################################### # 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 53266 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _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 BEST-TROSY' . . . 53266 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 2 $software_2 . . 53266 1 3 $software_3 . . 53266 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 6 6 ARG H H 1 7.401 0.00 . 1 . . . . . 45 ARG H . 53266 1 2 . 1 . 1 6 6 ARG N N 15 121.276 0.00 . 1 . . . . . 45 ARG N . 53266 1 3 . 1 . 1 8 8 ALA H H 1 8.410 0.00 . 1 . . . . . 47 ALA H . 53266 1 4 . 1 . 1 8 8 ALA N N 15 123.259 0.00 . 1 . . . . . 47 ALA N . 53266 1 5 . 1 . 1 9 9 LYS H H 1 8.398 0.00 . 1 . . . . . 48 LYS H . 53266 1 6 . 1 . 1 9 9 LYS N N 15 115.053 0.00 . 1 . . . . . 48 LYS N . 53266 1 7 . 1 . 1 10 10 TRP H H 1 8.078 0.00 . 1 . . . . . 49 TRP H . 53266 1 8 . 1 . 1 10 10 TRP HE1 H 1 10.059 0.00 . 1 . . . . . 49 TRP HE1 . 53266 1 9 . 1 . 1 10 10 TRP N N 15 122.211 0.00 . 1 . . . . . 49 TRP N . 53266 1 10 . 1 . 1 10 10 TRP NE1 N 15 129.581 0.00 . 1 . . . . . 49 TRP NE1 . 53266 1 11 . 1 . 1 11 11 PHE H H 1 8.658 0.00 . 1 . . . . . 50 PHE H . 53266 1 12 . 1 . 1 11 11 PHE N N 15 120.334 0.00 . 1 . . . . . 50 PHE N . 53266 1 13 . 1 . 1 12 12 LEU H H 1 8.161 0.00 . 1 . . . . . 51 LEU H . 53266 1 14 . 1 . 1 12 12 LEU N N 15 120.502 0.00 . 1 . . . . . 51 LEU N . 53266 1 15 . 1 . 1 13 13 GLU H H 1 9.097 0.00 . 1 . . . . . 52 GLU H . 53266 1 16 . 1 . 1 13 13 GLU N N 15 121.323 0.00 . 1 . . . . . 52 GLU N . 53266 1 17 . 1 . 1 14 14 HIS H H 1 7.520 0.00 . 1 . . . . . 53 HIS H . 53266 1 18 . 1 . 1 14 14 HIS N N 15 115.092 0.00 . 1 . . . . . 53 HIS N . 53266 1 19 . 1 . 1 15 15 GLY H H 1 7.857 0.00 . 1 . . . . . 54 GLY H . 53266 1 20 . 1 . 1 15 15 GLY N N 15 106.595 0.00 . 1 . . . . . 54 GLY N . 53266 1 21 . 1 . 1 16 16 PHE H H 1 8.198 0.00 . 1 . . . . . 55 PHE H . 53266 1 22 . 1 . 1 16 16 PHE N N 15 118.409 0.00 . 1 . . . . . 55 PHE N . 53266 1 23 . 1 . 1 17 17 ASN H H 1 10.304 0.00 . 1 . . . . . 56 ASN H . 53266 1 24 . 1 . 1 17 17 ASN N N 15 120.275 0.00 . 1 . . . . . 56 ASN N . 53266 1 25 . 1 . 1 18 18 ILE H H 1 7.512 0.00 . 1 . . . . . 57 ILE H . 53266 1 26 . 1 . 1 18 18 ILE N N 15 109.815 0.00 . 1 . . . . . 57 ILE N . 53266 1 27 . 1 . 1 22 22 ASP H H 1 8.410 0.00 . 1 . . . . . 61 ASP H . 53266 1 28 . 1 . 1 22 22 ASP N N 15 129.152 0.00 . 1 . . . . . 61 ASP N . 53266 1 29 . 1 . 1 26 26 LYS H H 1 8.003 0.00 . 1 . . . . . 65 LYS H . 53266 1 30 . 1 . 1 26 26 LYS N N 15 114.863 0.00 . 1 . . . . . 65 LYS N . 53266 1 31 . 1 . 1 32 32 GLU H H 1 8.614 0.00 . 1 . . . . . 71 GLU H . 53266 1 32 . 1 . 1 32 32 GLU N N 15 119.290 0.00 . 1 . . . . . 71 GLU N . 53266 1 33 . 1 . 1 33 33 TRP H H 1 6.951 0.00 . 1 . . . . . 72 TRP H . 53266 1 34 . 1 . 1 33 33 TRP HE1 H 1 10.495 0.00 . 1 . . . . . 72 TRP HE1 . 53266 1 35 . 1 . 1 33 33 TRP N N 15 117.407 0.00 . 1 . . . . . 72 TRP N . 53266 1 36 . 1 . 1 33 33 TRP NE1 N 15 131.387 0.00 . 1 . . . . . 72 TRP NE1 . 53266 1 37 . 1 . 1 34 34 GLN H H 1 8.384 0.00 . 1 . . . . . 73 GLN H . 53266 1 38 . 1 . 1 34 34 GLN N N 15 122.690 0.00 . 1 . . . . . 73 GLN N . 53266 1 39 . 1 . 1 35 35 LYS H H 1 7.688 0.00 . 1 . . . . . 74 LYS H . 53266 1 40 . 1 . 1 35 35 LYS N N 15 118.159 0.00 . 1 . . . . . 74 LYS N . 53266 1 41 . 1 . 1 36 36 TYR H H 1 7.951 0.00 . 1 . . . . . 75 TYR H . 53266 1 42 . 1 . 1 36 36 TYR N N 15 118.517 0.00 . 1 . . . . . 75 TYR N . 53266 1 43 . 1 . 1 37 37 SER H H 1 8.074 0.00 . 1 . . . . . 76 SER H . 53266 1 44 . 1 . 1 37 37 SER N N 15 113.884 0.00 . 1 . . . . . 76 SER N . 53266 1 45 . 1 . 1 38 38 HIS H H 1 7.853 0.00 . 1 . . . . . 77 HIS H . 53266 1 46 . 1 . 1 38 38 HIS N N 15 115.872 0.00 . 1 . . . . . 77 HIS N . 53266 1 47 . 1 . 1 39 39 GLU H H 1 8.298 0.00 . 1 . . . . . 78 GLU H . 53266 1 48 . 1 . 1 39 39 GLU N N 15 120.173 0.00 . 1 . . . . . 78 GLU N . 53266 1 49 . 1 . 1 40 40 MET H H 1 8.516 0.00 . 1 . . . . . 79 MET H . 53266 1 50 . 1 . 1 40 40 MET N N 15 119.523 0.00 . 1 . . . . . 79 MET N . 53266 1 51 . 1 . 1 42 42 SER H H 1 8.688 0.00 . 1 . . . . . 81 SER H . 53266 1 52 . 1 . 1 42 42 SER N N 15 116.829 0.00 . 1 . . . . . 81 SER N . 53266 1 53 . 1 . 1 43 43 ASP H H 1 8.964 0.00 . 1 . . . . . 82 ASP H . 53266 1 54 . 1 . 1 43 43 ASP N N 15 122.152 0.00 . 1 . . . . . 82 ASP N . 53266 1 55 . 1 . 1 44 44 GLU H H 1 8.576 0.00 . 1 . . . . . 83 GLU H . 53266 1 56 . 1 . 1 44 44 GLU N N 15 119.187 0.00 . 1 . . . . . 83 GLU N . 53266 1 57 . 1 . 1 45 45 GLU H H 1 7.638 0.00 . 1 . . . . . 84 GLU H . 53266 1 58 . 1 . 1 45 45 GLU N N 15 121.694 0.00 . 1 . . . . . 84 GLU N . 53266 1 59 . 1 . 1 46 46 LYS H H 1 8.093 0.00 . 1 . . . . . 85 LYS H . 53266 1 60 . 1 . 1 46 46 LYS N N 15 117.752 0.00 . 1 . . . . . 85 LYS N . 53266 1 61 . 1 . 1 47 47 GLN H H 1 7.809 0.00 . 1 . . . . . 86 GLN H . 53266 1 62 . 1 . 1 47 47 GLN N N 15 115.410 0.00 . 1 . . . . . 86 GLN N . 53266 1 63 . 1 . 