################################### # 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 19090 _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 . _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' 1 $sample_1 isotropic 19090 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.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 ARG H H 1 9.5565 0.0000 . 1 . . . . 2 ARG H . 19090 1 2 . 1 1 2 2 ARG N N 15 125.7092 0.0000 . 1 . . . . 2 ARG N . 19090 1 3 . 1 1 3 3 ILE H H 1 8.2343 0.0000 . 1 . . . . 3 ILE H . 19090 1 4 . 1 1 3 3 ILE N N 15 124.3966 0.0000 . 1 . . . . 3 ILE N . 19090 1 5 . 1 1 4 4 ILE H H 1 8.6425 0.0000 . 1 . . . . 4 ILE H . 19090 1 6 . 1 1 4 4 ILE N N 15 126.0943 0.0000 . 1 . . . . 4 ILE N . 19090 1 7 . 1 1 5 5 LEU H H 1 8.2054 0.0000 . 1 . . . . 5 LEU H . 19090 1 8 . 1 1 5 5 LEU N N 15 125.2193 0.0000 . 1 . . . . 5 LEU N . 19090 1 9 . 1 1 6 6 LEU H H 1 9.3745 0.0000 . 1 . . . . 6 LEU H . 19090 1 10 . 1 1 6 6 LEU N N 15 126.4069 0.0000 . 1 . . . . 6 LEU N . 19090 1 11 . 1 1 7 7 GLY H H 1 8.9465 0.0000 . 1 . . . . 7 GLY H . 19090 1 12 . 1 1 7 7 GLY N N 15 110.1928 0.0000 . 1 . . . . 7 GLY N . 19090 1 13 . 1 1 12 12 GLY H H 1 8.3912 0.0000 . 1 . . . . 12 GLY H . 19090 1 14 . 1 1 12 12 GLY N N 15 108.6608 0.0000 . 1 . . . . 12 GLY N . 19090 1 15 . 1 1 17 17 ALA H H 1 9.5351 0.0000 . 1 . . . . 17 ALA H . 19090 1 16 . 1 1 17 17 ALA N N 15 125.3150 0.0000 . 1 . . . . 17 ALA N . 19090 1 17 . 1 1 18 18 GLN H H 1 7.1454 0.0000 . 1 . . . . 18 GLN H . 19090 1 18 . 1 1 18 18 GLN N N 15 114.8518 0.0000 . 1 . . . . 18 GLN N . 19090 1 19 . 1 1 19 19 PHE H H 1 6.6205 0.0000 . 1 . . . . 19 PHE H . 19090 1 20 . 1 1 19 19 PHE N N 15 118.3118 0.0000 . 1 . . . . 19 PHE N . 19090 1 21 . 1 1 21 21 MET H H 1 8.4747 0.0000 . 1 . . . . 21 MET H . 19090 1 22 . 1 1 21 21 MET N N 15 121.2303 0.0000 . 1 . . . . 21 MET N . 19090 1 23 . 1 1 22 22 GLU H H 1 7.4063 0.0000 . 1 . . . . 22 GLU H . 19090 1 24 . 1 1 22 22 GLU N N 15 118.8722 0.0000 . 1 . . . . 22 GLU N . 19090 1 25 . 1 1 23 23 LYS H H 1 7.9446 0.0000 . 1 . . . . 23 LYS H . 19090 1 26 . 1 1 23 23 LYS N N 15 119.4344 0.0000 . 1 . . . . 23 LYS N . 19090 1 27 . 1 1 24 24 TYR H H 1 8.2250 0.0000 . 1 . . . . 24 TYR H . 19090 1 28 . 1 1 24 24 TYR N N 15 114.0611 0.0000 . 1 . . . . 24 TYR N . 19090 1 29 . 1 1 26 26 ILE H H 1 6.7053 0.0000 . 1 . . . . 26 ILE H . 19090 1 30 . 1 1 26 26 ILE N N 15 113.3095 0.0000 . 1 . . . . 26 ILE N . 19090 1 31 . 1 1 29 29 ILE H H 1 9.6718 0.0000 . 1 . . . . 29 ILE H . 19090 1 32 . 