################################### # 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 50576 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name nic_NfsB _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.03 _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 'variation in a series of spectra' _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' . . . 50576 1 2 '1D 1H' . . . 50576 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50576 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 3 3 ILE H H 1 8.5337 0.01 . . . . . . . 3 I HN . 50576 1 2 . 1 . 1 3 3 ILE N N 15 122.0015 0.03 . . . . . . . 3 I N . 50576 1 3 . 1 . 1 4 4 ILE H H 1 7.7826 0.01 . . . . . . . 4 I HN . 50576 1 4 . 1 . 1 4 4 ILE N N 15 123.5966 0.03 . . . . . . . 4 I N . 50576 1 5 . 1 . 1 5 5 SER H H 1 7.6255 0.01 . . . . . . . 5 S HN . 50576 1 6 . 1 . 1 5 5 SER N N 15 115.3560 0.03 . . . . . . . 5 S N . 50576 1 7 . 1 . 1 6 6 VAL H H 1 7.2188 0.01 . . . . . . . 6 V HN . 50576 1 8 . 1 . 1 6 6 VAL N N 15 119.3775 0.03 . . . . . . . 6 V N . 50576 1 9 . 1 . 1 7 7 ALA H H 1 8.1316 0.01 . . . . . . . 7 A HN . 50576 1 10 . 1 . 1 7 7 ALA N N 15 123.2978 0.03 . . . . . . . 7 A N . 50576 1 11 . 1 . 1 8 8 LEU H H 1 7.8463 0.01 . . . . . . . 8 L HN . 50576 1 12 . 1 . 1 8 8 LEU N N 15 114.1731 0.03 . . . . . . . 8 L N . 50576 1 13 . 1 . 1 9 9 LYS H H 1 7.5031 0.01 . . . . . . . 9 K HN . 50576 1 14 . 1 . 1 9 9 LYS N N 15 117.3095 0.03 . . . . . . . 9 K N . 50576 1 15 . 1 . 1 10 10 ARG H H 1 7.9636 0.01 . . . . . . . 10 R HN . 50576 1 16 . 1 . 1 10 10 ARG N N 15 118.8055 0.03 . . . . . . . 10 R N . 50576 1 17 . 1 . 1 12 12 SER H H 1 10.0861 0.01 . . . . . . . 12 S HN . 50576 1 18 . 1 . 1 12 12 SER N N 15 121.2057 0.03 . . . . . . . 12 S N . 50576 1 19 . 1 . 1 13 13 THR H H 1 7.6004 0.01 . . . . . . . 13 T HN . 50576 1 20 . 1 . 1 13 13 THR N N 15 128.6375 0.03 . . . . . . . 13 T N . 50576 1 21 . 1 . 1 15 15 ALA H H 1 6.8300 0.01 . . . . . . . 15 A HN . 50576 1 22 . 1 . 1 15 15 ALA N N 15 119.8540 0.03 . . . . . . . 15 A N . 50576 1 23 . 1 . 1 16 16 PHE H H 1 9.2979 0.01 . . . . . . . 16 F HN . 50576 1 24 . 1 . 1 16 16 PHE N N 15 121.6501 0.03 . . . . . . . 16 F N . 50576 1 25 . 1 . 1 17 17 ASP H H 1 8.9571 0.01 . . . . . . . 17 D HN . 50576 1 26 . 1 . 1 17 17 ASP N N 15 119.3678 0.03 . . . . . . . 17 D N . 50576 1 27 . 1 . 1 18 18 ALA H H 1 8.8796 0.01 . . . . . . . 18 A HN . 50576 1 28 . 1 . 1 18 18 ALA N N 15 131.0358 0.03 . . . . . . . 18 A N . 50576 1 29 . 1 . 1 19 19 SER H H 1 8.7100 0.01 . . . . . . . 19 S HN . 50576 1 30 . 1 . 1 19 19 SER N N 15 112.0007 0.03 . . . . . . . 19 S N . 50576 1 31 . 1 . 1 20 20 LYS H H 1 7.3038 0.01 . . . . . . . 20 K HN . 50576 1 32 . 1 . 1 20 20 LYS N N 15 122.9156 0.03 . . . . . . . 20 K N . 50576 1 33 . 1 . 1 21 21 LYS H H 1 8.5005 0.01 . . . . . . . 21 K HN . 50576 1 34 . 1 . 1 21 21 LYS N N 15 123.0992 0.03 . . . . . . . 21 K N . 50576 1 35 . 1 . 1 22 22 LEU H H 1 8.6397 0.01 . . . . . . . 22 L HN . 50576 1 36 . 1 . 1 22 22 LEU N N 15 122.4356 0.03 . . . . . . . 22 L N . 50576 1 37 . 1 . 1 23 23 THR H H 1 8.6237 0.01 . . . . . . . 23 T HN . 50576 1 38 . 1 . 1 23 23 THR N N 15 113.5922 0.03 . . . . . . . 23 T N . 50576 1 39 . 1 . 1 25 25 GLU H H 1 8.3659 0.01 . . . . . . . 25 E HN . 50576 1 40 . 1 . 1 25 25 GLU N N 15 116.9536 0.03 . . . . . . . 25 E N . 50576 1 41 . 1 . 1 26 26 GLN H H 1 7.7329 0.01 . . . . . . . 26 Q HN . 50576 1 42 . 1 . 1 26 26 GLN N N 15 119.6880 0.03 . . . . . . . 26 Q N . 50576 1 43 . 1 . 1 27 27 ALA H H 1 8.2911 0.01 . . . . . . . 27 A HN . 50576 1 44 . 1 . 1 27 27 ALA N N 15 121.0098 0.03 . . . . . . . 27 A N . 50576 1 45 . 1 . 1 28 28 GLU H H 1 7.4447 0.01 . . . . . . . 28 E HN . 50576 1 46 . 1 . 1 28 28 GLU N N 15 115.4966 0.03 . . . . . . . 28 E N . 