1 48 48 ARG H H 1 7.792 0.00 . 1 . . . . . 87 ARG H . 53266 1 64 . 1 . 1 48 48 ARG N N 15 121.911 0.00 . 1 . . . . . 87 ARG N . 53266 1 65 . 1 . 1 49 49 PHE H H 1 8.609 0.00 . 1 . . . . . 88 PHE H . 53266 1 66 . 1 . 1 49 49 PHE N N 15 119.285 0.00 . 1 . . . . . 88 PHE N . 53266 1 67 . 1 . 1 50 50 LEU H H 1 8.224 0.00 . 1 . . . . . 89 LEU H . 53266 1 68 . 1 . 1 50 50 LEU N N 15 119.044 0.00 . 1 . . . . . 89 LEU N . 53266 1 69 . 1 . 1 51 51 LYS H H 1 8.010 0.00 . 1 . . . . . 90 LYS H . 53266 1 70 . 1 . 1 51 51 LYS N N 15 121.025 0.00 . 1 . . . . . 90 LYS N . 53266 1 71 . 1 . 1 52 52 MET H H 1 7.869 0.00 . 1 . . . . . 91 MET H . 53266 1 72 . 1 . 1 52 52 MET N N 15 117.518 0.00 . 1 . . . . . 91 MET N . 53266 1 73 . 1 . 1 53 53 ILE H H 1 7.896 0.00 . 1 . . . . . 92 ILE H . 53266 1 74 . 1 . 1 53 53 ILE N N 15 120.831 0.00 . 1 . . . . . 92 ILE N . 53266 1 75 . 1 . 1 54 54 GLU H H 1 8.722 0.00 . 1 . . . . . 93 GLU H . 53266 1 76 . 1 . 1 54 54 GLU N N 15 124.672 0.00 . 1 . . . . . 93 GLU N . 53266 1 77 . 1 . 1 55 55 GLU H H 1 7.895 0.00 . 1 . . . . . 94 GLU H . 53266 1 78 . 1 . 1 55 55 GLU N N 15 117.068 0.00 . 1 . . . . . 94 GLU N . 53266 1 79 . 1 . 1 56 56 GLY H H 1 7.712 0.00 . 1 . . . . . 95 GLY H . 53266 1 80 . 1 . 1 56 56 GLY N N 15 105.240 0.00 . 1 . . . . . 95 GLY N . 53266 1 81 . 1 . 1 58 58 ASN H H 1 7.814 0.00 . 1 . . . . . 97 ASN H . 53266 1 82 . 1 . 1 58 58 ASN N N 15 115.413 0.00 . 1 . . . . . 97 ASN N . 53266 1 83 . 1 . 1 59 59 TYR H H 1 7.634 0.00 . 1 . . . . . 98 TYR H . 53266 1 84 . 1 . 1 59 59 TYR N N 15 112.968 0.00 . 1 . . . . . 98 TYR N . 53266 1 85 . 1 . 1 60 60 ALA H H 1 8.836 0.00 . 1 . . . . . 99 ALA H . 53266 1 86 . 1 . 1 60 60 ALA N N 15 121.197 0.00 . 1 . . . . . 99 ALA N . 53266 1 87 . 1 . 1 61 61 ILE H H 1 8.692 0.00 . 1 . . . . . 100 ILE H . 53266 1 88 . 1 . 1 61 61 ILE N N 15 120.222 0.00 . 1 . . . . . 100 ILE N . 53266 1 89 . 1 . 1 63 63 GLY H H 1 8.334 0.00 . 1 . . . . . 102 GLY H . 53266 1 90 . 1 . 1 63 63 GLY N N 15 106.733 0.00 . 1 . . . . . 102 GLY N . 53266 1 91 . 1 . 1 64 64 GLY H H 1 9.460 0.00 . 1 . . . . . 103 GLY H . 53266 1 92 . 1 . 1 64 64 GLY N N 15 112.085 0.00 . 1 . . . . . 103 GLY N . 53266 1 93 . 1 . 1 65 65 GLN H H 1 6.713 0.00 . 1 . . . . . 104 GLN H . 53266 1 94 . 1 . 1 65 65 GLN N N 15 118.822 0.00 . 1 . . . . . 104 GLN N . 53266 1 95 . 1 . 1 66 66 LYS H H 1 8.941 0.00 . 1 . . . . . 105 LYS H . 53266 1 96 . 1 . 1 66 66 LYS N N 15 117.426 0.00 . 1 . . . . . 105 LYS N . 53266 1 97 . 1 . 1 67 67 GLY H H 1 8.312 0.00 . 1 . . . . . 106 GLY H . 53266 1 98 . 1 . 1 67 67 GLY N N 15 106.132 0.00 . 1 . . . . . 106 GLY N . 53266 1 99 . 1 . 1 68 68 LEU H H 1 7.794 0.00 . 1 . . . . . 107 LEU H . 53266 1 100 . 1 . 1 68 68 LEU N N 15 121.673 0.00 . 1 . . . . . 107 LEU N . 53266 1 101 . 1 . 1 69 69 VAL H H 1 9.311 0.00 . 1 . . . . . 108 VAL H . 53266 1 102 . 1 . 1 69 69 VAL N N 15 123.442 0.00 . 1 . . . . . 108 VAL N . 53266 1 103 . 1 . 1 71 71 LEU H H 1 9.164 0.00 . 1 . . . . . 110 LEU H . 53266 1 104 . 1 . 1 71 71 LEU N N 15 128.683 0.00 . 1 . . . . . 110 LEU N . 53266 1 105 . 1 . 1 72 72 ASP H H 1 8.526 0.00 . 1 . . . . . 111 ASP H . 53266 1 106 . 1 . 1 72 72 ASP N N 15 125.308 0.00 . 1 . . . . . 111 ASP N . 53266 1 107 . 1 . 1 73 73 PHE H H 1 9.320 0.00 . 1 . . . . . 112 PHE H . 53266 1 108 . 1 . 1 73 73 PHE N N 15 123.938 0.00 . 1 . . . . . 112 PHE N . 53266 1 109 . 1 . 1 74 74 GLU H H 1 7.917 0.00 . 1 . . . . . 113 GLU H . 53266 1 110 . 1 . 1 74 74 GLU N N 15 124.101 0.00 . 1 . . . . . 113 GLU N . 53266 1 111 . 1 . 1 75 75 SER H H 1 8.648 0.00 . 1 . . . . . 114 SER H . 53266 1 112 . 1 . 1 75 75 SER N N 15 109.966 0.00 . 1 . . . . . 114 SER N . 53266 1 113 . 1 . 1 76 76 LYS H H 1 9.155 0.00 . 1 . . . . . 115 LYS H . 53266 1 114 . 1 . 1 76 76 LYS N N 15 130.796 0.00 . 1 . . . . . 115 LYS N . 53266 1 115 . 1 . 1 77 77 GLU H H 1 8.336 0.00 . 1 . . . . . 116 GLU H . 53266 1 116 . 1 . 1 77 77 GLU N N 15 119.323 0.00 . 1 . . . . . 116 GLU N . 53266 1 117 . 1 . 1 78 78 LYS H H 1 8.035 0.00 . 1 . . . . . 117 LYS H . 53266 1 118 . 1 . 1 78 78 LYS N N 15 121.436 0.00 . 1 . . . . . 117 LYS N . 53266 1 119 . 1 . 1 79 79 LEU H H 1 7.573 0.00 . 1 . . . . . 118 LEU H . 53266 1 120 . 1 . 1 79 79 LEU N N 15 119.660 0.00 . 1 . . . . . 118 LEU N . 53266 1 121 . 1 . 1 80 80 LYS H H 1 8.159 0.00 . 1 . . . . . 119 LYS H . 53266 1 122 . 1 . 1 80 80 LYS N N 15 118.439 0.00 . 1 . . . . . 119 LYS N . 53266 1 123 . 1 . 1 81 81 ALA H H 1 7.546 0.00 . 1 . . . . . 120 ALA H . 53266 1 124 . 1 . 1 81 81 ALA N N 15 120.602 0.00 . 1 . . . . . 120 ALA N . 53266 1 125 . 1 . 1 82 82 TRP H H 1 8.142 0.00 . 1 . . . . . 121 TRP H . 53266 1 126 . 1 . 1 82 82 TRP HE1 H 1 9.854 0.00 . 1 . . . . . 121 TRP HE1 . 53266 1 127 . 1 . 1 82 82 TRP N N 15 120.393 0.00 . 1 . . . . . 121 TRP N . 53266 1 128 . 1 . 1 82 82 TRP NE1 N 15 124.674 0.00 . 1 . . . . . 121 TRP NE1 . 53266 1 129 . 1 . 1 84 84 GLY H H 1 7.484 0.00 . 