1 1 29 29 ILE N N 15 132.9344 0.0000 . 1 . . . . 29 ILE N . 19090 1 33 . 1 1 32 32 GLY H H 1 9.9389 0.0000 . 1 . . . . 32 GLY H . 19090 1 34 . 1 1 32 32 GLY N N 15 110.5289 0.0000 . 1 . . . . 32 GLY N . 19090 1 35 . 1 1 35 35 LEU H H 1 8.5569 0.0000 . 1 . . . . 35 LEU H . 19090 1 36 . 1 1 35 35 LEU N N 15 122.9857 0.0000 . 1 . . . . 35 LEU N . 19090 1 37 . 1 1 39 39 VAL H H 1 8.1473 0.0000 . 1 . . . . 39 VAL H . 19090 1 38 . 1 1 39 39 VAL N N 15 120.3390 0.0000 . 1 . . . . 39 VAL N . 19090 1 39 . 1 1 40 40 LYS H H 1 7.7822 0.0000 . 1 . . . . 40 LYS H . 19090 1 40 . 1 1 40 40 LYS N N 15 121.4817 0.0000 . 1 . . . . 40 LYS N . 19090 1 41 . 1 1 41 41 SER H H 1 7.9744 0.0000 . 1 . . . . 41 SER H . 19090 1 42 . 1 1 41 41 SER N N 15 113.4126 0.0000 . 1 . . . . 41 SER N . 19090 1 43 . 1 1 42 42 GLY H H 1 7.7287 0.0000 . 1 . . . . 42 GLY H . 19090 1 44 . 1 1 42 42 GLY N N 15 110.7774 0.0000 . 1 . . . . 42 GLY N . 19090 1 45 . 1 1 43 43 SER H H 1 7.5600 0.0000 . 1 . . . . 43 SER H . 19090 1 46 . 1 1 43 43 SER N N 15 115.1068 0.0000 . 1 . . . . 43 SER N . 19090 1 47 . 1 1 44 44 GLU H H 1 8.9070 0.0000 . 1 . . . . 44 GLU H . 19090 1 48 . 1 1 44 44 GLU N N 15 122.7619 0.0000 . 1 . . . . 44 GLU N . 19090 1 49 . 1 1 45 45 LEU H H 1 8.1359 0.0000 . 1 . . . . 45 LEU H . 19090 1 50 . 1 1 45 45 LEU N N 15 120.9458 0.0000 . 1 . . . . 45 LEU N . 19090 1 51 . 1 1 46 46 GLY H H 1 7.6914 0.0000 . 1 . . . . 46 GLY H . 19090 1 52 . 1 1 46 46 GLY N N 15 107.6578 0.0000 . 1 . . . . 46 GLY N . 19090 1 53 . 1 1 47 47 LYS H H 1 8.2270 0.0000 . 1 . . . . 47 LYS H . 19090 1 54 . 1 1 47 47 LYS N N 15 121.6545 0.0000 . 1 . . . . 47 LYS N . 19090 1 55 . 1 1 48 48 GLN H H 1 7.5985 0.0000 . 1 . . . . 48 GLN H . 19090 1 56 . 1 1 48 48 GLN N N 15 117.7510 0.0000 . 1 . . . . 48 GLN N . 19090 1 57 . 1 1 49 49 ALA H H 1 8.0888 0.0000 . 1 . . . . 49 ALA H . 19090 1 58 . 1 1 49 49 ALA N N 15 120.4339 0.0000 . 1 . . . . 49 ALA N . 19090 1 59 . 1 1 50 50 LYS H H 1 7.8367 0.0000 . 1 . . . . 50 LYS H . 19090 1 60 . 1 1 50 50 LYS N N 15 118.9014 0.0000 . 1 . . . . 50 LYS N . 19090 1 61 . 1 1 51 51 ASP H H 1 8.2468 0.0000 . 1 . . . . 51 ASP H . 19090 1 62 . 1 1 51 51 ASP N N 15 117.0905 0.0000 . 1 . . . . 51 ASP N . 19090 1 63 . 1 1 52 52 ILE H H 1 7.1965 0.0000 . 1 . . . . 52 ILE H . 19090 1 64 . 1 1 52 52 ILE N N 15 122.0516 0.0000 . 1 . . . . 52 ILE N . 19090 1 65 . 1 1 53 53 MET H H 1 8.1711 0.0000 . 1 . . . . 53 MET H . 19090 1 66 . 1 1 53 53 MET N N 15 118.9158 0.0000 . 1 . . . . 53 MET N . 19090 1 67 . 1 1 54 54 ASP H H 1 8.5726 0.0000 . 