50576 1 47 . 1 . 1 29 29 GLN H H 1 8.0834 0.01 . . . . . . . 29 Q HN . 50576 1 48 . 1 . 1 29 29 GLN N N 15 120.3472 0.03 . . . . . . . 29 Q N . 50576 1 49 . 1 . 1 30 30 ILE H H 1 8.2019 0.01 . . . . . . . 30 I HN . 50576 1 50 . 1 . 1 30 30 ILE N N 15 112.8048 0.03 . . . . . . . 30 I N . 50576 1 51 . 1 . 1 31 31 LYS H H 1 6.9848 0.01 . . . . . . . 31 K HN . 50576 1 52 . 1 . 1 31 31 LYS N N 15 120.0026 0.03 . . . . . . . 31 K N . 50576 1 53 . 1 . 1 32 32 THR H H 1 7.8078 0.01 . . . . . . . 32 T HN . 50576 1 54 . 1 . 1 32 32 THR N N 15 116.7991 0.03 . . . . . . . 32 T N . 50576 1 55 . 1 . 1 33 33 LEU H H 1 7.6456 0.01 . . . . . . . 33 L HN . 50576 1 56 . 1 . 1 33 33 LEU N N 15 119.3111 0.03 . . . . . . . 33 L N . 50576 1 57 . 1 . 1 34 34 LEU H H 1 7.1327 0.01 . . . . . . . 34 L HN . 50576 1 58 . 1 . 1 34 34 LEU N N 15 119.8657 0.03 . . . . . . . 34 L N . 50576 1 59 . 1 . 1 35 35 GLN H H 1 7.2767 0.01 . . . . . . . 35 Q HN . 50576 1 60 . 1 . 1 35 35 GLN N N 15 114.5889 0.03 . . . . . . . 35 Q N . 50576 1 61 . 1 . 1 36 36 TYR H H 1 8.0377 0.01 . . . . . . . 36 Y HN . 50576 1 62 . 1 . 1 36 36 TYR N N 15 110.4156 0.03 . . . . . . . 36 Y N . 50576 1 63 . 1 . 1 37 37 SER H H 1 6.7289 0.01 . . . . . . . 37 S HN . 50576 1 64 . 1 . 1 37 37 SER N N 15 117.5110 0.03 . . . . . . . 37 S N . 50576 1 65 . 1 . 1 39 39 SER H H 1 6.9676 0.01 . . . . . . . 39 S HN . 50576 1 66 . 1 . 1 39 39 SER N N 15 105.6865 0.03 . . . . . . . 39 S N . 50576 1 67 . 1 . 1 40 40 SER H H 1 8.7900 0.01 . . . . . . . 40 S HN . 50576 1 68 . 1 . 1 40 40 SER N N 15 117.6857 0.03 . . . . . . . 40 S N . 50576 1 69 . 1 . 1 42 42 ASN H H 1 8.8689 0.01 . . . . . . . 42 N HN . 50576 1 70 . 1 . 1 42 42 ASN N N 15 120.2437 0.03 . . . . . . . 42 N N . 50576 1 71 . 1 . 1 43 43 SER H H 1 7.3056 0.01 . . . . . . . 43 S HN . 50576 1 72 . 1 . 1 43 43 SER N N 15 110.6106 0.03 . . . . . . . 43 S N . 50576 1 73 . 1 . 1 46 46 TRP H H 1 8.6708 0.01 . . . . . . . 46 W HN . 50576 1 74 . 1 . 1 46 46 TRP N N 15 118.0175 0.03 . . . . . . . 46 W N . 50576 1 75 . 1 . 1 47 47 HIS H H 1 7.9404 0.01 . . . . . . . 47 H HN . 50576 1 76 . 1 . 1 47 47 HIS N N 15 117.3869 0.03 . . . . . . . 47 H N . 50576 1 77 . 1 . 1 48 48 PHE H H 1 8.4343 0.01 . . . . . . . 48 F HN . 50576 1 78 . 1 . 1 48 48 PHE N N 15 123.6624 0.03 . . . . . . . 48 F N . 50576 1 79 . 1 . 1 49 49 ILE H H 1 8.3080 0.01 . . . . . . . 49 I HN . 50576 1 80 . 1 . 1 49 49 ILE N N 15 122.9251 0.03 . . . . . . . 49 I N . 50576 1 81 . 1 . 1 50 50 VAL H H 1 9.0652 0.01 . . . . . . . 50 V HN . 50576 1 82 . 1 . 1 50 50 VAL N N 15 126.6629 0.03 . . . . . . . 50 V N . 50576 1 83 . 1 . 1 51 51 ALA H H 1 9.5400 0.01 . . . . . . . 51 A HN . 50576 1 84 . 1 . 1 51 51 ALA N N 15 132.4240 0.03 . . . . . . . 51 A N . 50576 1 85 . 1 . 1 52 52 SER H H 1 9.3223 0.01 . . . . . . . 52 S HN . 50576 1 86 . 1 . 1 52 52 SER N N 15 116.5133 0.03 . . . . . . . 52 S N . 50576 1 87 . 1 . 1 53 53 THR H H 1 7.6399 0.01 . . . . . . . 53 T HN . 50576 1 88 . 1 . 1 53 53 THR N N 15 114.4464 0.03 . . . . . . . 53 T N . 50576 1 89 . 1 . 1 54 54 GLU H H 1 9.0154 0.01 . . . . . . . 54 E HN . 50576 1 90 . 1 . 1 54 54 GLU N N 15 122.1443 0.03 . . . . . . . 54 E N . 50576 1 91 . 1 . 1 55 55 GLU H H 1 9.0345 0.01 . . . . . . . 55 E HN . 50576 1 92 . 1 . 1 55 55 GLU N N 15 119.3361 0.03 . . . . . . . 55 E N . 50576 1 93 . 1 . 1 56 56 GLY H H 1 8.8783 0.01 . . . . . . . 56 G HN . 50576 1 94 . 1 . 1 56 56 GLY N N 15 110.2029 0.03 . . . . . . . 56 G N . 50576 1 95 . 1 . 1 57 57 LYS H H 1 8.4000 0.01 . . . . . . . 57 K HN . 50576 1 96 . 1 . 1 57 57 LYS N N 15 120.3873 0.03 . . . . . . . 57 K N . 50576 1 97 . 1 . 1 58 58 ALA H H 1 7.7884 0.01 . . . . . . . 58 A HN . 50576 1 98 . 1 . 1 58 58 ALA N N 15 120.4640 0.03 . . . . . . . 58 A N . 50576 1 99 . 1 . 