1 . . . . . 123 GLY H . 53266 1 130 . 1 . 1 84 84 GLY N N 15 112.585 0.00 . 1 . . . . . 123 GLY N . 53266 1 131 . 1 . 1 85 85 GLU H H 1 8.674 0.00 . 1 . . . . . 124 GLU H . 53266 1 132 . 1 . 1 85 85 GLU N N 15 120.422 0.00 . 1 . . . . . 124 GLU N . 53266 1 133 . 1 . 1 87 87 ALA H H 1 8.222 0.00 . 1 . . . . . 126 ALA H . 53266 1 134 . 1 . 1 87 87 ALA N N 15 124.888 0.00 . 1 . . . . . 126 ALA N . 53266 1 135 . 1 . 1 88 88 LEU H H 1 7.857 0.00 . 1 . . . . . 127 LEU H . 53266 1 136 . 1 . 1 88 88 LEU N N 15 119.830 0.00 . 1 . . . . . 127 LEU N . 53266 1 137 . 1 . 1 89 89 GLU H H 1 8.297 0.00 . 1 . . . . . 128 GLU H . 53266 1 138 . 1 . 1 89 89 GLU N N 15 118.272 0.00 . 1 . . . . . 128 GLU N . 53266 1 139 . 1 . 1 90 90 GLU H H 1 7.811 0.00 . 1 . . . . . 129 GLU H . 53266 1 140 . 1 . 1 90 90 GLU N N 15 118.630 0.00 . 1 . . . . . 129 GLU N . 53266 1 141 . 1 . 1 91 91 LEU H H 1 7.710 0.00 . 1 . . . . . 130 LEU H . 53266 1 142 . 1 . 1 91 91 LEU N N 15 120.995 0.00 . 1 . . . . . 130 LEU N . 53266 1 143 . 1 . 1 92 92 CYS H H 1 8.141 0.00 . 1 . . . . . 131 CYS H . 53266 1 144 . 1 . 1 92 92 CYS N N 15 113.699 0.00 . 1 . . . . . 131 CYS N . 53266 1 145 . 1 . 1 93 93 ARG H H 1 7.825 0.00 . 1 . . . . . 132 ARG H . 53266 1 146 . 1 . 1 93 93 ARG N N 15 119.714 0.00 . 1 . . . . . 132 ARG N . 53266 1 147 . 1 . 1 94 94 LYS H H 1 7.588 0.00 . 1 . . . . . 133 LYS H . 53266 1 148 . 1 . 1 94 94 LYS N N 15 117.822 0.00 . 1 . . . . . 133 LYS N . 53266 1 149 . 1 . 1 95 95 THR H H 1 7.797 0.00 . 1 . . . . . 134 THR H . 53266 1 150 . 1 . 1 95 95 THR N N 15 113.134 0.00 . 1 . . . . . 134 THR N . 53266 1 151 . 1 . 1 96 96 LEU H H 1 6.826 0.00 . 1 . . . . . 135 LEU H . 53266 1 152 . 1 . 1 96 96 LEU N N 15 124.081 0.00 . 1 . . . . . 135 LEU N . 53266 1 153 . 1 . 1 98 98 THR H H 1 9.435 0.00 . 1 . . . . . 137 THR H . 53266 1 154 . 1 . 1 98 98 THR N N 15 114.005 0.00 . 1 . . . . . 137 THR N . 53266 1 155 . 1 . 1 99 99 ASN H H 1 9.309 0.00 . 1 . . . . . 138 ASN H . 53266 1 156 . 1 . 1 99 99 ASN N N 15 119.396 0.00 . 1 . . . . . 138 ASN N . 53266 1 157 . 1 . 1 105 105 ILE H H 1 8.375 0.00 . 1 . . . . . 144 ILE H . 53266 1 158 . 1 . 1 105 105 ILE N N 15 118.575 0.00 . 1 . . . . . 144 ILE N . 53266 1 159 . 1 . 1 106 106 HIS H H 1 9.111 0.00 . 1 . . . . . 145 HIS H . 53266 1 160 . 1 . 1 106 106 HIS N N 15 126.358 0.00 . 1 . . . . . 145 HIS N . 53266 1 161 . 1 . 1 107 107 ILE H H 1 9.043 0.00 . 1 . . . . . 146 ILE H . 53266 1 162 . 1 . 1 107 107 ILE N N 15 122.064 0.00 . 1 . . . . . 146 ILE N . 53266 1 163 . 1 . 1 108 108 TYR H H 1 8.822 0.00 . 1 . . . . . 147 TYR H . 53266 1 164 . 1 . 1 108 108 TYR N N 15 129.906 0.00 . 1 . . . . . 147 TYR N . 53266 1 165 . 1 . 1 109 109 VAL H H 1 8.853 0.00 . 1 . . . . . 148 VAL H . 53266 1 166 . 1 . 1 109 109 VAL N N 15 115.442 0.00 . 1 . . . . . 148 VAL N . 53266 1 167 . 1 . 1 110 110 LEU H H 1 8.412 0.00 . 1 . . . . . 149 LEU H . 53266 1 168 . 1 . 1 110 110 LEU N N 15 118.895 0.00 . 1 . . . . . 149 LEU N . 53266 1 169 . 1 . 1 111 111 SER H H 1 8.996 0.00 . 1 . . . . . 150 SER H . 53266 1 170 . 1 . 1 111 111 SER N N 15 113.192 0.00 . 1 . . . . . 150 SER N . 53266 1 171 . 1 . 1 123 123 PHE H H 1 7.067 0.00 . 1 . . . . . 162 PHE H . 53266 1 172 . 1 . 1 123 123 PHE N N 15 109.361 0.00 . 1 . . . . . 162 PHE N . 53266 1 173 . 1 . 1 124 124 GLU H H 1 9.468 0.00 . 1 . . . . . 163 GLU H . 53266 1 174 . 1 . 1 124 124 GLU N N 15 119.432 0.00 . 1 . . . . . 163 GLU N . 53266 1 175 . 1 . 1 125 125 GLU H H 1 9.009 0.00 . 1 . . . . . 164 GLU H . 53266 1 176 . 1 . 1 125 125 GLU N N 15 121.062 0.00 . 1 . . . . . 164 GLU N . 53266 1 177 . 1 . 1 126 126 ASN H H 1 9.519 0.00 . 1 . . . . . 165 ASN H . 53266 1 178 . 1 . 1 126 126 ASN N N 15 128.212 0.00 . 1 . . . . . 165 ASN N . 53266 1 179 . 1 . 1 127 127 GLY H H 1 8.659 0.00 . 1 . . . . . 166 GLY H . 53266 1 180 . 1 . 1 127 127 GLY N N 15 103.112 0.00 . 1 . . . . . 166 GLY N . 53266 1 181 . 1 . 1 128 128 LYS H H 1 7.694 0.00 . 1 . . . . . 167 LYS H . 53266 1 182 . 1 . 1 128 128 LYS N N 15 120.650 0.00 . 1 . . . . . 167 LYS N . 53266 1 183 . 1 . 1 129 129 GLY H H 1 8.954 0.00 . 1 . . . . . 168 GLY H . 53266 1 184 . 1 . 1 129 129 GLY N N 15 112.046 0.00 . 1 . . . . . 168 GLY N . 53266 1 185 . 1 . 1 130 130 ILE H H 1 7.955 0.00 . 1 . . . . . 169 ILE H . 53266 1 186 . 1 . 1 130 130 ILE N N 15 114.369 0.00 . 1 . . . . . 169 ILE N . 53266 1 187 . 1 . 1 131 131 ILE H H 1 7.539 0.00 . 1 . . . . . 170 ILE H . 53266 1 188 . 1 . 1 131 131 ILE N N 15 119.938 0.00 . 1 . . . . . 170 ILE N . 53266 1 189 . 1 . 1 132 132 ASP H H 1 8.209 0.00 . 1 . . . . . 171 ASP H . 53266 1 190 . 1 . 1 132 132 ASP N N 15 127.860 0.00 . 1 . . . . . 171 ASP N . 53266 1 191 . 1 . 1 134 134 GLN H H 1 8.999 0.00 . 1 . . . . . 173 GLN H . 53266 1 192 . 1 . 1 134 134 GLN N N 15 125.976 0.00 . 1 . . . . . 173 GLN N . 53266 1 193 . 1 . 1 137 137 ASN H H 1 9.465 0.00 . 1 . . . . . 176 ASN H . 53266 1 194 . 1 . 