1 . . . . 54 ASP H . 19090 1 68 . 1 1 54 54 ASP N N 15 120.7911 0.0000 . 1 . . . . 54 ASP N . 19090 1 69 . 1 1 55 55 ALA H H 1 7.1320 0.0000 . 1 . . . . 55 ALA H . 19090 1 70 . 1 1 55 55 ALA N N 15 119.8618 0.0000 . 1 . . . . 55 ALA N . 19090 1 71 . 1 1 56 56 GLY H H 1 7.9670 0.0000 . 1 . . . . 56 GLY H . 19090 1 72 . 1 1 56 56 GLY N N 15 106.9892 0.0000 . 1 . . . . 56 GLY N . 19090 1 73 . 1 1 57 57 LYS H H 1 7.2825 0.0000 . 1 . . . . 57 LYS H . 19090 1 74 . 1 1 57 57 LYS N N 15 118.9800 0.0000 . 1 . . . . 57 LYS N . 19090 1 75 . 1 1 61 61 ASP H H 1 8.7930 0.0000 . 1 . . . . 61 ASP H . 19090 1 76 . 1 1 61 61 ASP N N 15 126.2826 0.0000 . 1 . . . . 61 ASP N . 19090 1 77 . 1 1 62 62 GLU H H 1 9.2678 0.0000 . 1 . . . . 62 GLU H . 19090 1 78 . 1 1 62 62 GLU N N 15 117.2122 0.0000 . 1 . . . . 62 GLU N . 19090 1 79 . 1 1 63 63 LEU H H 1 6.9401 0.0000 . 1 . . . . 63 LEU H . 19090 1 80 . 1 1 63 63 LEU N N 15 118.1060 0.0000 . 1 . . . . 63 LEU N . 19090 1 81 . 1 1 64 64 VAL H H 1 7.0467 0.0000 . 1 . . . . 64 VAL H . 19090 1 82 . 1 1 64 64 VAL N N 15 115.9418 0.0000 . 1 . . . . 64 VAL N . 19090 1 83 . 1 1 66 66 ALA H H 1 7.1047 0.0000 . 1 . . . . 66 ALA H . 19090 1 84 . 1 1 66 66 ALA N N 15 120.3088 0.0000 . 1 . . . . 66 ALA N . 19090 1 85 . 1 1 69 69 LYS H H 1 8.2553 0.0000 . 1 . . . . 69 LYS H . 19090 1 86 . 1 1 69 69 LYS N N 15 118.8433 0.0000 . 1 . . . . 69 LYS N . 19090 1 87 . 1 1 70 70 GLU H H 1 7.3107 0.0000 . 1 . . . . 70 GLU H . 19090 1 88 . 1 1 70 70 GLU N N 15 117.2713 0.0000 . 1 . . . . 70 GLU N . 19090 1 89 . 1 1 71 71 ARG H H 1 7.4424 0.0000 . 1 . . . . 71 ARG H . 19090 1 90 . 1 1 71 71 ARG N N 15 121.1752 0.0000 . 1 . . . . 71 ARG N . 19090 1 91 . 1 1 72 72 ILE H H 1 8.1461 0.0000 . 1 . . . . 72 ILE H . 19090 1 92 . 1 1 72 72 ILE N N 15 112.4315 0.0000 . 1 . . . . 72 ILE N . 19090 1 93 . 1 1 73 73 ALA H H 1 6.8147 0.0000 . 1 . . . . 73 ALA H . 19090 1 94 . 1 1 73 73 ALA N N 15 122.2102 0.0000 . 1 . . . . 73 ALA N . 19090 1 95 . 1 1 74 74 GLN H H 1 7.1436 0.0000 . 1 . . . . 74 GLN H . 19090 1 96 . 1 1 74 74 GLN N N 15 117.2920 0.0000 . 1 . . . . 74 GLN N . 19090 1 97 . 1 1 76 76 ASP H H 1 8.4173 0.0000 . 1 . . . . 76 ASP H . 19090 1 98 . 1 1 76 76 ASP N N 15 118.3438 0.0000 . 1 . . . . 76 ASP N . 19090 1 99 . 1 1 77 77 CYS H H 1 7.6061 0.0000 . 1 . . . . 77 CYS H . 19090 1 100 . 1 1 77 77 CYS N N 15 118.6849 0.0000 . 1 . . . . 77 CYS N . 19090 1 101 . 1 1 78 78 ARG H H 1 7.6587 0.0000 . 1 . . . . 78 ARG H . 19090 1 102 . 1 1 78 78 ARG N N 15 122.8055 0.0000 . 1 . . . . 