1 59 59 ARG H H 1 7.6499 0.01 . . . . . . . 59 R HN . 50576 1 100 . 1 . 1 59 59 ARG N N 15 117.6555 0.03 . . . . . . . 59 R N . 50576 1 101 . 1 . 1 60 60 VAL H H 1 7.5031 0.01 . . . . . . . 60 V HN . 50576 1 102 . 1 . 1 60 60 VAL N N 15 117.3095 0.03 . . . . . . . 60 V N . 50576 1 103 . 1 . 1 61 61 ALA H H 1 8.6753 0.01 . . . . . . . 61 A HN . 50576 1 104 . 1 . 1 61 61 ALA N N 15 121.6871 0.03 . . . . . . . 61 A N . 50576 1 105 . 1 . 1 62 62 LYS H H 1 7.4391 0.01 . . . . . . . 62 K HN . 50576 1 106 . 1 . 1 62 62 LYS N N 15 120.9047 0.03 . . . . . . . 62 K N . 50576 1 107 . 1 . 1 63 63 SER H H 1 8.1190 0.01 . . . . . . . 63 S HN . 50576 1 108 . 1 . 1 63 63 SER N N 15 110.7713 0.03 . . . . . . . 63 S N . 50576 1 109 . 1 . 1 64 64 ALA H H 1 8.0298 0.01 . . . . . . . 64 A HN . 50576 1 110 . 1 . 1 64 64 ALA N N 15 131.2306 0.03 . . . . . . . 64 A N . 50576 1 111 . 1 . 1 65 65 ALA H H 1 6.9949 0.01 . . . . . . . 65 A HN . 50576 1 112 . 1 . 1 65 65 ALA N N 15 120.6927 0.03 . . . . . . . 65 A N . 50576 1 113 . 1 . 1 66 66 GLY H H 1 8.9446 0.01 . . . . . . . 66 G HN . 50576 1 114 . 1 . 1 66 66 GLY N N 15 109.9907 0.03 . . . . . . . 66 G N . 50576 1 115 . 1 . 1 68 68 TYR H H 1 7.7166 0.01 . . . . . . . 68 Y HN . 50576 1 116 . 1 . 1 68 68 TYR N N 15 116.7946 0.03 . . . . . . . 68 Y N . 50576 1 117 . 1 . 1 69 69 VAL H H 1 7.2508 0.01 . . . . . . . 69 V HN . 50576 1 118 . 1 . 1 69 69 VAL N N 15 120.0327 0.03 . . . . . . . 69 V N . 50576 1 119 . 1 . 1 70 70 PHE H H 1 7.5899 0.01 . . . . . . . 70 F HN . 50576 1 120 . 1 . 1 70 70 PHE N N 15 118.5849 0.03 . . . . . . . 70 F N . 50576 1 121 . 1 . 1 71 71 ASN H H 1 8.2936 0.01 . . . . . . . 71 N HN . 50576 1 122 . 1 . 1 71 71 ASN N N 15 117.0112 0.03 . . . . . . . 71 N N . 50576 1 123 . 1 . 1 72 72 GLU H H 1 8.1316 0.01 . . . . . . . 72 E HN . 50576 1 124 . 1 . 1 72 72 GLU N N 15 123.2978 0.03 . . . . . . . 72 E N . 50576 1 125 . 1 . 1 73 73 ARG H H 1 8.8154 0.01 . . . . . . . 73 R HN . 50576 1 126 . 1 . 1 73 73 ARG N N 15 116.4374 0.03 . . . . . . . 73 R N . 50576 1 127 . 1 . 1 74 74 LYS H H 1 7.3331 0.01 . . . . . . . 74 K HN . 50576 1 128 . 1 . 1 74 74 LYS N N 15 116.5475 0.03 . . . . . . . 74 K N . 50576 1 129 . 1 . 1 75 75 MET H H 1 6.6588 0.01 . . . . . . . 75 M HN . 50576 1 130 . 1 . 1 75 75 MET N N 15 109.8817 0.03 . . . . . . . 75 M N . 50576 1 131 . 1 . 1 76 76 LEU H H 1 7.2052 0.01 . . . . . . . 76 L HN . 50576 1 132 . 1 . 1 76 76 LEU N N 15 112.2173 0.03 . . . . . . . 76 L N . 50576 1 133 . 1 . 1 77 77 ASP H H 1 8.2102 0.01 . . . . . . . 77 D HN . 50576 1 134 . 1 . 1 77 77 ASP N N 15 117.0101 0.03 . . . . . . . 77 D N . 50576 1 135 . 1 . 1 78 78 ALA H H 1 6.0605 0.01 . . . . . . . 78 A HN . 50576 1 136 . 1 . 1 78 78 ALA N N 15 118.8088 0.03 . . . . . . . 78 A N . 50576 1 137 . 1 . 1 79 79 SER H H 1 6.9223 0.01 . . . . . . . 79 S HN . 50576 1 138 . 1 . 1 79 79 SER N N 15 110.7441 0.03 . . . . . . . 79 S N . 50576 1 139 . 1 . 1 80 80 HIS H H 1 8.0903 0.01 . . . . . . . 80 H HN . 50576 1 140 . 1 . 1 80 80 HIS N N 15 116.2910 0.03 . . . . . . . 80 H N . 50576 1 141 . 1 . 1 81 81 VAL H H 1 9.1621 0.01 . . . . . . . 81 V HN . 50576 1 142 . 1 . 1 81 81 VAL N N 15 121.8080 0.03 . . . . . . . 81 V N . 50576 1 143 . 1 . 1 82 82 VAL H H 1 7.8188 0.01 . . . . . . . 82 V HN . 50576 1 144 . 1 . 1 82 82 VAL N N 15 127.7328 0.03 . . . . . . . 82 V N . 50576 1 145 . 1 . 1 83 83 VAL H H 1 9.7730 0.01 . . . . . . . 83 V HN . 50576 1 146 . 1 . 1 83 83 VAL N N 15 128.0118 0.03 . . . . . . . 83 V N . 50576 1 147 . 1 . 1 84 84 PHE H H 1 9.3329 0.01 . . . . . . . 84 F HN . 50576 1 148 . 1 . 1 84 84 PHE N N 15 126.5833 0.03 . . . . . . . 84 F N . 50576 1 149 . 1 . 1 85 85 CYS H H 1 8.4184 0.01 . . . . . . . 85 C HN . 50576 1 150 . 1 . 1 85 85 CYS N N 15 120.8492 0.03 . . . . . . . 