1 137 137 ASN N N 15 115.112 0.00 . 1 . . . . . 176 ASN N . 53266 1 195 . 1 . 1 138 138 SER H H 1 8.255 0.00 . 1 . . . . . 177 SER H . 53266 1 196 . 1 . 1 138 138 SER N N 15 111.602 0.00 . 1 . . . . . 177 SER N . 53266 1 197 . 1 . 1 139 139 TYR H H 1 7.799 0.00 . 1 . . . . . 178 TYR H . 53266 1 198 . 1 . 1 139 139 TYR N N 15 115.142 0.00 . 1 . . . . . 178 TYR N . 53266 1 199 . 1 . 1 140 140 VAL H H 1 7.264 0.00 . 1 . . . . . 179 VAL H . 53266 1 200 . 1 . 1 140 140 VAL N N 15 108.377 0.00 . 1 . . . . . 179 VAL N . 53266 1 201 . 1 . 1 143 143 LEU H H 1 7.643 0.00 . 1 . . . . . 182 LEU H . 53266 1 202 . 1 . 1 143 143 LEU N N 15 119.918 0.00 . 1 . . . . . 182 LEU N . 53266 1 203 . 1 . 1 144 144 GLY H H 1 8.828 0.00 . 1 . . . . . 183 GLY H . 53266 1 204 . 1 . 1 144 144 GLY N N 15 112.051 0.00 . 1 . . . . . 183 GLY N . 53266 1 205 . 1 . 1 146 146 CYS H H 1 8.250 0.00 . 1 . . . . . 185 CYS H . 53266 1 206 . 1 . 1 146 146 CYS N N 15 120.490 0.00 . 1 . . . . . 185 CYS N . 53266 1 207 . 1 . 1 148 148 ASN H H 1 8.386 0.00 . 1 . . . . . 187 ASN H . 53266 1 208 . 1 . 1 148 148 ASN N N 15 123.060 0.00 . 1 . . . . . 187 ASN N . 53266 1 209 . 1 . 1 149 149 HIS H H 1 9.153 0.00 . 1 . . . . . 188 HIS H . 53266 1 210 . 1 . 1 149 149 HIS N N 15 128.714 0.00 . 1 . . . . . 188 HIS N . 53266 1 211 . 1 . 1 150 150 LEU H H 1 8.593 0.00 . 1 . . . . . 189 LEU H . 53266 1 212 . 1 . 1 150 150 LEU N N 15 126.052 0.00 . 1 . . . . . 189 LEU N . 53266 1 213 . 1 . 1 152 152 CYS H H 1 8.048 0.00 . 1 . . . . . 191 CYS H . 53266 1 214 . 1 . 1 152 152 CYS N N 15 122.251 0.00 . 1 . . . . . 191 CYS N . 53266 1 215 . 1 . 1 155 155 ASP H H 1 8.430 0.00 . 1 . . . . . 194 ASP H . 53266 1 216 . 1 . 1 155 155 ASP N N 15 124.462 0.00 . 1 . . . . . 194 ASP N . 53266 1 217 . 1 . 1 156 156 LYS H H 1 7.893 0.00 . 1 . . . . . 195 LYS H . 53266 1 218 . 1 . 1 156 156 LYS N N 15 117.813 0.00 . 1 . . . . . 195 LYS N . 53266 1 219 . 1 . 1 157 157 CYS H H 1 7.230 0.00 . 1 . . . . . 196 CYS H . 53266 1 220 . 1 . 1 157 157 CYS N N 15 122.721 0.00 . 1 . . . . . 196 CYS N . 53266 1 221 . 1 . 1 159 159 TRP H H 1 8.294 0.00 . 1 . . . . . 198 TRP H . 53266 1 222 . 1 . 1 159 159 TRP HE1 H 1 9.713 0.00 . 1 . . . . . 198 TRP HE1 . 53266 1 223 . 1 . 1 159 159 TRP N N 15 120.987 0.00 . 1 . . . . . 198 TRP N . 53266 1 224 . 1 . 1 159 159 TRP NE1 N 15 128.989 0.00 . 1 . . . . . 198 TRP NE1 . 53266 1 225 . 1 . 1 160 160 LYS H H 1 6.650 0.00 . 1 . . . . . 199 LYS H . 53266 1 226 . 1 . 1 160 160 LYS N N 15 120.253 0.00 . 1 . . . . . 199 LYS N . 53266 1 227 . 1 . 1 161 161 GLU H H 1 8.080 0.00 . 1 . . . . . 200 GLU H . 53266 1 228 . 1 . 1 161 161 GLU N N 15 117.033 0.00 . 1 . . . . . 200 GLU N . 53266 1 229 . 1 . 1 163 163 ASN H H 1 8.432 0.00 . 1 . . . . . 202 ASN H . 53266 1 230 . 1 . 1 163 163 ASN N N 15 117.752 0.00 . 1 . . . . . 202 ASN N . 53266 1 231 . 1 . 1 164 164 TYR H H 1 8.193 0.00 . 1 . . . . . 203 TYR H . 53266 1 232 . 1 . 1 164 164 TYR N N 15 130.196 0.00 . 1 . . . . . 203 TYR N . 53266 1 233 . 1 . 1 165 165 THR H H 1 7.976 0.00 . 1 . . . . . 204 THR H . 53266 1 234 . 1 . 1 165 165 THR N N 15 125.557 0.00 . 1 . . . . . 204 THR N . 53266 1 235 . 1 . 1 166 166 THR H H 1 8.030 0.00 . 1 . . . . . 205 THR H . 53266 1 236 . 1 . 1 166 166 THR N N 15 113.113 0.00 . 1 . . . . . 205 THR N . 53266 1 237 . 1 . 1 167 167 CYS H H 1 8.461 0.00 . 1 . . . . . 206 CYS H . 53266 1 238 . 1 . 1 167 167 CYS N N 15 116.133 0.00 . 1 . . . . . 206 CYS N . 53266 1 239 . 1 . 1 171 171 TYR H H 1 7.883 0.00 . 1 . . . . . 210 TYR H . 53266 1 240 . 1 . 1 171 171 TYR N N 15 123.868 0.00 . 1 . . . . . 210 TYR N . 53266 1 241 . 1 . 1 172 172 ASN H H 1 9.251 0.00 . 1 . . . . . 211 ASN H . 53266 1 242 . 1 . 1 172 172 ASN N N 15 115.674 0.00 . 1 . . . . . 211 ASN N . 53266 1 243 . 1 . 1 173 173 GLU H H 1 9.747 0.00 . 1 . . . . . 212 GLU H . 53266 1 244 . 1 . 1 173 173 GLU N N 15 122.191 0.00 . 1 . . . . . 212 GLU N . 53266 1 245 . 1 . 1 174 174 LEU H H 1 8.642 0.00 . 1 . . . . . 213 LEU H . 53266 1 246 . 1 . 1 174 174 LEU N N 15 124.894 0.00 . 1 . . . . . 213 LEU N . 53266 1 247 . 1 . 1 175 175 LYS H H 1 6.723 0.00 . 1 . . . . . 214 LYS H . 53266 1 248 . 1 . 1 175 175 LYS N N 15 124.477 0.00 . 1 . . . . . 214 LYS N . 53266 1 249 . 1 . 1 176 176 GLU H H 1 7.973 0.00 . 1 . . . . . 215 GLU H . 53266 1 250 . 1 . 1 176 176 GLU N N 15 114.893 0.00 . 1 . . . . . 215 GLU N . 53266 1 251 . 1 . 1 177 177 ILE H H 1 8.274 0.00 . 1 . . . . . 216 ILE H . 53266 1 252 . 1 . 1 177 177 ILE N N 15 122.443 0.00 . 1 . . . . . 216 ILE N . 53266 1 253 . 1 . 1 178 178 SER H H 1 8.683 0.00 . 1 . . . . . 217 SER H . 53266 1 254 . 1 . 1 178 178 SER N N 15 124.622 0.00 . 1 . . . . . 217 SER N . 53266 1 255 . 1 . 1 179 179 LYS H H 1 8.352 0.00 . 1 . . . . . 218 LYS H . 53266 1 256 . 1 . 1 179 179 LYS N N 15 123.290 0.00 . 1 . . . . . 218 LYS N . 53266 1 257 . 1 . 1 180 180 VAL H H 1 9.014 0.00 . 1 . . . . . 219 VAL H . 53266 1 258 . 