78 ARG N . 19090 1 103 . 1 1 79 79 ASN H H 1 8.3787 0.0000 . 1 . . . . 79 ASN H . 19090 1 104 . 1 1 79 79 ASN N N 15 116.0543 0.0000 . 1 . . . . 79 ASN N . 19090 1 105 . 1 1 80 80 GLY H H 1 7.3365 0.0000 . 1 . . . . 80 GLY H . 19090 1 106 . 1 1 80 80 GLY N N 15 108.3393 0.0000 . 1 . . . . 80 GLY N . 19090 1 107 . 1 1 81 81 PHE H H 1 7.4928 0.0000 . 1 . . . . 81 PHE H . 19090 1 108 . 1 1 81 81 PHE N N 15 110.1555 0.0000 . 1 . . . . 81 PHE N . 19090 1 109 . 1 1 82 82 LEU H H 1 8.6496 0.0000 . 1 . . . . 82 LEU H . 19090 1 110 . 1 1 82 82 LEU N N 15 122.6489 0.0000 . 1 . . . . 82 LEU N . 19090 1 111 . 1 1 83 83 LEU H H 1 9.5489 0.0000 . 1 . . . . 83 LEU H . 19090 1 112 . 1 1 83 83 LEU N N 15 128.4586 0.0000 . 1 . . . . 83 LEU N . 19090 1 113 . 1 1 88 88 ARG H H 1 7.7581 0.0000 . 1 . . . . 88 ARG H . 19090 1 114 . 1 1 88 88 ARG N N 15 113.2574 0.0000 . 1 . . . . 88 ARG N . 19090 1 115 . 1 1 89 89 THR H H 1 6.9958 0.0000 . 1 . . . . 89 THR H . 19090 1 116 . 1 1 89 89 THR N N 15 107.8007 0.0000 . 1 . . . . 89 THR N . 19090 1 117 . 1 1 90 90 ILE H H 1 9.6685 0.0000 . 1 . . . . 90 ILE H . 19090 1 118 . 1 1 90 90 ILE N N 15 124.4512 0.0000 . 1 . . . . 90 ILE N . 19090 1 119 . 1 1 92 92 GLN H H 1 7.0854 0.0000 . 1 . . . . 92 GLN H . 19090 1 120 . 1 1 92 92 GLN N N 15 116.2899 0.0000 . 1 . . . . 92 GLN N . 19090 1 121 . 1 1 93 93 ALA H H 1 7.3602 0.0000 . 1 . . . . 93 ALA H . 19090 1 122 . 1 1 93 93 ALA N N 15 124.8597 0.0000 . 1 . . . . 93 ALA N . 19090 1 123 . 1 1 94 94 ASP H H 1 8.9497 0.0000 . 1 . . . . 94 ASP H . 19090 1 124 . 1 1 94 94 ASP N N 15 121.3992 0.0000 . 1 . . . . 94 ASP N . 19090 1 125 . 1 1 95 95 ALA H H 1 7.9243 0.0000 . 1 . . . . 95 ALA H . 19090 1 126 . 1 1 95 95 ALA N N 15 123.0622 0.0000 . 1 . . . . 95 ALA N . 19090 1 127 . 1 1 96 96 MET H H 1 7.4913 0.0000 . 1 . . . . 96 MET H . 19090 1 128 . 1 1 96 96 MET N N 15 118.1862 0.0000 . 1 . . . . 96 MET N . 19090 1 129 . 1 1 97 97 LYS H H 1 7.5802 0.0000 . 1 . . . . 97 LYS H . 19090 1 130 . 1 1 97 97 LYS N N 15 121.6391 0.0000 . 1 . . . . 97 LYS N . 19090 1 131 . 1 1 98 98 GLU H H 1 8.5860 0.0000 . 1 . . . . 98 GLU H . 19090 1 132 . 1 1 98 98 GLU N N 15 121.7846 0.0000 . 1 . . . . 98 GLU N . 19090 1 133 . 1 1 100 100 GLY H H 1 7.8270 0.0000 . 1 . . . . 100 GLY H . 19090 1 134 . 1 1 100 100 GLY N N 15 108.6855 0.0000 . 1 . . . . 100 GLY N . 19090 1 135 . 1 1 102 102 ASN H H 1 7.9458 0.0000 . 1 . . . . 102 ASN H . 19090 1 136 . 1 1 102 102 ASN N N 15 125.7387 0.0000 . 1 . . . . 102 ASN N . 19090 1 137 . 1 1 103 103 VAL H H 1 8.7879 0.0000 . 