85 C N . 50576 1 151 . 1 . 1 86 86 ALA H H 1 8.8822 0.01 . . . . . . . 86 A HN . 50576 1 152 . 1 . 1 86 86 ALA N N 15 122.6856 0.03 . . . . . . . 86 A N . 50576 1 153 . 1 . 1 87 87 LYS H H 1 7.3151 0.01 . . . . . . . 87 K HN . 50576 1 154 . 1 . 1 87 87 LYS N N 15 119.8734 0.03 . . . . . . . 87 K N . 50576 1 155 . 1 . 1 88 88 THR H H 1 7.5799 0.01 . . . . . . . 88 T HN . 50576 1 156 . 1 . 1 88 88 THR N N 15 108.1379 0.03 . . . . . . . 88 T N . 50576 1 157 . 1 . 1 89 89 ALA H H 1 7.3532 0.01 . . . . . . . 89 A HN . 50576 1 158 . 1 . 1 89 89 ALA N N 15 122.2509 0.03 . . . . . . . 89 A N . 50576 1 159 . 1 . 1 90 90 MET H H 1 9.0658 0.01 . . . . . . . 90 M HN . 50576 1 160 . 1 . 1 90 90 MET N N 15 121.8073 0.03 . . . . . . . 90 M N . 50576 1 161 . 1 . 1 91 91 ASP H H 1 8.5018 0.01 . . . . . . . 91 D HN . 50576 1 162 . 1 . 1 91 91 ASP N N 15 127.3667 0.03 . . . . . . . 91 D N . 50576 1 163 . 1 . 1 93 93 VAL H H 1 7.8899 0.01 . . . . . . . 93 V HN . 50576 1 164 . 1 . 1 93 93 VAL N N 15 122.2848 0.03 . . . . . . . 93 V N . 50576 1 165 . 1 . 1 94 94 TRP H H 1 8.0132 0.01 . . . . . . . 94 W HN . 50576 1 166 . 1 . 1 94 94 TRP N N 15 124.1864 0.03 . . . . . . . 94 W N . 50576 1 167 . 1 . 1 95 95 LEU H H 1 7.2793 0.01 . . . . . . . 95 L HN . 50576 1 168 . 1 . 1 95 95 LEU N N 15 113.4759 0.03 . . . . . . . 95 L N . 50576 1 169 . 1 . 1 96 96 LYS H H 1 7.7536 0.01 . . . . . . . 96 K HN . 50576 1 170 . 1 . 1 96 96 LYS N N 15 122.4688 0.03 . . . . . . . 96 K N . 50576 1 171 . 1 . 1 97 97 LEU H H 1 8.0455 0.01 . . . . . . . 97 L HN . 50576 1 172 . 1 . 1 97 97 LEU N N 15 120.9366 0.03 . . . . . . . 97 L N . 50576 1 173 . 1 . 1 98 98 VAL H H 1 7.8304 0.01 . . . . . . . 98 V HN . 50576 1 174 . 1 . 1 98 98 VAL N N 15 115.7447 0.03 . . . . . . . 98 V N . 50576 1 175 . 1 . 1 99 99 VAL H H 1 7.4763 0.01 . . . . . . . 99 V HN . 50576 1 176 . 1 . 1 99 99 VAL N N 15 120.5217 0.03 . . . . . . . 99 V N . 50576 1 177 . 1 . 1 100 100 ASP H H 1 8.7946 0.01 . . . . . . . 100 D HN . 50576 1 178 . 1 . 1 100 100 ASP N N 15 125.2502 0.03 . . . . . . . 100 D N . 50576 1 179 . 1 . 1 101 101 GLN H H 1 8.0680 0.01 . . . . . . . 101 Q HN . 50576 1 180 . 1 . 1 101 101 GLN N N 15 124.7703 0.03 . . . . . . . 101 Q N . 50576 1 181 . 1 . 1 102 102 GLU H H 1 8.0968 0.01 . . . . . . . 102 E HN . 50576 1 182 . 1 . 1 102 102 GLU N N 15 120.2889 0.03 . . . . . . . 102 E N . 50576 1 183 . 1 . 1 103 103 ASP H H 1 8.1323 0.01 . . . . . . . 103 D HN . 50576 1 184 . 1 . 1 103 103 ASP N N 15 117.7704 0.03 . . . . . . . 103 D N . 50576 1 185 . 1 . 1 104 104 ALA H H 1 8.4778 0.01 . . . . . . . 104 A HN . 50576 1 186 . 1 . 1 104 104 ALA N N 15 125.8988 0.03 . . . . . . . 104 A N . 50576 1 187 . 1 . 1 105 105 ASP H H 1 8.0990 0.01 . . . . . . . 105 D HN . 50576 1 188 . 1 . 1 105 105 ASP N N 15 115.4740 0.03 . . . . . . . 105 D N . 50576 1 189 . 1 . 1 106 106 GLY H H 1 7.8810 0.01 . . . . . . . 106 G HN . 50576 1 190 . 1 . 1 106 106 GLY N N 15 106.0758 0.03 . . . . . . . 106 G N . 50576 1 191 . 1 . 1 107 107 ARG H H 1 7.5823 0.01 . . . . . . . 107 R HN . 50576 1 192 . 1 . 1 107 107 ARG N N 15 115.4086 0.03 . . . . . . . 107 R N . 50576 1 193 . 1 . 1 108 108 PHE H H 1 8.6892 0.01 . . . . . . . 108 F HN . 50576 1 194 . 1 . 1 108 108 PHE N N 15 117.3061 0.03 . . . . . . . 108 F N . 50576 1 195 . 1 . 1 110 110 THR H H 1 7.1852 0.01 . . . . . . . 110 T HN . 50576 1 196 . 1 . 1 110 110 THR N N 15 103.1245 0.03 . . . . . . . 110 T N . 50576 1 197 . 1 . 1 112 112 GLU H H 1 8.5548 0.01 . . . . . . . 112 E HN . 50576 1 198 . 1 . 1 112 112 GLU N N 15 118.9976 0.03 . . . . . . . 112 E N . 50576 1 199 . 1 . 1 113 113 ALA H H 1 8.0132 0.01 . . . . . . . 113 A HN . 50576 1 200 . 1 . 1 113 113 ALA N N 15 124.1864 0.03 . . . . . . . 113 A N . 50576 1 201 . 1 . 