1 . 1 180 180 VAL N N 15 120.576 0.00 . 1 . . . . . 219 VAL N . 53266 1 259 . 1 . 1 182 182 LEU H H 1 8.213 0.00 . 1 . . . . . 221 LEU H . 53266 1 260 . 1 . 1 182 182 LEU N N 15 129.343 0.00 . 1 . . . . . 221 LEU N . 53266 1 261 . 1 . 1 183 183 LYS H H 1 8.805 0.00 . 1 . . . . . 222 LYS H . 53266 1 262 . 1 . 1 183 183 LYS N N 15 118.261 0.00 . 1 . . . . . 222 LYS N . 53266 1 263 . 1 . 1 184 184 SER H H 1 7.858 0.00 . 1 . . . . . 223 SER H . 53266 1 264 . 1 . 1 184 184 SER N N 15 114.419 0.00 . 1 . . . . . 223 SER N . 53266 1 265 . 1 . 1 185 185 LEU H H 1 7.967 0.00 . 1 . . . . . 224 LEU H . 53266 1 266 . 1 . 1 185 185 LEU N N 15 124.707 0.00 . 1 . . . . . 224 LEU N . 53266 1 267 . 1 . 1 186 186 LEU H H 1 8.770 0.00 . 1 . . . . . 225 LEU H . 53266 1 268 . 1 . 1 186 186 LEU N N 15 118.568 0.00 . 1 . . . . . 225 LEU N . 53266 1 269 . 1 . 1 187 187 ARG H H 1 8.439 0.00 . 1 . . . . . 226 ARG H . 53266 1 270 . 1 . 1 187 187 ARG N N 15 119.318 0.00 . 1 . . . . . 226 ARG N . 53266 1 271 . 1 . 1 188 188 PHE H H 1 8.168 0.00 . 1 . . . . . 227 PHE H . 53266 1 272 . 1 . 1 188 188 PHE N N 15 122.913 0.00 . 1 . . . . . 227 PHE N . 53266 1 273 . 1 . 1 189 189 LEU H H 1 8.445 0.00 . 1 . . . . . 228 LEU H . 53266 1 274 . 1 . 1 189 189 LEU N N 15 119.316 0.00 . 1 . . . . . 228 LEU N . 53266 1 275 . 1 . 1 190 190 ALA H H 1 9.102 0.00 . 1 . . . . . 229 ALA H . 53266 1 276 . 1 . 1 190 190 ALA N N 15 123.522 0.00 . 1 . . . . . 229 ALA N . 53266 1 277 . 1 . 1 191 191 GLU H H 1 8.590 0.00 . 1 . . . . . 230 GLU H . 53266 1 278 . 1 . 1 191 191 GLU N N 15 121.678 0.00 . 1 . . . . . 230 GLU N . 53266 1 279 . 1 . 1 192 192 LYS H H 1 8.023 0.00 . 1 . . . . . 231 LYS H . 53266 1 280 . 1 . 1 192 192 LYS N N 15 116.515 0.00 . 1 . . . . . 231 LYS N . 53266 1 281 . 1 . 1 193 193 GLY H H 1 8.276 0.00 . 1 . . . . . 232 GLY H . 53266 1 282 . 1 . 1 193 193 GLY N N 15 104.392 0.00 . 1 . . . . . 232 GLY N . 53266 1 283 . 1 . 1 194 194 LYS H H 1 7.431 0.00 . 1 . . . . . 233 LYS H . 53266 1 284 . 1 . 1 194 194 LYS N N 15 122.356 0.00 . 1 . . . . . 233 LYS N . 53266 1 285 . 1 . 1 196 196 LEU H H 1 7.375 0.00 . 1 . . . . . 235 LEU H . 53266 1 286 . 1 . 1 196 196 LEU N N 15 118.024 0.00 . 1 . . . . . 235 LEU N . 53266 1 287 . 1 . 1 197 197 GLY H H 1 7.727 0.00 . 1 . . . . . 236 GLY H . 53266 1 288 . 1 . 1 197 197 GLY N N 15 107.307 0.00 . 1 . . . . . 236 GLY N . 53266 1 289 . 1 . 1 198 198 ILE H H 1 7.436 0.00 . 1 . . . . . 237 ILE H . 53266 1 290 . 1 . 1 198 198 ILE N N 15 122.354 0.00 . 1 . . . . . 237 ILE N . 53266 1 291 . 1 . 1 199 199 THR H H 1 8.992 0.00 . 1 . . . . . 238 THR H . 53266 1 292 . 1 . 1 199 199 THR N N 15 118.202 0.00 . 1 . . . . . 238 THR N . 53266 1 293 . 1 . 1 200 200 LEU H H 1 8.808 0.00 . 1 . . . . . 239 LEU H . 53266 1 294 . 1 . 1 200 200 LEU N N 15 125.302 0.00 . 1 . . . . . 239 LEU N . 53266 1 295 . 1 . 1 201 201 SER H H 1 7.958 0.00 . 1 . . . . . 240 SER H . 53266 1 296 . 1 . 1 201 201 SER N N 15 119.208 0.00 . 1 . . . . . 240 SER N . 53266 1 297 . 1 . 1 202 202 LYS H H 1 8.989 0.00 . 1 . . . . . 241 LYS H . 53266 1 298 . 1 . 1 202 202 LYS N N 15 123.207 0.00 . 1 . . . . . 241 LYS N . 53266 1 299 . 1 . 1 203 203 THR H H 1 8.291 0.00 . 1 . . . . . 242 THR H . 53266 1 300 . 1 . 1 203 203 THR N N 15 112.912 0.00 . 1 . . . . . 242 THR N . 53266 1 301 . 1 . 1 204 204 ALA H H 1 7.711 0.00 . 1 . . . . . 243 ALA H . 53266 1 302 . 1 . 1 204 204 ALA N N 15 124.912 0.00 . 1 . . . . . 243 ALA N . 53266 1 303 . 1 . 1 205 205 LYS H H 1 8.638 0.00 . 1 . . . . . 244 LYS H . 53266 1 304 . 1 . 1 205 205 LYS N N 15 118.727 0.00 . 1 . . . . . 244 LYS N . 53266 1 305 . 1 . 1 206 206 GLU H H 1 8.024 0.00 . 1 . . . . . 245 GLU H . 53266 1 306 . 1 . 1 206 206 GLU N N 15 117.628 0.00 . 1 . . . . . 245 GLU N . 53266 1 307 . 1 . 1 207 207 TRP H H 1 7.516 0.00 . 1 . . . . . 246 TRP H . 53266 1 308 . 1 . 1 207 207 TRP HE1 H 1 10.521 0.00 . 1 . . . . . 246 TRP HE1 . 53266 1 309 . 1 . 1 207 207 TRP N N 15 118.940 0.00 . 1 . . . . . 246 TRP N . 53266 1 310 . 1 . 1 207 207 TRP NE1 N 15 131.838 0.00 . 1 . . . . . 246 TRP NE1 . 53266 1 311 . 1 . 1 209 209 GLU H H 1 8.178 0.00 . 1 . . . . . 248 GLU H . 53266 1 312 . 1 . 1 209 209 GLU N N 15 115.045 0.00 . 1 . . . . . 248 GLU N . 53266 1 313 . 1 . 1 210 210 GLY H H 1 7.487 0.00 . 1 . . . . . 249 GLY H . 53266 1 314 . 1 . 1 210 210 GLY N N 15 108.242 0.00 . 1 . . . . . 249 GLY N . 53266 1 315 . 1 . 1 211 211 LYS H H 1 8.013 0.00 . 1 . . . . . 250 LYS H . 53266 1 316 . 1 . 1 211 211 LYS N N 15 120.258 0.00 . 1 . . . . . 250 LYS N . 53266 1 317 . 1 . 1 212 212 LYS H H 1 8.405 0.00 . 1 . . . . . 251 LYS H . 53266 1 318 . 1 . 1 212 212 LYS N N 15 123.928 0.00 . 1 . . . . . 251 LYS N . 53266 1 319 . 1 . 1 213 213 GLU H H 1 8.600 0.00 . 1 . . . . . 252 GLU H . 53266 1 320 . 1 . 1 213 213 GLU N N 15 122.976 0.00 . 1 . . . . . 252 GLU N . 53266 1 321 . 1 . 1 218 218 VAL H H 1 8.118 0.00 . 1 . . . . . 