1 . . . . 103 VAL H . 19090 1 138 . 1 1 103 103 VAL N N 15 114.0980 0.0000 . 1 . . . . 103 VAL N . 19090 1 139 . 1 1 105 105 TYR H H 1 7.5331 0.0000 . 1 . . . . 105 TYR H . 19090 1 140 . 1 1 105 105 TYR N N 15 116.0924 0.0000 . 1 . . . . 105 TYR N . 19090 1 141 . 1 1 106 106 VAL H H 1 8.6988 0.0000 . 1 . . . . 106 VAL H . 19090 1 142 . 1 1 106 106 VAL N N 15 124.0512 0.0000 . 1 . . . . 106 VAL N . 19090 1 143 . 1 1 107 107 LEU H H 1 8.4750 0.0000 . 1 . . . . 107 LEU H . 19090 1 144 . 1 1 107 107 LEU N N 15 125.9850 0.0000 . 1 . . . . 107 LEU N . 19090 1 145 . 1 1 108 108 GLU H H 1 8.6914 0.0000 . 1 . . . . 108 GLU H . 19090 1 146 . 1 1 108 108 GLU N N 15 126.1309 0.0000 . 1 . . . . 108 GLU N . 19090 1 147 . 1 1 109 109 PHE H H 1 9.2955 0.0000 . 1 . . . . 109 PHE H . 19090 1 148 . 1 1 109 109 PHE N N 15 129.5799 0.0000 . 1 . . . . 109 PHE N . 19090 1 149 . 1 1 110 110 ASP H H 1 8.8726 0.0000 . 1 . . . . 110 ASP H . 19090 1 150 . 1 1 110 110 ASP N N 15 127.1023 0.0000 . 1 . . . . 110 ASP N . 19090 1 151 . 1 1 111 111 VAL H H 1 7.5148 0.0000 . 1 . . . . 111 VAL H . 19090 1 152 . 1 1 111 111 VAL N N 15 126.4648 0.0000 . 1 . . . . 111 VAL N . 19090 1 153 . 1 1 114 114 GLU H H 1 9.0590 0.0000 . 1 . . . . 114 GLU H . 19090 1 154 . 1 1 114 114 GLU N N 15 116.3515 0.0000 . 1 . . . . 114 GLU N . 19090 1 155 . 1 1 118 118 ASP H H 1 7.7311 0.0000 . 1 . . . . 118 ASP H . 19090 1 156 . 1 1 118 118 ASP N N 15 117.4385 0.0000 . 1 . . . . 118 ASP N . 19090 1 157 . 1 1 120 120 ILE H H 1 7.9497 0.0000 . 1 . . . . 120 ILE H . 19090 1 158 . 1 1 120 120 ILE N N 15 118.3531 0.0000 . 1 . . . . 120 ILE N . 19090 1 159 . 1 1 122 122 GLY H H 1 6.9881 0.0000 . 1 . . . . 122 GLY H . 19090 1 160 . 1 1 122 122 GLY N N 15 105.4904 0.0000 . 1 . . . . 122 GLY N . 19090 1 161 . 1 1 123 123 ARG H H 1 7.1566 0.0000 . 1 . . . . 123 ARG H . 19090 1 162 . 1 1 123 123 ARG N N 15 123.5497 0.0000 . 1 . . . . 123 ARG N . 19090 1 163 . 1 1 124 124 ARG H H 1 8.4061 0.0000 . 1 . . . . 124 ARG H . 19090 1 164 . 1 1 124 124 ARG N N 15 130.5510 0.0000 . 1 . . . . 124 ARG N . 19090 1 165 . 1 1 125 125 VAL H H 1 9.1837 0.0000 . 1 . . . . 125 VAL H . 19090 1 166 . 1 1 125 125 VAL N N 15 117.4790 0.0000 . 1 . . . . 125 VAL N . 19090 1 167 . 1 1 126 126 HIS H H 1 9.0982 0.0000 . 1 . . . . 126 HIS H . 19090 1 168 . 1 1 126 126 HIS N N 15 126.5398 0.0000 . 1 . . . . 126 HIS N . 19090 1 169 . 1 1 127 127 ALA H H 1 8.8924 0.0000 . 1 . . . . 127 ALA H . 19090 1 170 . 1 1 127 127 ALA N N 15 130.0508 0.0000 . 1 . . . . 127 ALA N . 