1 114 114 LYS H H 1 6.9981 0.01 . . . . . . . 114 K HN . 50576 1 202 . 1 . 1 114 114 LYS N N 15 121.2439 0.03 . . . . . . . 114 K N . 50576 1 203 . 1 . 1 115 115 ALA H H 1 7.7884 0.01 . . . . . . . 115 A HN . 50576 1 204 . 1 . 1 115 115 ALA N N 15 120.4640 0.03 . . . . . . . 115 A N . 50576 1 205 . 1 . 1 116 116 ALA H H 1 7.9958 0.01 . . . . . . . 116 A HN . 50576 1 206 . 1 . 1 116 116 ALA N N 15 120.0013 0.03 . . . . . . . 116 A N . 50576 1 207 . 1 . 1 117 117 ASN H H 1 7.5257 0.01 . . . . . . . 117 N HN . 50576 1 208 . 1 . 1 117 117 ASN N N 15 120.5454 0.03 . . . . . . . 117 N N . 50576 1 209 . 1 . 1 118 118 ASP H H 1 8.3022 0.01 . . . . . . . 118 D HN . 50576 1 210 . 1 . 1 118 118 ASP N N 15 120.0137 0.03 . . . . . . . 118 D N . 50576 1 211 . 1 . 1 119 119 LYS H H 1 8.2845 0.01 . . . . . . . 119 K HN . 50576 1 212 . 1 . 1 119 119 LYS N N 15 118.4690 0.03 . . . . . . . 119 K N . 50576 1 213 . 1 . 1 120 120 GLY H H 1 8.1170 0.01 . . . . . . . 120 G HN . 50576 1 214 . 1 . 1 120 120 GLY N N 15 106.9574 0.03 . . . . . . . 120 G N . 50576 1 215 . 1 . 1 121 121 ARG H H 1 8.0184 0.01 . . . . . . . 121 R HN . 50576 1 216 . 1 . 1 121 121 ARG N N 15 123.3886 0.03 . . . . . . . 121 R N . 50576 1 217 . 1 . 1 122 122 LYS H H 1 8.6853 0.01 . . . . . . . 122 K HN . 50576 1 218 . 1 . 1 122 122 LYS N N 15 118.7915 0.03 . . . . . . . 122 K N . 50576 1 219 . 1 . 1 123 123 PHE H H 1 8.1505 0.01 . . . . . . . 123 F HN . 50576 1 220 . 1 . 1 123 123 PHE N N 15 119.3819 0.03 . . . . . . . 123 F N . 50576 1 221 . 1 . 1 124 124 PHE H H 1 7.5339 0.01 . . . . . . . 124 F HN . 50576 1 222 . 1 . 1 124 124 PHE N N 15 118.7159 0.03 . . . . . . . 124 F N . 50576 1 223 . 1 . 1 125 125 ALA H H 1 9.0893 0.01 . . . . . . . 125 A HN . 50576 1 224 . 1 . 1 125 125 ALA N N 15 121.5579 0.03 . . . . . . . 125 A N . 50576 1 225 . 1 . 1 126 126 ASP H H 1 9.1052 0.01 . . . . . . . 126 D HN . 50576 1 226 . 1 . 1 126 126 ASP N N 15 119.2177 0.03 . . . . . . . 126 D N . 50576 1 227 . 1 . 1 127 127 MET H H 1 7.5222 0.01 . . . . . . . 127 M HN . 50576 1 228 . 1 . 1 127 127 MET N N 15 122.8177 0.03 . . . . . . . 127 M N . 50576 1 229 . 1 . 1 128 128 HIS H H 1 6.9878 0.01 . . . . . . . 128 H HN . 50576 1 230 . 1 . 1 128 128 HIS N N 15 113.2409 0.03 . . . . . . . 128 H N . 50576 1 231 . 1 . 1 129 129 ARG H H 1 9.2216 0.01 . . . . . . . 129 R HN . 50576 1 232 . 1 . 1 129 129 ARG N N 15 117.1510 0.03 . . . . . . . 129 R N . 50576 1 233 . 1 . 1 130 130 LYS H H 1 8.6708 0.01 . . . . . . . 130 K HN . 50576 1 234 . 1 . 1 130 130 LYS N N 15 118.0175 0.03 . . . . . . . 130 K N . 50576 1 235 . 1 . 1 131 131 ASP H H 1 6.9851 0.01 . . . . . . . 131 D HN . 50576 1 236 . 1 . 1 131 131 ASP N N 15 117.1776 0.03 . . . . . . . 131 D N . 50576 1 237 . 1 . 1 132 132 LEU H H 1 8.0592 0.01 . . . . . . . 132 L HN . 50576 1 238 . 1 . 1 132 132 LEU N N 15 115.9250 0.03 . . . . . . . 132 L N . 50576 1 239 . 1 . 1 133 133 HIS H H 1 6.9209 0.01 . . . . . . . 133 H HN . 50576 1 240 . 1 . 1 133 133 HIS N N 15 112.2761 0.03 . . . . . . . 133 H N . 50576 1 241 . 1 . 1 134 134 ASP H H 1 8.8011 0.01 . . . . . . . 134 D HN . 50576 1 242 . 1 . 1 134 134 ASP N N 15 119.1826 0.03 . . . . . . . 134 D N . 50576 1 243 . 1 . 1 135 135 ASP H H 1 8.8545 0.01 . . . . . . . 135 D HN . 50576 1 244 . 1 . 1 135 135 ASP N N 15 117.8211 0.03 . . . . . . . 135 D N . 50576 1 245 . 1 . 1 136 136 ALA H H 1 8.5052 0.01 . . . . . . . 136 A HN . 50576 1 246 . 1 . 1 136 136 ALA N N 15 123.5100 0.03 . . . . . . . 136 A N . 50576 1 247 . 1 . 1 137 137 GLU H H 1 8.4459 0.01 . . . . . . . 137 E HN . 50576 1 248 . 1 . 1 137 137 GLU N N 15 121.4080 0.03 . . . . . . . 137 E N . 50576 1 249 . 1 . 1 138 138 TRP H H 1 9.0359 0.01 . . . . . . . 138 W HN . 50576 1 250 . 1 . 1 138 138 TRP N N 15 122.8160 0.03 . . . . . . . 