################################### # 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 25850 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 4 '3D 15N/13C-edited 1H-1H NOESY' . . . 25850 1 9 '3D HNCO' . . . 25850 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 GLY HA2 H 1 4.005 0.020 . 2 . . . . A 2 GLY HA2 . 25850 1 2 . 1 1 2 2 GLY HA3 H 1 4.091 0.020 . 2 . . . . A 2 GLY HA3 . 25850 1 3 . 1 1 2 2 GLY C C 13 173.891 0.100 . 1 . . . . A 2 GLY C . 25850 1 4 . 1 1 2 2 GLY CA C 13 44.831 0.100 . 1 . . . . A 2 GLY CA . 25850 1 5 . 1 1 3 3 SER H H 1 8.428 0.020 . 1 . . . . A 3 SER H . 25850 1 6 . 1 1 3 3 SER HA H 1 4.799 0.020 . 1 . . . . A 3 SER HA . 25850 1 7 . 1 1 3 3 SER HB2 H 1 4.130 0.020 . 2 . . . . A 3 SER HB2 . 25850 1 8 . 1 1 3 3 SER HB3 H 1 3.935 0.020 . 2 . . . . A 3 SER HB3 . 25850 1 9 . 1 1 3 3 SER C C 13 173.162 0.100 . 1 . . . . A 3 SER C . 25850 1 10 . 1 1 3 3 SER CA C 13 56.530 0.100 . 1 . . . . A 3 SER CA . 25850 1 11 . 1 1 3 3 SER CB C 13 63.002 0.100 . 1 . . . . A 3 SER CB . 25850 1 12 . 1 1 3 3 SER N N 15 117.545 0.100 . 1 . . . . A 3 SER N . 25850 1 13 . 1 1 4 4 PRO HA H 1 4.644 0.020 . 1 . . . . A 4 PRO HA . 25850 1 14 . 1 1 4 4 PRO HB2 H 1 2.528 0.020 . 2 . . . . A 4 PRO HB2 . 25850 1 15 . 1 1 4 4 PRO HB3 H 1 2.051 0.020 . 2 . . . . A 4 PRO HB3 . 25850 1 16 . 1 1 4 4 PRO HG2 H 1 2.133 0.020 . 2 . . . . A 4 PRO HG2 . 25850 1 17 . 1 1 4 4 PRO HG3 H 1 2.049 0.020 . 2 . . . . A 4 PRO HG3 . 25850 1 18 . 1 1 4 4 PRO HD2 H 1 3.943 0.020 . 2 . . . . A 4 PRO HD2 . 25850 1 19 . 1 1 4 4 PRO HD3 H 1 3.855 0.020 . 2 . . . . A 4 PRO HD3 . 25850 1 20 . 1 1 4 4 PRO C C 13 178.093 0.100 . 1 . . . . A 4 PRO C . 25850 1 21 . 1 1 4 4 PRO CA C 13 65.378 0.100 . 1 . . . . A 4 PRO CA . 25850 1 22 . 1 1 4 4 PRO CB C 13 31.965 0.100 . 1 . . . . A 4 PRO CB . 25850 1 23 . 1 1 4 4 PRO CG C 13 27.931 0.100 . 1 . . . . A 4 PRO CG . 25850 1 24 . 1 1 4 4 PRO CD C 13 50.377 0.100 . 1 . . . . A 4 PRO CD . 25850 1 25 . 1 1 5 5 ASP H H 1 8.233 0.020 . 1 . . . . A 5 ASP H . 25850 1 26 . 1 1 5 5 ASP HA H 1 4.353 0.020 . 1 . . . . A 5 ASP HA . 25850 1 27 . 1 1 5 5 ASP HB2 H 1 2.479 0.020 . 2 . . . . A 5 ASP HB2 . 25850 1 28 . 1 1 5 5 ASP HB3 H 1 2.581 0.020 . 2 . . . . A 5 ASP HB3 . 25850 1 29 . 1 1 5 5 ASP C C 13 178.915 0.100 . 1 . . . . A 5 ASP C . 25850 1 30 . 1 1 5 5 ASP CA C 13 56.796 0.100 . 1 . . . . A 5 ASP CA . 25850 1 31 . 1 1 5 5 ASP CB C 13 40.690 0.100 . 1 . . . . A 5 ASP CB . 25850 1 32 . 1 1 5 5 ASP N N 15 115.270 0.100 . 1 . . . . A 5 ASP N . 25850 1 33 . 1 1 6 6 GLU H H 1 7.770 0.020 . 1 . . . . A 6 GLU H . 25850 1 34 . 1 1 6 6 GLU HA H 1 4.027 0.020 . 1 . . . . A 6 GLU HA . 25850 1 35 . 1 1 6 6 GLU HB2 H 1 2.093 0.020 . 