19090 1 171 . 1 1 129 129 SER H H 1 6.7354 0.0000 . 1 . . . . 129 SER H . 19090 1 172 . 1 1 129 129 SER N N 15 108.3846 0.0000 . 1 . . . . 129 SER N . 19090 1 173 . 1 1 130 130 GLY H H 1 8.3875 0.0000 . 1 . . . . 130 GLY H . 19090 1 174 . 1 1 130 130 GLY N N 15 113.7003 0.0000 . 1 . . . . 130 GLY N . 19090 1 175 . 1 1 131 131 ARG H H 1 8.4204 0.0000 . 1 . . . . 131 ARG H . 19090 1 176 . 1 1 131 131 ARG N N 15 122.5597 0.0000 . 1 . . . . 131 ARG N . 19090 1 177 . 1 1 132 132 VAL H H 1 7.9218 0.0000 . 1 . . . . 132 VAL H . 19090 1 178 . 1 1 132 132 VAL N N 15 119.0973 0.0000 . 1 . . . . 132 VAL N . 19090 1 179 . 1 1 136 136 LYS H H 1 9.4620 0.0000 . 1 . . . . 136 LYS H . 19090 1 180 . 1 1 136 136 LYS N N 15 120.8153 0.0000 . 1 . . . . 136 LYS N . 19090 1 181 . 1 1 141 141 LYS H H 1 10.0745 0.0000 . 1 . . . . 141 LYS H . 19090 1 182 . 1 1 141 141 LYS N N 15 124.7175 0.0000 . 1 . . . . 141 LYS N . 19090 1 183 . 1 1 142 142 VAL H H 1 8.7379 0.0000 . 1 . . . . 142 VAL H . 19090 1 184 . 1 1 142 142 VAL N N 15 121.4206 0.0000 . 1 . . . . 142 VAL N . 19090 1 185 . 1 1 143 143 GLU H H 1 8.0842 0.0000 . 1 . . . . 143 GLU H . 19090 1 186 . 1 1 143 143 GLU N N 15 126.3867 0.0000 . 1 . . . . 143 GLU N . 19090 1 187 . 1 1 146 146 ASP H H 1 8.9679 0.0000 . 1 . . . . 146 ASP H . 19090 1 188 . 1 1 146 146 ASP N N 15 120.7128 0.0000 . 1 . . . . 146 ASP N . 19090 1 189 . 1 1 147 147 ASP H H 1 7.8562 0.0000 . 1 . . . . 147 ASP H . 19090 1 190 . 1 1 147 147 ASP N N 15 127.8140 0.0000 . 1 . . . . 147 ASP N . 19090 1 191 . 1 1 148 148 VAL H H 1 6.2769 0.0000 . 1 . . . . 148 VAL H . 19090 1 192 . 1 1 148 148 VAL N N 15 116.0516 0.0000 . 1 . . . . 148 VAL N . 19090 1 193 . 1 1 149 149 THR H H 1 7.4233 0.0000 . 1 . . . . 149 THR H . 19090 1 194 . 1 1 149 149 THR N N 15 106.3135 0.0000 . 1 . . . . 149 THR N . 19090 1 195 . 1 1 150 150 GLY H H 1 7.7772 0.0000 . 1 . . . . 150 GLY H . 19090 1 196 . 1 1 150 150 GLY N N 15 111.9780 0.0000 . 1 . . . . 150 GLY N . 19090 1 197 . 1 1 151 151 GLU H H 1 7.5866 0.0000 . 1 . . . . 151 GLU H . 19090 1 198 . 1 1 151 151 GLU N N 15 119.5472 0.0000 . 1 . . . . 151 GLU N . 19090 1 199 . 1 1 152 152 GLU H H 1 8.6306 0.0000 . 1 . . . . 152 GLU H . 19090 1 200 . 1 1 152 152 GLU N N 15 120.6398 0.0000 . 1 . . . . 152 GLU N . 19090 1 201 . 1 1 154 154 THR H H 1 9.3306 0.0000 . 1 . . . . 154 THR H . 19090 1 202 . 1 1 154 154 THR N N 15 114.7679 0.0000 . 1 . . . . 154 THR N . 19090 1 203 . 1 1 155 155 THR H H 1 8.2473 0.0000 . 1 . . . . 155 THR H . 19090 1 204 . 