138 W N . 50576 1 251 . 1 . 1 139 139 MET H H 1 8.4796 0.01 . . . . . . . 139 M HN . 50576 1 252 . 1 . 1 139 139 MET N N 15 117.5372 0.03 . . . . . . . 139 M N . 50576 1 253 . 1 . 1 140 140 ALA H H 1 8.0845 0.01 . . . . . . . 140 A HN . 50576 1 254 . 1 . 1 140 140 ALA N N 15 121.4392 0.03 . . . . . . . 140 A N . 50576 1 255 . 1 . 1 141 141 LYS H H 1 8.0417 0.01 . . . . . . . 141 K HN . 50576 1 256 . 1 . 1 141 141 LYS N N 15 118.0245 0.03 . . . . . . . 141 K N . 50576 1 257 . 1 . 1 142 142 GLN H H 1 7.1503 0.01 . . . . . . . 142 Q HN . 50576 1 258 . 1 . 1 142 142 GLN N N 15 113.8100 0.03 . . . . . . . 142 Q N . 50576 1 259 . 1 . 1 143 143 VAL H H 1 7.7951 0.01 . . . . . . . 143 V HN . 50576 1 260 . 1 . 1 143 143 VAL N N 15 117.5659 0.03 . . . . . . . 143 V N . 50576 1 261 . 1 . 1 144 144 TYR H H 1 8.3190 0.01 . . . . . . . 144 Y HN . 50576 1 262 . 1 . 1 144 144 TYR N N 15 121.4153 0.03 . . . . . . . 144 Y N . 50576 1 263 . 1 . 1 145 145 LEU H H 1 7.8706 0.01 . . . . . . . 145 L HN . 50576 1 264 . 1 . 1 145 145 LEU N N 15 122.2140 0.03 . . . . . . . 145 L N . 50576 1 265 . 1 . 1 146 146 ASN H H 1 7.7676 0.01 . . . . . . . 146 N HN . 50576 1 266 . 1 . 1 146 146 ASN N N 15 121.4844 0.03 . . . . . . . 146 N N . 50576 1 267 . 1 . 1 147 147 VAL H H 1 8.2049 0.01 . . . . . . . 147 V HN . 50576 1 268 . 1 . 1 147 147 VAL N N 15 117.8021 0.03 . . . . . . . 147 V N . 50576 1 269 . 1 . 1 148 148 GLY H H 1 8.2932 0.01 . . . . . . . 148 G HN . 50576 1 270 . 1 . 1 148 148 GLY N N 15 107.2676 0.03 . . . . . . . 148 G N . 50576 1 271 . 1 . 1 149 149 ASN H H 1 7.8790 0.01 . . . . . . . 149 N HN . 50576 1 272 . 1 . 1 149 149 ASN N N 15 121.0756 0.03 . . . . . . . 149 N N . 50576 1 273 . 1 . 1 150 150 PHE H H 1 9.3982 0.01 . . . . . . . 150 F HN . 50576 1 274 . 1 . 1 150 150 PHE N N 15 119.9459 0.03 . . . . . . . 150 F N . 50576 1 275 . 1 . 1 151 151 LEU H H 1 8.9462 0.01 . . . . . . . 151 L HN . 50576 1 276 . 1 . 1 151 151 LEU N N 15 115.6711 0.03 . . . . . . . 151 L N . 50576 1 277 . 1 . 1 152 152 LEU H H 1 7.2309 0.01 . . . . . . . 152 L HN . 50576 1 278 . 1 . 1 152 152 LEU N N 15 120.7262 0.03 . . . . . . . 152 L N . 50576 1 279 . 1 . 1 153 153 GLY H H 1 8.4326 0.01 . . . . . . . 153 G HN . 50576 1 280 . 1 . 1 153 153 GLY N N 15 107.5444 0.03 . . . . . . . 153 G N . 50576 1 281 . 1 . 1 154 154 VAL H H 1 8.8383 0.01 . . . . . . . 154 V HN . 50576 1 282 . 1 . 1 154 154 VAL N N 15 116.5036 0.03 . . . . . . . 154 V N . 50576 1 283 . 1 . 1 155 155 ALA H H 1 6.9236 0.01 . . . . . . . 155 A HN . 50576 1 284 . 1 . 1 155 155 ALA N N 15 122.4456 0.03 . . . . . . . 155 A N . 50576 1 285 . 1 . 1 156 156 ALA H H 1 8.2967 0.01 . . . . . . . 156 A HN . 50576 1 286 . 1 . 1 156 156 ALA N N 15 122.5564 0.03 . . . . . . . 156 A N . 50576 1 287 . 1 . 1 157 157 LEU H H 1 7.5339 0.01 . . . . . . . 157 L HN . 50576 1 288 . 1 . 1 157 157 LEU N N 15 118.7159 0.03 . . . . . . . 157 L N . 50576 1 289 . 1 . 1 158 158 GLY H H 1 7.9356 0.01 . . . . . . . 158 G HN . 50576 1 290 . 1 . 1 158 158 GLY N N 15 106.8882 0.03 . . . . . . . 158 G N . 50576 1 291 . 1 . 1 159 159 LEU H H 1 7.5467 0.01 . . . . . . . 159 L HN . 50576 1 292 . 1 . 1 159 159 LEU N N 15 119.1349 0.03 . . . . . . . 159 L N . 50576 1 293 . 1 . 1 160 160 ASP H H 1 8.4472 0.01 . . . . . . . 160 D HN . 50576 1 294 . 1 . 1 160 160 ASP N N 15 118.9448 0.03 . . . . . . . 160 D N . 50576 1 295 . 1 . 1 161 161 ALA H H 1 8.3925 0.01 . . . . . . . 161 A HN . 50576 1 296 . 1 . 1 161 161 ALA N N 15 117.7223 0.03 . . . . . . . 161 A N . 50576 1 297 . 1 . 1 162 162 VAL H H 1 7.5339 0.01 . . . . . . . 162 V HN . 50576 1 298 . 1 . 1 162 162 VAL N N 15 118.7159 0.03 . . . . . . . 162 V N . 50576 1 299 . 1 . 1 164 164 ILE H H 1 8.2936 0.01 . . . . . . . 164 I HN . 50576 1 300 . 1 . 