257 VAL H . 53266 1 322 . 1 . 1 218 218 VAL N N 15 123.087 0.00 . 1 . . . . . 257 VAL N . 53266 1 323 . 1 . 1 219 219 VAL H H 1 8.110 0.00 . 1 . . . . . 258 VAL H . 53266 1 324 . 1 . 1 219 219 VAL N N 15 124.234 0.00 . 1 . . . . . 258 VAL N . 53266 1 325 . 1 . 1 220 220 GLU H H 1 8.520 0.00 . 1 . . . . . 259 GLU H . 53266 1 326 . 1 . 1 220 220 GLU N N 15 124.080 0.00 . 1 . . . . . 259 GLU N . 53266 1 327 . 1 . 1 224 224 LEU H H 1 7.771 0.00 . 1 . . . . . 263 LEU H . 53266 1 328 . 1 . 1 224 224 LEU N N 15 122.719 0.00 . 1 . . . . . 263 LEU N . 53266 1 329 . 1 . 1 225 225 ARG H H 1 8.683 0.00 . 1 . . . . . 264 ARG H . 53266 1 330 . 1 . 1 225 225 ARG N N 15 118.792 0.00 . 1 . . . . . 264 ARG N . 53266 1 331 . 1 . 1 226 226 LYS H H 1 7.468 0.00 . 1 . . . . . 265 LYS H . 53266 1 332 . 1 . 1 226 226 LYS N N 15 115.796 0.00 . 1 . . . . . 265 LYS N . 53266 1 333 . 1 . 1 228 228 LEU H H 1 8.223 0.00 . 1 . . . . . 267 LEU H . 53266 1 334 . 1 . 1 228 228 LEU N N 15 118.605 0.00 . 1 . . . . . 267 LEU N . 53266 1 335 . 1 . 1 229 229 VAL H H 1 8.589 0.00 . 1 . . . . . 268 VAL H . 53266 1 336 . 1 . 1 229 229 VAL N N 15 119.122 0.00 . 1 . . . . . 268 VAL N . 53266 1 337 . 1 . 1 230 230 LYS H H 1 7.296 0.00 . 1 . . . . . 269 LYS H . 53266 1 338 . 1 . 1 230 230 LYS N N 15 119.551 0.00 . 1 . . . . . 269 LYS N . 53266 1 339 . 1 . 1 231 231 ARG H H 1 7.283 0.00 . 1 . . . . . 270 ARG H . 53266 1 340 . 1 . 1 231 231 ARG N N 15 115.351 0.00 . 1 . . . . . 270 ARG N . 53266 1 341 . 1 . 1 232 232 ASP H H 1 6.924 0.00 . 1 . . . . . 271 ASP H . 53266 1 342 . 1 . 1 232 232 ASP N N 15 121.871 0.00 . 1 . . . . . 271 ASP N . 53266 1 343 . 1 . 1 233 233 SER H H 1 8.815 0.00 . 1 . . . . . 272 SER H . 53266 1 344 . 1 . 1 233 233 SER N N 15 118.812 0.00 . 1 . . . . . 272 SER N . 53266 1 345 . 1 . 1 234 234 GLY H H 1 8.957 0.00 . 1 . . . . . 273 GLY H . 53266 1 346 . 1 . 1 234 234 GLY N N 15 111.558 0.00 . 1 . . . . . 273 GLY N . 53266 1 347 . 1 . 1 235 235 LYS H H 1 7.860 0.00 . 1 . . . . . 274 LYS H . 53266 1 348 . 1 . 1 235 235 LYS N N 15 121.397 0.00 . 1 . . . . . 274 LYS N . 53266 1 349 . 1 . 1 237 237 VAL H H 1 8.972 0.00 . 1 . . . . . 276 VAL H . 53266 1 350 . 1 . 1 237 237 VAL N N 15 122.447 0.00 . 1 . . . . . 276 VAL N . 53266 1 351 . 1 . 1 238 238 GLU H H 1 9.347 0.00 . 1 . . . . . 277 GLU H . 53266 1 352 . 1 . 1 238 238 GLU N N 15 117.654 0.00 . 1 . . . . . 277 GLU N . 53266 1 353 . 1 . 1 239 239 LYS H H 1 7.087 0.00 . 1 . . . . . 278 LYS H . 53266 1 354 . 1 . 1 239 239 LYS N N 15 119.161 0.00 . 1 . . . . . 278 LYS N . 53266 1 355 . 1 . 1 240 240 ILE H H 1 8.061 0.00 . 1 . . . . . 279 ILE H . 53266 1 356 . 1 . 1 240 240 ILE N N 15 122.631 0.00 . 1 . . . . . 279 ILE N . 53266 1 357 . 1 . 1 241 241 LYS H H 1 8.162 0.00 . 1 . . . . . 280 LYS H . 53266 1 358 . 1 . 1 241 241 LYS N N 15 116.665 0.00 . 1 . . . . . 280 LYS N . 53266 1 359 . 1 . 1 242 242 GLU H H 1 7.321 0.00 . 1 . . . . . 281 GLU H . 53266 1 360 . 1 . 1 242 242 GLU N N 15 118.388 0.00 . 1 . . . . . 281 GLU N . 53266 1 361 . 1 . 1 243 243 GLU H H 1 8.350 0.00 . 1 . . . . . 282 GLU H . 53266 1 362 . 1 . 1 243 243 GLU N N 15 119.625 0.00 . 1 . . . . . 282 GLU N . 53266 1 363 . 1 . 1 244 244 ILE H H 1 8.353 0.00 . 1 . . . . . 283 ILE H . 53266 1 364 . 1 . 1 244 244 ILE N N 15 117.230 0.00 . 1 . . . . . 283 ILE N . 53266 1 365 . 1 . 1 245 245 CYS H H 1 8.422 0.00 . 1 . . . . . 284 CYS H . 53266 1 366 . 1 . 1 245 245 CYS N N 15 114.033 0.00 . 1 . . . . . 284 CYS N . 53266 1 367 . 1 . 1 246 246 THR H H 1 7.677 0.00 . 1 . . . . . 285 THR H . 53266 1 368 . 1 . 1 246 246 THR N N 15 109.973 0.00 . 1 . . . . . 285 THR N . 53266 1 369 . 1 . 1 247 247 LYS H H 1 7.060 0.00 . 1 . . . . . 286 LYS H . 53266 1 370 . 1 . 1 247 247 LYS N N 15 122.536 0.00 . 1 . . . . . 286 LYS N . 53266 1 371 . 1 . 1 256 256 ILE H H 1 8.064 0.00 . 1 . . . . . 295 ILE H . 53266 1 372 . 1 . 1 256 256 ILE N N 15 115.884 0.00 . 1 . . . . . 295 ILE N . 53266 1 373 . 1 . 1 257 257 ILE H H 1 8.586 0.00 . 1 . . . . . 296 ILE H . 53266 1 374 . 1 . 1 257 257 ILE N N 15 116.219 0.00 . 1 . . . . . 296 ILE N . 53266 1 375 . 1 . 1 258 258 CYS H H 1 7.505 0.00 . 1 . . . . . 297 CYS H . 53266 1 376 . 1 . 1 258 258 CYS N N 15 116.147 0.00 . 1 . . . . . 297 CYS N . 53266 1 377 . 1 . 1 259 259 GLU H H 1 7.539 0.00 . 1 . . . . . 298 GLU H . 53266 1 378 . 1 . 1 259 259 GLU N N 15 116.157 0.00 . 1 . . . . . 298 GLU N . 53266 1 379 . 1 . 1 260 260 ASN H H 1 7.021 0.00 . 1 . . . . . 299 ASN H . 53266 1 380 . 1 . 1 260 260 ASN HD22 H 1 7.419 0.00 . 1 . . . . . 299 ASN HD22 . 53266 1 381 . 1 . 1 260 260 ASN N N 15 113.548 0.00 . 1 . . . . . 299 ASN N . 53266 1 382 . 1 . 1 260 260 ASN ND2 N 15 111.424 0.00 . 1 . . . . . 299 ASN ND2 . 53266 1 383 . 1 . 1 261 261 LYS H H 1 8.134 0.00 . 1 . . . . . 300 LYS H . 53266 1 384 . 1 . 1 261 261 LYS N N 15 117.753 0.00 . 1 . . . . . 300 LYS N . 53266 1 385 . 1 . 1 262 262 THR H H 1 8.452 0.00 . 