1 1 155 155 THR N N 15 115.4268 0.0000 . 1 . . . . 155 THR N . 19090 1 205 . 1 1 156 156 ARG H H 1 10.0330 0.0000 . 1 . . . . 156 ARG H . 19090 1 206 . 1 1 156 156 ARG N N 15 128.5958 0.0000 . 1 . . . . 156 ARG N . 19090 1 207 . 1 1 162 162 GLU H H 1 9.0775 0.0000 . 1 . . . . 162 GLU H . 19090 1 208 . 1 1 162 162 GLU N N 15 117.4833 0.0000 . 1 . . . . 162 GLU N . 19090 1 209 . 1 1 163 163 THR H H 1 7.2480 0.0000 . 1 . . . . 163 THR H . 19090 1 210 . 1 1 163 163 THR N N 15 116.7873 0.0000 . 1 . . . . 163 THR N . 19090 1 211 . 1 1 171 171 TYR H H 1 8.4072 0.0000 . 1 . . . . 171 TYR H . 19090 1 212 . 1 1 171 171 TYR N N 15 121.1291 0.0000 . 1 . . . . 171 TYR N . 19090 1 213 . 1 1 173 173 GLN H H 1 7.8336 0.0000 . 1 . . . . 173 GLN H . 19090 1 214 . 1 1 173 173 GLN N N 15 116.6955 0.0000 . 1 . . . . 173 GLN N . 19090 1 215 . 1 1 174 174 MET H H 1 8.5503 0.0000 . 1 . . . . 174 MET H . 19090 1 216 . 1 1 174 174 MET N N 15 113.8379 0.0000 . 1 . . . . 174 MET N . 19090 1 217 . 1 1 175 175 THR H H 1 7.8034 0.0000 . 1 . . . . 175 THR H . 19090 1 218 . 1 1 175 175 THR N N 15 118.0533 0.0000 . 1 . . . . 175 THR N . 19090 1 219 . 1 1 176 176 ALA H H 1 7.9156 0.0000 . 1 . . . . 176 ALA H . 19090 1 220 . 1 1 176 176 ALA N N 15 127.2390 0.0000 . 1 . . . . 176 ALA N . 19090 1 221 . 1 1 179 179 ILE H H 1 8.0826 0.0000 . 1 . . . . 179 ILE H . 19090 1 222 . 1 1 179 179 ILE N N 15 123.8534 0.0000 . 1 . . . . 179 ILE N . 19090 1 223 . 1 1 181 181 TYR H H 1 7.5589 0.0000 . 1 . . . . 181 TYR H . 19090 1 224 . 1 1 181 181 TYR N N 15 123.7096 0.0000 . 1 . . . . 181 TYR N . 19090 1 225 . 1 1 182 182 TYR H H 1 9.0117 0.0000 . 1 . . . . 182 TYR H . 19090 1 226 . 1 1 182 182 TYR N N 15 117.6695 0.0000 . 1 . . . . 182 TYR N . 19090 1 227 . 1 1 183 183 SER H H 1 8.2843 0.0000 . 1 . . . . 183 SER H . 19090 1 228 . 1 1 183 183 SER N N 15 120.5686 0.0000 . 1 . . . . 183 SER N . 19090 1 229 . 1 1 184 184 LYS H H 1 7.6172 0.0000 . 1 . . . . 184 LYS H . 19090 1 230 . 1 1 184 184 LYS N N 15 124.0801 0.0000 . 1 . . . . 184 LYS N . 19090 1 231 . 1 1 186 186 ALA H H 1 8.2523 0.0000 . 1 . . . . 186 ALA H . 19090 1 232 . 1 1 186 186 ALA N N 15 123.4925 0.0000 . 1 . . . . 186 ALA N . 19090 1 233 . 1 1 188 188 ALA H H 1 7.3949 0.0000 . 1 . . . . 188 ALA H . 19090 1 234 . 1 1 188 188 ALA N N 15 119.4012 0.0000 . 1 . . . . 188 ALA N . 19090 1 235 . 1 1 189 189 GLY H H 1 7.8271 0.0000 . 1 . . . . 189 GLY H . 19090 1 236 . 1 1 189 189 GLY N N 15 106.1128 0.0000 . 1 . . . . 189 GLY N . 19090 1 237 . 1 1 190 190 ASN H H 1 8.1363 0.0000 . 1 . . . . 