 122 0.2 . 1 . . . . . 463 GLU N . 27399 1 656 . 1 1 183 183 MET H H 1 8.15 0.02 . 1 . . . . . 464 MET H . 27399 1 657 . 1 1 183 183 MET C C 13 174.1 0.1 . 1 . . . . . 464 MET C . 27399 1 658 . 1 1 183 183 MET CA C 13 53.25 0.04 . 1 . . . . . 464 MET CA . 27399 1 659 . 1 1 183 183 MET CB C 13 33.63 0.02 . 1 . . . . . 464 MET CB . 27399 1 660 . 1 1 183 183 MET N N 15 125.68 0.2 . 1 . . . . . 464 MET N . 27399 1 661 . 1 1 184 184 MET H H 1 8.97 0.02 . 1 . . . . . 465 MET H . 27399 1 662 . 1 1 184 184 MET C C 13 177.69 0.1 . 1 . . . . . 465 MET C . 27399 1 663 . 1 1 184 184 MET CA C 13 57 0.04 . 1 . . . . . 465 MET CA . 27399 1 664 . 1 1 184 184 MET CB C 13 33.7 0.02 . 1 . . . . . 465 MET CB . 27399 1 665 . 1 1 184 184 MET N N 15 116.83 0.2 . 1 . . . . . 465 MET N . 27399 1 666 . 1 1 185 185 TYR H H 1 8.53 0.02 . 1 . . . . . 466 TYR H . 27399 1 667 . 1 1 185 185 TYR C C 13 178.48 0.1 . 1 . . . . . 466 TYR C . 27399 1 668 . 1 1 185 185 TYR CA C 13 63.52 0.04 . 1 . . . . . 466 TYR CA . 27399 1 669 . 1 1 185 185 TYR CB C 13 38.8 0.02 . 1 . . . . . 466 TYR CB . 27399 1 670 . 1 1 185 185 TYR N N 15 124.86 0.2 . 1 . . . . . 466 TYR N . 27399 1 671 . 1 1 186 186 ASP H H 1 9.76 0.02 . 1 . . . . . 467 ASP H . 27399 1 672 . 1 1 186 186 ASP C C 13 180.05 0.1 . 1 . . . . . 467 ASP C . 27399 1 673 . 1 1 186 186 ASP CA C 13 57.43 0.04 . 1 . . . . . 467 ASP CA . 27399 1 674 . 1 1 186 186 ASP CB C 13 40.31 0.02 . 1 . . . . . 467 ASP CB . 27399 1 675 . 1 1 186 186 ASP N N 15 117.81 0.2 . 1 . . . . . 467 ASP N . 27399 1 676 . 1 1 187 187 GLU H H 1 6.43 0.02 . 1 . . . . . 468 GLU H . 27399 1 677 . 1 1 187 187 GLU C C 13 177.54 0.1 . 1 . . . . . 468 GLU C . 27399 1 678 . 1 1 187 187 GLU CA C 13 59.5 0.04 . 1 . . . . . 468 GLU CA . 27399 1 679 . 1 1 187 187 GLU CB C 13 29.73 0.02 . 1 . . . . . 468 GLU CB . 27399 1 680 . 1 1 187 187 GLU N N 15 117.16 0.2 . 1 . . . . . 468 GLU N . 27399 1 681 . 1 1 188 188 GLY H H 1 7.62 0.02 . 1 . . . . . 469 GLY H . 27399 1 682 . 1 1 188 188 GLY C C 13 175.28 0.1 . 1 . . . . . 469 GLY C . 27399 1 683 . 1 1 188 188 GLY CA C 13 47.42 0.04 . 1 . . . . . 469 GLY CA . 27399 1 684 . 1 1 188 188 GLY N N 15 105.66 0.2 . 1 . . . . . 469 GLY N . 27399 1 685 . 1 1 189 189 SER H H 1 8.11 0.02 . 1 . . . . . 470 SER H . 27399 1 686 . 1 1 189 189 SER C C 13 176.98 0.1 . 