1 . . . . . 301 THR H . 53266 1 386 . 1 . 1 262 262 THR N N 15 108.410 0.00 . 1 . . . . . 301 THR N . 53266 1 387 . 1 . 1 263 263 TYR H H 1 9.769 0.00 . 1 . . . . . 302 TYR H . 53266 1 388 . 1 . 1 263 263 TYR N N 15 122.848 0.00 . 1 . . . . . 302 TYR N . 53266 1 389 . 1 . 1 264 264 ALA H H 1 8.840 0.00 . 1 . . . . . 303 ALA H . 53266 1 390 . 1 . 1 264 264 ALA N N 15 121.381 0.00 . 1 . . . . . 303 ALA N . 53266 1 391 . 1 . 1 265 265 ASP H H 1 7.799 0.00 . 1 . . . . . 304 ASP H . 53266 1 392 . 1 . 1 265 265 ASP N N 15 117.197 0.00 . 1 . . . . . 304 ASP N . 53266 1 393 . 1 . 1 267 267 ASN H H 1 8.051 0.00 . 1 . . . . . 306 ASN H . 53266 1 394 . 1 . 1 267 267 ASN N N 15 117.800 0.00 . 1 . . . . . 306 ASN N . 53266 1 395 . 1 . 1 268 268 ILE H H 1 7.755 0.00 . 1 . . . . . 307 ILE H . 53266 1 396 . 1 . 1 268 268 ILE N N 15 119.352 0.00 . 1 . . . . . 307 ILE N . 53266 1 397 . 1 . 1 269 269 ASP H H 1 7.937 0.00 . 1 . . . . . 308 ASP H . 53266 1 398 . 1 . 1 269 269 ASP N N 15 123.421 0.00 . 1 . . . . . 308 ASP N . 53266 1 399 . 1 . 1 270 270 ARG H H 1 9.897 0.00 . 1 . . . . . 309 ARG H . 53266 1 400 . 1 . 1 270 270 ARG N N 15 121.695 0.00 . 1 . . . . . 309 ARG N . 53266 1 401 . 1 . 1 271 271 SER H H 1 9.562 0.00 . 1 . . . . . 310 SER H . 53266 1 402 . 1 . 1 271 271 SER N N 15 113.533 0.00 . 1 . . . . . 310 SER N . 53266 1 403 . 1 . 1 272 272 ARG H H 1 7.785 0.00 . 1 . . . . . 311 ARG H . 53266 1 404 . 1 . 1 272 272 ARG N N 15 129.292 0.00 . 1 . . . . . 311 ARG N . 53266 1 405 . 1 . 1 273 273 GLY H H 1 8.054 0.00 . 1 . . . . . 312 GLY H . 53266 1 406 . 1 . 1 273 273 GLY N N 15 110.031 0.00 . 1 . . . . . 312 GLY N . 53266 1 407 . 1 . 1 274 274 ASP H H 1 8.519 0.00 . 1 . . . . . 313 ASP H . 53266 1 408 . 1 . 1 274 274 ASP N N 15 119.949 0.00 . 1 . . . . . 313 ASP N . 53266 1 409 . 1 . 1 275 275 TRP H H 1 7.991 0.00 . 1 . . . . . 314 TRP H . 53266 1 410 . 1 . 1 275 275 TRP N N 15 118.499 0.00 . 1 . . . . . 314 TRP N . 53266 1 411 . 1 . 1 276 276 HIS H H 1 8.488 0.00 . 1 . . . . . 315 HIS H . 53266 1 412 . 1 . 1 276 276 HIS N N 15 113.913 0.00 . 1 . . . . . 315 HIS N . 53266 1 413 . 1 . 1 278 278 ILE H H 1 8.834 0.00 . 1 . . . . . 317 ILE H . 53266 1 414 . 1 . 1 278 278 ILE N N 15 119.791 0.00 . 1 . . . . . 317 ILE N . 53266 1 415 . 1 . 1 279 279 LEU H H 1 8.228 0.00 . 1 . . . . . 318 LEU H . 53266 1 416 . 1 . 1 279 279 LEU N N 15 119.230 0.00 . 1 . . . . . 318 LEU N . 53266 1 417 . 1 . 1 280 280 TYR H H 1 7.537 0.00 . 1 . . . . . 319 TYR H . 53266 1 418 . 1 . 1 280 280 TYR N N 15 117.379 0.00 . 1 . . . . . 319 TYR N . 53266 1 419 . 1 . 1 281 281 LEU H H 1 8.783 0.00 . 1 . . . . . 320 LEU H . 53266 1 420 . 1 . 1 281 281 LEU N N 15 121.194 0.00 . 1 . . . . . 320 LEU N . 53266 1 421 . 1 . 1 282 282 MET H H 1 8.939 0.00 . 1 . . . . . 321 MET H . 53266 1 422 . 1 . 1 282 282 MET N N 15 119.131 0.00 . 1 . . . . . 321 MET N . 53266 1 423 . 1 . 1 285 285 GLY H H 1 7.676 0.00 . 1 . . . . . 324 GLY H . 53266 1 424 . 1 . 1 285 285 GLY N N 15 106.988 0.00 . 1 . . . . . 324 GLY N . 53266 1 425 . 1 . 1 286 286 VAL H H 1 8.255 0.00 . 1 . . . . . 325 VAL H . 53266 1 426 . 1 . 1 286 286 VAL N N 15 124.269 0.00 . 1 . . . . . 325 VAL N . 53266 1 427 . 1 . 1 287 287 THR H H 1 8.043 0.00 . 1 . . . . . 326 THR H . 53266 1 428 . 1 . 1 287 287 THR N N 15 110.750 0.00 . 1 . . . . . 326 THR N . 53266 1 429 . 1 . 1 288 288 ASP H H 1 7.622 0.00 . 1 . . . . . 327 ASP H . 53266 1 430 . 1 . 1 288 288 ASP N N 15 121.152 0.00 . 1 . . . . . 327 ASP N . 53266 1 431 . 1 . 1 290 290 ASP H H 1 8.266 0.00 . 1 . . . . . 329 ASP H . 53266 1 432 . 1 . 1 290 290 ASP N N 15 116.173 0.00 . 1 . . . . . 329 ASP N . 53266 1 433 . 1 . 1 291 291 LYS H H 1 7.401 0.00 . 1 . . . . . 330 LYS H . 53266 1 434 . 1 . 1 291 291 LYS N N 15 121.012 0.00 . 1 . . . . . 330 LYS N . 53266 1 435 . 1 . 1 292 292 ILE H H 1 7.780 0.00 . 1 . . . . . 331 ILE H . 53266 1 436 . 1 . 1 292 292 ILE N N 15 116.756 0.00 . 1 . . . . . 331 ILE N . 53266 1 437 . 1 . 1 293 293 LEU H H 1 8.111 0.00 . 1 . . . . . 332 LEU H . 53266 1 438 . 1 . 1 293 293 LEU N N 15 116.564 0.00 . 1 . . . . . 332 LEU N . 53266 1 439 . 1 . 1 294 294 GLU H H 1 7.119 0.00 . 1 . . . . . 333 GLU H . 53266 1 440 . 1 . 1 294 294 GLU N N 15 115.716 0.00 . 1 . . . . . 333 GLU N . 53266 1 441 . 1 . 1 295 295 LEU H H 1 7.409 0.00 . 1 . . . . . 334 LEU H . 53266 1 442 . 1 . 1 295 295 LEU N N 15 118.314 0.00 . 1 . . . . . 334 LEU N . 53266 1 443 . 1 . 1 296 296 LEU H H 1 7.237 0.00 . 1 . . . . . 335 LEU H . 53266 1 444 . 1 . 1 296 296 LEU N N 15 119.400 0.00 . 1 . . . . . 335 LEU N . 53266 1 445 . 1 . 1 298 298 ARG H H 1 8.519 0.00 . 1 . . . . . 337 ARG H . 53266 1 446 . 1 . 1 298 298 ARG N N 15 115.381 0.00 . 1 . . . . . 337 ARG N . 53266 1 447 . 1 . 1 299 299 ASP H H 1 8.101 0.00 . 1 . . . . . 338 ASP H . 53266 1 448 . 1 . 1 299 299 ASP N N 15 112.638 0.00 . 1 . . . . . 338 ASP N . 53266 1 449 . 1 . 1 300 300 SER H H 1 7.626 0.00 . 