2 . . . . A 6 GLU HB2 . 25850 1 36 . 1 1 6 6 GLU HB3 H 1 2.005 0.020 . 2 . . . . A 6 GLU HB3 . 25850 1 37 . 1 1 6 6 GLU HG2 H 1 2.198 0.020 . 2 . . . . A 6 GLU HG2 . 25850 1 38 . 1 1 6 6 GLU HG3 H 1 2.261 0.020 . 2 . . . . A 6 GLU HG3 . 25850 1 39 . 1 1 6 6 GLU C C 13 178.836 0.100 . 1 . . . . A 6 GLU C . 25850 1 40 . 1 1 6 6 GLU CA C 13 58.594 0.100 . 1 . . . . A 6 GLU CA . 25850 1 41 . 1 1 6 6 GLU CB C 13 29.641 0.100 . 1 . . . . A 6 GLU CB . 25850 1 42 . 1 1 6 6 GLU CG C 13 36.600 0.100 . 1 . . . . A 6 GLU CG . 25850 1 43 . 1 1 6 6 GLU N N 15 121.390 0.100 . 1 . . . . A 6 GLU N . 25850 1 44 . 1 1 7 7 ASN H H 1 8.378 0.020 . 1 . . . . A 7 ASN H . 25850 1 45 . 1 1 7 7 ASN HA H 1 4.155 0.020 . 1 . . . . A 7 ASN HA . 25850 1 46 . 1 1 7 7 ASN HB2 H 1 2.877 0.020 . 2 . . . . A 7 ASN HB2 . 25850 1 47 . 1 1 7 7 ASN HB3 H 1 2.468 0.020 . 2 . . . . A 7 ASN HB3 . 25850 1 48 . 1 1 7 7 ASN HD21 H 1 7.752 0.020 . 1 . . . . A 7 ASN HD21 . 25850 1 49 . 1 1 7 7 ASN HD22 H 1 6.716 0.020 . 1 . . . . A 7 ASN HD22 . 25850 1 50 . 1 1 7 7 ASN C C 13 176.723 0.100 . 1 . . . . A 7 ASN C . 25850 1 51 . 1 1 7 7 ASN CA C 13 55.007 0.100 . 1 . . . . A 7 ASN CA . 25850 1 52 . 1 1 7 7 ASN CB C 13 36.627 0.100 . 1 . . . . A 7 ASN CB . 25850 1 53 . 1 1 7 7 ASN N N 15 119.966 0.100 . 1 . . . . A 7 ASN N . 25850 1 54 . 1 1 7 7 ASN ND2 N 15 111.816 0.100 . 1 . . . . A 7 ASN ND2 . 25850 1 55 . 1 1 8 8 ILE H H 1 8.626 0.020 . 1 . . . . A 8 ILE H . 25850 1 56 . 1 1 8 8 ILE HA H 1 3.608 0.020 . 1 . . . . A 8 ILE HA . 25850 1 57 . 1 1 8 8 ILE HB H 1 1.901 0.020 . 1 . . . . A 8 ILE HB . 25850 1 58 . 1 1 8 8 ILE HG12 H 1 0.920 0.020 . 2 . . . . A 8 ILE HG12 . 25850 1 59 . 1 1 8 8 ILE HG13 H 1 1.858 0.020 . 2 . . . . A 8 ILE HG13 . 25850 1 60 . 1 1 8 8 ILE HG21 H 1 0.844 0.020 . 1 . . . . A 8 ILE HG21 . 25850 1 61 . 1 1 8 8 ILE HG22 H 1 0.844 0.020 . 1 . . . . A 8 ILE HG22 . 25850 1 62 . 1 1 8 8 ILE HG23 H 1 0.844 0.020 . 1 . . . . A 8 ILE HG23 . 25850 1 63 . 1 1 8 8 ILE HD11 H 1 0.767 0.020 . 1 . . . . A 8 ILE HD11 . 25850 1 64 . 1 1 8 8 ILE HD12 H 1 0.767 0.020 . 1 . . . . A 8 ILE HD12 . 25850 1 65 . 1 1 8 8 ILE HD13 H 1 0.767 0.020 . 1 . . . . A 8 ILE HD13 . 25850 1 66 . 1 1 8 8 ILE CA C 13 66.495 0.100 . 1 . . . . A 8 ILE CA . 25850 1 67 . 1 1 8 8 ILE CB C 13 37.558 0.100 . 1 . . . . A 8 ILE CB . 25850 1 68 . 1 1 8 8 ILE CG1 C 13 31.105 0.100 . 1 . . . . A 8 ILE CG1 . 25850 1 69 . 1 1 8 8 ILE CG2 C 13 17.069 0.100 . 1 . . . . A 8 ILE CG2 . 25850 1 70 . 1 1 8 8 ILE CD1 C 13 13.761 0.100 . 1 . . . . A 8 ILE CD1 . 25850 1 71 . 1 1 8 8 ILE N N 15 119.915 0.100 . 1 . . . . A 8 ILE N . 25850 1 72 . 1 1 9 9 ALA H H 1 7.597 0.020 . 1 . . . . A 9 ALA H . 25850 1 73 . 1 1 9 9 ALA HA H 1 4.235 0.020 . 