1 164 164 ILE N N 15 117.0112 0.03 . . . . . . . 164 I N . 50576 1 301 . 1 . 1 165 165 GLU H H 1 8.7102 0.01 . . . . . . . 165 E HN . 50576 1 302 . 1 . 1 165 165 GLU N N 15 124.7895 0.03 . . . . . . . 165 E N . 50576 1 303 . 1 . 1 166 166 GLY H H 1 8.3043 0.01 . . . . . . . 166 G HN . 50576 1 304 . 1 . 1 166 166 GLY N N 15 109.8319 0.03 . . . . . . . 166 G N . 50576 1 305 . 1 . 1 167 167 PHE H H 1 7.4207 0.01 . . . . . . . 167 F HN . 50576 1 306 . 1 . 1 167 167 PHE N N 15 121.0077 0.03 . . . . . . . 167 F N . 50576 1 307 . 1 . 1 168 168 ASP H H 1 9.1858 0.01 . . . . . . . 168 D HN . 50576 1 308 . 1 . 1 168 168 ASP N N 15 120.5955 0.03 . . . . . . . 168 D N . 50576 1 309 . 1 . 1 169 169 ALA H H 1 8.2259 0.01 . . . . . . . 169 A HN . 50576 1 310 . 1 . 1 169 169 ALA N N 15 130.8317 0.03 . . . . . . . 169 A N . 50576 1 311 . 1 . 1 170 170 ALA H H 1 8.1200 0.01 . . . . . . . 170 A HN . 50576 1 312 . 1 . 1 170 170 ALA N N 15 119.6224 0.03 . . . . . . . 170 A N . 50576 1 313 . 1 . 1 171 171 ILE H H 1 7.6949 0.01 . . . . . . . 171 I HN . 50576 1 314 . 1 . 1 171 171 ILE N N 15 120.4542 0.03 . . . . . . . 171 I N . 50576 1 315 . 1 . 1 172 172 LEU H H 1 7.9590 0.01 . . . . . . . 172 L HN . 50576 1 316 . 1 . 1 172 172 LEU N N 15 123.7943 0.03 . . . . . . . 172 L N . 50576 1 317 . 1 . 1 173 173 ASP H H 1 9.3713 0.01 . . . . . . . 173 D HN . 50576 1 318 . 1 . 1 173 173 ASP N N 15 118.2318 0.03 . . . . . . . 173 D N . 50576 1 319 . 1 . 1 174 174 ALA H H 1 7.7284 0.01 . . . . . . . 174 A HN . 50576 1 320 . 1 . 1 174 174 ALA N N 15 122.4390 0.03 . . . . . . . 174 A N . 50576 1 321 . 1 . 1 175 175 GLU H H 1 8.4000 0.01 . . . . . . . 175 E HN . 50576 1 322 . 1 . 1 175 175 GLU N N 15 120.3873 0.03 . . . . . . . 175 E N . 50576 1 323 . 1 . 1 176 176 PHE H H 1 7.4605 0.01 . . . . . . . 176 F HN . 50576 1 324 . 1 . 1 176 176 PHE N N 15 112.4288 0.03 . . . . . . . 176 F N . 50576 1 325 . 1 . 1 177 177 GLY H H 1 7.7269 0.01 . . . . . . . 177 G HN . 50576 1 326 . 1 . 1 177 177 GLY N N 15 111.8673 0.03 . . . . . . . 177 G N . 50576 1 327 . 1 . 1 178 178 LEU H H 1 8.4831 0.01 . . . . . . . 178 L HN . 50576 1 328 . 1 . 1 178 178 LEU N N 15 115.5138 0.03 . . . . . . . 178 L N . 50576 1 329 . 1 . 1 179 179 LYS H H 1 8.5576 0.01 . . . . . . . 179 K HN . 50576 1 330 . 1 . 1 179 179 LYS N N 15 120.9752 0.03 . . . . . . . 179 K N . 50576 1 331 . 1 . 1 180 180 GLU H H 1 8.8595 0.01 . . . . . . . 180 E HN . 50576 1 332 . 1 . 1 180 180 GLU N N 15 119.7610 0.03 . . . . . . . 180 E N . 50576 1 333 . 1 . 1 181 181 LYS H H 1 7.1380 0.01 . . . . . . . 181 K HN . 50576 1 334 . 1 . 1 181 181 LYS N N 15 116.9057 0.03 . . . . . . . 181 K N . 50576 1 335 . 1 . 1 182 182 GLY H H 1 7.7267 0.01 . . . . . . . 182 G HN . 50576 1 336 . 1 . 1 182 182 GLY N N 15 105.7034 0.03 . . . . . . . 182 G N . 50576 1 337 . 1 . 1 183 183 TYR H H 1 8.1078 0.01 . . . . . . . 183 Y HN . 50576 1 338 . 1 . 1 183 183 TYR N N 15 118.9076 0.03 . . . . . . . 183 Y N . 50576 1 339 . 1 . 1 184 184 THR H H 1 8.7462 0.01 . . . . . . . 184 T HN . 50576 1 340 . 1 . 1 184 184 THR N N 15 111.5521 0.03 . . . . . . . 184 T N . 50576 1 341 . 1 . 1 185 185 SER H H 1 10.7071 0.01 . . . . . . . 185 S HN . 50576 1 342 . 1 . 1 185 185 SER N N 15 129.0834 0.03 . . . . . . . 185 S N . 50576 1 343 . 1 . 1 186 186 LEU H H 1 8.7900 0.01 . . . . . . . 186 L HN . 50576 1 344 . 1 . 1 186 186 LEU N N 15 117.6857 0.03 . . . . . . . 186 L N . 50576 1 345 . 1 . 1 187 187 VAL H H 1 7.2095 0.01 . . . . . . . 187 V HN . 50576 1 346 . 1 . 1 187 187 VAL N N 15 113.8505 0.03 . . . . . . . 187 V N . 50576 1 347 . 1 . 1 188 188 VAL H H 1 8.2394 0.01 . . . . . . . 188 V HN . 50576 1 348 . 1 . 1 188 188 VAL N N 15 127.7057 0.03 . . . . . . . 188 V N . 50576 1 349 . 1 . 1 189 189 VAL H H 1 10.0111 0.01 . . . . . . . 