1 . . . . . 470 SER C . 27399 1 687 . 1 1 189 189 SER CA C 13 61.5 0.04 . 1 . . . . . 470 SER CA . 27399 1 688 . 1 1 189 189 SER CB C 13 62.72 0.02 . 1 . . . . . 470 SER CB . 27399 1 689 . 1 1 189 189 SER N N 15 115.65 0.2 . 1 . . . . . 470 SER N . 27399 1 690 . 1 1 190 190 ARG H H 1 7.47 0.02 . 1 . . . . . 471 ARG H . 27399 1 691 . 1 1 190 190 ARG C C 13 177.97 0.1 . 1 . . . . . 471 ARG C . 27399 1 692 . 1 1 190 190 ARG CA C 13 57.44 0.04 . 1 . . . . . 471 ARG CA . 27399 1 693 . 1 1 190 190 ARG CB C 13 28.92 0.02 . 1 . . . . . 471 ARG CB . 27399 1 694 . 1 1 190 190 ARG N N 15 121.14 0.2 . 1 . . . . . 471 ARG N . 27399 1 695 . 1 1 203 203 ILE C C 13 175.83 0.1 . 1 . . . . . 484 ILE C . 27399 1 696 . 1 1 203 203 ILE CA C 13 61.1 0.04 . 1 . . . . . 484 ILE CA . 27399 1 697 . 1 1 203 203 ILE CB C 13 38.32 0.02 . 1 . . . . . 484 ILE CB . 27399 1 698 . 1 1 204 204 GLY H H 1 8.18 0.02 . 1 . . . . . 485 GLY H . 27399 1 699 . 1 1 204 204 GLY C C 13 175.05 0.1 . 1 . . . . . 485 GLY C . 27399 1 700 . 1 1 204 204 GLY CA C 13 45.99 0.04 . 1 . . . . . 485 GLY CA . 27399 1 701 . 1 1 204 204 GLY N N 15 110.02 0.2 . 1 . . . . . 485 GLY N . 27399 1 702 . 1 1 205 205 ARG H H 1 7.8 0.02 . 1 . . . . . 486 ARG H . 27399 1 703 . 1 1 205 205 ARG C C 13 177.14 0.1 . 1 . . . . . 486 ARG C . 27399 1 704 . 1 1 205 205 ARG CA C 13 57.84 0.04 . 1 . . . . . 486 ARG CA . 27399 1 705 . 1 1 205 205 ARG CB C 13 30.26 0.02 . 1 . . . . . 486 ARG CB . 27399 1 706 . 1 1 205 205 ARG N N 15 118.67 0.2 . 1 . . . . . 486 ARG N . 27399 1 707 . 1 1 206 206 ASP H H 1 8.64 0.02 . 1 . . . . . 487 ASP H . 27399 1 708 . 1 1 206 206 ASP C C 13 175.11 0.1 . 1 . . . . . 487 ASP C . 27399 1 709 . 1 1 206 206 ASP CA C 13 53.28 0.04 . 1 . . . . . 487 ASP CA . 27399 1 710 . 1 1 206 206 ASP CB C 13 40.71 0.02 . 1 . . . . . 487 ASP CB . 27399 1 711 . 1 1 206 206 ASP N N 15 121.22 0.2 . 1 . . . . . 487 ASP N . 27399 1 712 . 1 1 207 207 ARG H H 1 7.67 0.02 . 1 . . . . . 488 ARG H . 27399 1 713 . 1 1 207 207 ARG C C 13 180.94 0.1 . 1 . . . . . 488 ARG C . 27399 1 714 . 1 1 207 207 ARG CA C 13 56.94 0.04 . 1 . . . . . 488 ARG CA . 27399 1 715 . 1 1 207 207 ARG CB C 13 30.88 0.02 . 1 . . . . . 488 ARG CB . 27399 1 716 . 1 1 207 207 ARG N N 15 125.98 0.2 . 1 . . . . . 488 ARG N . 27399 1 stop_ save_