190 ASN H . 19090 1 238 . 1 1 190 190 ASN N N 15 117.6099 0.0000 . 1 . . . . 190 ASN N . 19090 1 239 . 1 1 191 191 THR H H 1 7.4428 0.0000 . 1 . . . . 191 THR H . 19090 1 240 . 1 1 191 191 THR N N 15 113.5846 0.0000 . 1 . . . . 191 THR N . 19090 1 241 . 1 1 193 193 TYR H H 1 8.6260 0.0000 . 1 . . . . 193 TYR H . 19090 1 242 . 1 1 193 193 TYR N N 15 126.5171 0.0000 . 1 . . . . 193 TYR N . 19090 1 243 . 1 1 194 194 ALA H H 1 8.4910 0.0000 . 1 . . . . 194 ALA H . 19090 1 244 . 1 1 194 194 ALA N N 15 132.0351 0.0000 . 1 . . . . 194 ALA N . 19090 1 245 . 1 1 197 197 ASP H H 1 8.6669 0.0000 . 1 . . . . 197 ASP H . 19090 1 246 . 1 1 197 197 ASP N N 15 124.4510 0.0000 . 1 . . . . 197 ASP N . 19090 1 247 . 1 1 198 198 GLY H H 1 8.2786 0.0000 . 1 . . . . 198 GLY H . 19090 1 248 . 1 1 198 198 GLY N N 15 112.5156 0.0000 . 1 . . . . 198 GLY N . 19090 1 249 . 1 1 200 200 LYS H H 1 6.2851 0.0000 . 1 . . . . 200 LYS H . 19090 1 250 . 1 1 200 200 LYS N N 15 123.0754 0.0000 . 1 . . . . 200 LYS N . 19090 1 251 . 1 1 202 202 VAL H H 1 8.1664 0.0000 . 1 . . . . 202 VAL H . 19090 1 252 . 1 1 202 202 VAL N N 15 123.6975 0.0000 . 1 . . . . 202 VAL N . 19090 1 253 . 1 1 203 203 ALA H H 1 8.8123 0.0000 . 1 . . . . 203 ALA H . 19090 1 254 . 1 1 203 203 ALA N N 15 118.8235 0.0000 . 1 . . . . 203 ALA N . 19090 1 255 . 1 1 205 205 VAL H H 1 7.8972 0.0000 . 1 . . . . 205 VAL H . 19090 1 256 . 1 1 205 205 VAL N N 15 122.6075 0.0000 . 1 . . . . 205 VAL N . 19090 1 257 . 1 1 206 206 ARG H H 1 7.7203 0.0000 . 1 . . . . 206 ARG H . 19090 1 258 . 1 1 206 206 ARG N N 15 119.5612 0.0000 . 1 . . . . 206 ARG N . 19090 1 259 . 1 1 207 207 ALA H H 1 7.1966 0.0000 . 1 . . . . 207 ALA H . 19090 1 260 . 1 1 207 207 ALA N N 15 121.2959 0.0000 . 1 . . . . 207 ALA N . 19090 1 261 . 1 1 209 209 LEU H H 1 8.2910 0.0000 . 1 . . . . 209 LEU H . 19090 1 262 . 1 1 209 209 LEU N N 15 121.9173 0.0000 . 1 . . . . 209 LEU N . 19090 1 263 . 1 1 210 210 GLU H H 1 8.2119 0.0000 . 1 . . . . 210 GLU H . 19090 1 264 . 1 1 210 210 GLU N N 15 120.3607 0.0000 . 1 . . . . 210 GLU N . 19090 1 265 . 1 1 212 212 ILE H H 1 7.2062 0.0000 . 1 . . . . 212 ILE H . 19090 1 266 . 1 1 212 212 ILE N N 15 120.0420 0.0000 . 1 . . . . 212 ILE N . 19090 1 267 . 1 1 213 213 LEU H H 1 7.8741 0.0000 . 1 . . . . 213 LEU H . 19090 1 268 . 1 1 213 213 LEU N N 15 118.3586 0.0000 . 1 . . . . 213 LEU N . 19090 1 269 . 1 1 214 214 GLY H H 1 7.6483 0.0000 . 1 . . . . 214 GLY H . 19090 1 270 . 1 1 214 214 GLY N N 15 112.9057 0.0000 . 1 . . . . 214 GLY N . 19090 1 stop_ save_