189 V HN . 50576 1 350 . 1 . 1 189 189 VAL N N 15 126.3787 0.03 . . . . . . . 189 V N . 50576 1 351 . 1 . 1 191 191 VAL H H 1 8.9563 0.01 . . . . . . . 191 V HN . 50576 1 352 . 1 . 1 191 191 VAL N N 15 120.5038 0.03 . . . . . . . 191 V N . 50576 1 353 . 1 . 1 192 192 GLY H H 1 8.8130 0.01 . . . . . . . 192 G HN . 50576 1 354 . 1 . 1 192 192 GLY N N 15 113.0166 0.03 . . . . . . . 192 G N . 50576 1 355 . 1 . 1 193 193 HIS H H 1 9.8570 0.01 . . . . . . . 193 H HN . 50576 1 356 . 1 . 1 193 193 HIS N N 15 124.5778 0.03 . . . . . . . 193 H N . 50576 1 357 . 1 . 1 194 194 HIS H H 1 10.6421 0.01 . . . . . . . 194 H HN . 50576 1 358 . 1 . 1 194 194 HIS N N 15 123.6154 0.03 . . . . . . . 194 H N . 50576 1 359 . 1 . 1 195 195 SER H H 1 8.1516 0.01 . . . . . . . 195 S HN . 50576 1 360 . 1 . 1 195 195 SER N N 15 116.3809 0.03 . . . . . . . 195 S N . 50576 1 361 . 1 . 1 197 197 GLU H H 1 7.8775 0.01 . . . . . . . 197 E HN . 50576 1 362 . 1 . 1 197 197 GLU N N 15 117.8347 0.03 . . . . . . . 197 E N . 50576 1 363 . 1 . 1 198 198 ASP H H 1 7.7078 0.01 . . . . . . . 198 D HN . 50576 1 364 . 1 . 1 198 198 ASP N N 15 118.6139 0.03 . . . . . . . 198 D N . 50576 1 365 . 1 . 1 199 199 PHE H H 1 7.7393 0.01 . . . . . . . 199 F HN . 50576 1 366 . 1 . 1 199 199 PHE N N 15 128.0223 0.03 . . . . . . . 199 F N . 50576 1 367 . 1 . 1 200 200 ASN H H 1 7.5899 0.01 . . . . . . . 200 N HN . 50576 1 368 . 1 . 1 200 200 ASN N N 15 118.5849 0.03 . . . . . . . 200 N N . 50576 1 369 . 1 . 1 201 201 ALA H H 1 6.9848 0.01 . . . . . . . 201 A HN . 50576 1 370 . 1 . 1 201 201 ALA N N 15 120.0026 0.03 . . . . . . . 201 A N . 50576 1 371 . 1 . 1 202 202 THR H H 1 6.9697 0.01 . . . . . . . 202 T HN . 50576 1 372 . 1 . 1 202 202 THR N N 15 102.3511 0.03 . . . . . . . 202 T N . 50576 1 373 . 1 . 1 203 203 LEU H H 1 6.4486 0.01 . . . . . . . 203 L HN . 50576 1 374 . 1 . 1 203 203 LEU N N 15 122.1752 0.03 . . . . . . . 203 L N . 50576 1 375 . 1 . 1 205 205 LYS H H 1 8.6397 0.01 . . . . . . . 205 K HN . 50576 1 376 . 1 . 1 205 205 LYS N N 15 122.4356 0.03 . . . . . . . 205 K N . 50576 1 377 . 1 . 1 206 206 SER H H 1 8.8154 0.01 . . . . . . . 206 S HN . 50576 1 378 . 1 . 1 206 206 SER N N 15 116.4374 0.03 . . . . . . . 206 S N . 50576 1 379 . 1 . 1 207 207 ARG H H 1 8.4202 0.01 . . . . . . . 207 R HN . 50576 1 380 . 1 . 1 207 207 ARG N N 15 129.3119 0.03 . . . . . . . 207 R N . 50576 1 381 . 1 . 1 208 208 LEU H H 1 9.6134 0.01 . . . . . . . 208 L HN . 50576 1 382 . 1 . 1 208 208 LEU N N 15 120.6407 0.03 . . . . . . . 208 L N . 50576 1 383 . 1 . 1 210 210 GLN H H 1 8.6456 0.01 . . . . . . . 210 Q HN . 50576 1 384 . 1 . 1 210 210 GLN N N 15 119.5338 0.03 . . . . . . . 210 Q N . 50576 1 385 . 1 . 1 211 211 ASN H H 1 8.1510 0.01 . . . . . . . 211 N HN . 50576 1 386 . 1 . 1 211 211 ASN N N 15 111.7337 0.03 . . . . . . . 211 N N . 50576 1 387 . 1 . 1 212 212 ILE H H 1 7.6843 0.01 . . . . . . . 212 I HN . 50576 1 388 . 1 . 1 212 212 ILE N N 15 118.8643 0.03 . . . . . . . 212 I N . 50576 1 389 . 1 . 1 213 213 THR H H 1 7.1403 0.01 . . . . . . . 213 T HN . 50576 1 390 . 1 . 1 213 213 THR N N 15 106.1403 0.03 . . . . . . . 213 T N . 50576 1 391 . 1 . 1 214 214 LEU H H 1 8.3080 0.01 . . . . . . . 214 L HN . 50576 1 392 . 1 . 1 214 214 LEU N N 15 122.9251 0.03 . . . . . . . 214 L N . 50576 1 393 . 1 . 1 215 215 THR H H 1 8.8829 0.01 . . . . . . . 215 T HN . 50576 1 394 . 1 . 1 215 215 THR N N 15 124.5833 0.03 . . . . . . . 215 T N . 50576 1 395 . 1 . 1 216 216 GLU H H 1 8.8352 0.01 . . . . . . . 216 E HN . 50576 1 396 . 1 . 1 216 216 GLU N N 15 127.9697 0.03 . . . . . . . 216 E N . 50576 1 397 . 1 . 1 217 217 VAL H H 1 8.4449 0.01 . . . . . . . 217 V HN . 50576 1 398 . 1 . 1 217 217 VAL N N 15 123.2225 0.03 . . . . . . . 217 V N . 50576 1 stop_ save_