1 . . . . . 339 SER H . 53266 1 450 . 1 . 1 300 300 SER N N 15 112.864 0.00 . 1 . . . . . 339 SER N . 53266 1 451 . 1 . 1 302 302 ALA H H 1 8.498 0.00 . 1 . . . . . 341 ALA H . 53266 1 452 . 1 . 1 302 302 ALA N N 15 118.369 0.00 . 1 . . . . . 341 ALA N . 53266 1 453 . 1 . 1 303 303 LYS H H 1 7.446 0.00 . 1 . . . . . 342 LYS H . 53266 1 454 . 1 . 1 303 303 LYS N N 15 115.707 0.00 . 1 . . . . . 342 LYS N . 53266 1 455 . 1 . 1 304 304 GLU H H 1 8.121 0.00 . 1 . . . . . 343 GLU H . 53266 1 456 . 1 . 1 304 304 GLU N N 15 120.940 0.00 . 1 . . . . . 343 GLU N . 53266 1 457 . 1 . 1 305 305 ASN H H 1 8.929 0.00 . 1 . . . . . 344 ASN H . 53266 1 458 . 1 . 1 305 305 ASN N N 15 124.706 0.00 . 1 . . . . . 344 ASN N . 53266 1 459 . 1 . 1 306 306 GLU H H 1 10.709 0.00 . 1 . . . . . 345 GLU H . 53266 1 460 . 1 . 1 306 306 GLU N N 15 127.750 0.00 . 1 . . . . . 345 GLU N . 53266 1 461 . 1 . 1 307 307 LYS H H 1 9.010 0.00 . 1 . . . . . 346 LYS H . 53266 1 462 . 1 . 1 307 307 LYS N N 15 122.750 0.00 . 1 . . . . . 346 LYS N . 53266 1 463 . 1 . 1 308 308 TRP H H 1 7.723 0.00 . 1 . . . . . 347 TRP H . 53266 1 464 . 1 . 1 308 308 TRP HE1 H 1 10.872 0.00 . 1 . . . . . 347 TRP HE1 . 53266 1 465 . 1 . 1 308 308 TRP N N 15 121.251 0.00 . 1 . . . . . 347 TRP N . 53266 1 466 . 1 . 1 308 308 TRP NE1 N 15 129.836 0.00 . 1 . . . . . 347 TRP NE1 . 53266 1 467 . 1 . 1 309 309 ASN H H 1 6.636 0.00 . 1 . . . . . 348 ASN H . 53266 1 468 . 1 . 1 309 309 ASN N N 15 117.185 0.00 . 1 . . . . . 348 ASN N . 53266 1 469 . 1 . 1 310 310 THR H H 1 8.586 0.00 . 1 . . . . . 349 THR H . 53266 1 470 . 1 . 1 310 310 THR N N 15 118.592 0.00 . 1 . . . . . 349 THR N . 53266 1 471 . 1 . 1 311 311 GLN H H 1 7.672 0.00 . 1 . . . . . 350 GLN H . 53266 1 472 . 1 . 1 311 311 GLN N N 15 121.426 0.00 . 1 . . . . . 350 GLN N . 53266 1 473 . 1 . 1 312 312 LYS H H 1 7.537 0.00 . 1 . . . . . 351 LYS H . 53266 1 474 . 1 . 1 312 312 LYS N N 15 119.389 0.00 . 1 . . . . . 351 LYS N . 53266 1 475 . 1 . 1 313 313 TYR H H 1 7.889 0.00 . 1 . . . . . 352 TYR H . 53266 1 476 . 1 . 1 313 313 TYR N N 15 117.813 0.00 . 1 . . . . . 352 TYR N . 53266 1 477 . 1 . 1 314 314 PHE H H 1 8.850 0.00 . 1 . . . . . 353 PHE H . 53266 1 478 . 1 . 1 314 314 PHE N N 15 124.086 0.00 . 1 . . . . . 353 PHE N . 53266 1 479 . 1 . 1 315 315 VAL H H 1 8.463 0.00 . 1 . . . . . 354 VAL H . 53266 1 480 . 1 . 1 315 315 VAL N N 15 117.365 0.00 . 1 . . . . . 354 VAL N . 53266 1 481 . 1 . 1 316 316 ILE H H 1 8.088 0.00 . 1 . . . . . 355 ILE H . 53266 1 482 . 1 . 1 316 316 ILE N N 15 120.281 0.00 . 1 . . . . . 355 ILE N . 53266 1 483 . 1 . 1 317 317 THR H H 1 7.770 0.00 . 1 . . . . . 356 THR H . 53266 1 484 . 1 . 1 317 317 THR N N 15 118.480 0.00 . 1 . . . . . 356 THR N . 53266 1 485 . 1 . 1 318 318 LEU H H 1 8.676 0.00 . 1 . . . . . 357 LEU H . 53266 1 486 . 1 . 1 318 318 LEU N N 15 119.569 0.00 . 1 . . . . . 357 LEU N . 53266 1 487 . 1 . 1 319 319 SER H H 1 8.340 0.00 . 1 . . . . . 358 SER H . 53266 1 488 . 1 . 1 319 319 SER N N 15 113.160 0.00 . 1 . . . . . 358 SER N . 53266 1 489 . 1 . 1 320 320 LYS H H 1 8.554 0.00 . 1 . . . . . 359 LYS H . 53266 1 490 . 1 . 1 320 320 LYS N N 15 122.412 0.00 . 1 . . . . . 359 LYS N . 53266 1 491 . 1 . 1 321 321 ALA H H 1 8.750 0.00 . 1 . . . . . 360 ALA H . 53266 1 492 . 1 . 1 321 321 ALA N N 15 124.036 0.00 . 1 . . . . . 360 ALA N . 53266 1 493 . 1 . 1 322 322 TRP HE1 H 1 10.057 0.00 . 1 . . . . . 361 TRP HE1 . 53266 1 494 . 1 . 1 322 322 TRP NE1 N 15 127.002 0.00 . 1 . . . . . 361 TRP NE1 . 53266 1 495 . 1 . 1 323 323 SER H H 1 7.669 0.00 . 1 . . . . . 362 SER H . 53266 1 496 . 1 . 1 323 323 SER N N 15 112.534 0.00 . 1 . . . . . 362 SER N . 53266 1 497 . 1 . 1 324 324 VAL H H 1 7.272 0.00 . 1 . . . . . 363 VAL H . 53266 1 498 . 1 . 1 324 324 VAL N N 15 120.602 0.00 . 1 . . . . . 363 VAL N . 53266 1 499 . 1 . 1 325 325 VAL H H 1 8.402 0.00 . 1 . . . . . 364 VAL H . 53266 1 500 . 1 . 1 325 325 VAL N N 15 122.097 0.00 . 1 . . . . . 364 VAL N . 53266 1 501 . 1 . 1 326 326 LYS H H 1 8.692 0.00 . 1 . . . . . 365 LYS H . 53266 1 502 . 1 . 1 326 326 LYS N N 15 121.071 0.00 . 1 . . . . . 365 LYS N . 53266 1 503 . 1 . 1 327 327 LYS H H 1 6.892 0.00 . 1 . . . . . 366 LYS H . 53266 1 504 . 1 . 1 327 327 LYS N N 15 116.906 0.00 . 1 . . . . . 366 LYS N . 53266 1 505 . 1 . 1 328 328 TYR H H 1 7.581 0.00 . 1 . . . . . 367 TYR H . 53266 1 506 . 1 . 1 328 328 TYR N N 15 122.062 0.00 . 1 . . . . . 367 TYR N . 53266 1 507 . 1 . 1 329 329 LEU H H 1 8.389 0.00 . 1 . . . . . 368 LEU H . 53266 1 508 . 1 . 1 329 329 LEU N N 15 121.810 0.00 . 1 . . . . . 368 LEU N . 53266 1 509 . 1 . 1 330 330 GLU H H 1 7.750 0.00 . 1 . . . . . 369 GLU H . 53266 1 510 . 1 . 1 330 330 GLU N N 15 119.352 0.00 . 1 . . . . . 369 GLU N . 53266 1 511 . 1 . 1 331 331 ALA H H 1 7.514 0.00 . 1 . . . . . 370 ALA H . 53266 1 512 . 1 . 1 331 331 ALA N N 15 121.417 0.00 . 1 . . . . . 370 ALA N . 53266 1 stop_ save_