1 . . . . A 9 ALA HA . 25850 1 74 . 1 1 9 9 ALA HB1 H 1 1.454 0.020 . 1 . . . . A 9 ALA HB1 . 25850 1 75 . 1 1 9 9 ALA HB2 H 1 1.454 0.020 . 1 . . . . A 9 ALA HB2 . 25850 1 76 . 1 1 9 9 ALA HB3 H 1 1.454 0.020 . 1 . . . . A 9 ALA HB3 . 25850 1 77 . 1 1 9 9 ALA C C 13 180.624 0.100 . 1 . . . . A 9 ALA C . 25850 1 78 . 1 1 9 9 ALA CA C 13 54.922 0.100 . 1 . . . . A 9 ALA CA . 25850 1 79 . 1 1 9 9 ALA CB C 13 17.710 0.100 . 1 . . . . A 9 ALA CB . 25850 1 80 . 1 1 9 9 ALA N N 15 121.268 0.100 . 1 . . . . A 9 ALA N . 25850 1 81 . 1 1 10 10 LYS H H 1 7.569 0.020 . 1 . . . . A 10 LYS H . 25850 1 82 . 1 1 10 10 LYS HA H 1 4.011 0.020 . 1 . . . . A 10 LYS HA . 25850 1 83 . 1 1 10 10 LYS HB2 H 1 1.726 0.020 . 2 . . . . A 10 LYS HB2 . 25850 1 84 . 1 1 10 10 LYS HB3 H 1 1.686 0.020 . 2 . . . . A 10 LYS HB3 . 25850 1 85 . 1 1 10 10 LYS HG2 H 1 1.429 0.020 . 2 . . . . A 10 LYS HG2 . 25850 1 86 . 1 1 10 10 LYS HG3 H 1 1.148 0.020 . 2 . . . . A 10 LYS HG3 . 25850 1 87 . 1 1 10 10 LYS HD2 H 1 1.514 0.020 . 1 . . . . A 10 LYS HD2 . 25850 1 88 . 1 1 10 10 LYS HD3 H 1 1.514 0.020 . 1 . . . . A 10 LYS HD3 . 25850 1 89 . 1 1 10 10 LYS HE2 H 1 2.749 0.020 . 1 . . . . A 10 LYS HE2 . 25850 1 90 . 1 1 10 10 LYS HE3 H 1 2.749 0.020 . 1 . . . . A 10 LYS HE3 . 25850 1 91 . 1 1 10 10 LYS C C 13 180.034 0.100 . 1 . . . . A 10 LYS C . 25850 1 92 . 1 1 10 10 LYS CA C 13 59.264 0.100 . 1 . . . . A 10 LYS CA . 25850 1 93 . 1 1 10 10 LYS CB C 13 31.744 0.100 . 1 . . . . A 10 LYS CB . 25850 1 94 . 1 1 10 10 LYS CG C 13 24.817 0.100 . 1 . . . . A 10 LYS CG . 25850 1 95 . 1 1 10 10 LYS CD C 13 29.229 0.100 . 1 . . . . A 10 LYS CD . 25850 1 96 . 1 1 10 10 LYS CE C 13 41.809 0.100 . 1 . . . . A 10 LYS CE . 25850 1 97 . 1 1 10 10 LYS N N 15 118.798 0.100 . 1 . . . . A 10 LYS N . 25850 1 98 . 1 1 11 11 PHE H H 1 8.347 0.020 . 1 . . . . A 11 PHE H . 25850 1 99 . 1 1 11 11 PHE HA H 1 4.728 0.020 . 1 . . . . A 11 PHE HA . 25850 1 100 . 1 1 11 11 PHE HB2 H 1 2.975 0.020 . 2 . . . . A 11 PHE HB2 . 25850 1 101 . 1 1 11 11 PHE HB3 H 1 3.362 0.020 . 2 . . . . A 11 PHE HB3 . 25850 1 102 . 1 1 11 11 PHE HD1 H 1 7.104 0.020 . 1 . . . . A 11 PHE HD1 . 25850 1 103 . 1 1 11 11 PHE HD2 H 1 7.104 0.020 . 1 . . . . A 11 PHE HD2 . 25850 1 104 . 1 1 11 11 PHE HE1 H 1 7.354 0.020 . 1 . . . . A 11 PHE HE1 . 25850 1 105 . 1 1 11 11 PHE HE2 H 1 7.354 0.020 . 1 . . . . A 11 PHE HE2 . 25850 1 106 . 1 1 11 11 PHE HZ H 1 7.279 0.020 . 1 . . . . A 11 PHE HZ . 25850 1 107 . 1 1 11 11 PHE C C 13 178.445 0.100 . 1 . . . . A 11 PHE C . 25850 1 108 . 1 1 11 11 PHE CA C 13 59.549 0.100 . 1 . . . . A 11 PHE CA . 25850 1 109 . 1 1 11 11 PHE CB C 13 39.001 0.100 . 1 . . . . A 11 PHE CB . 25850 1 110 . 1 1 11 11 PHE CD1 C 13 131.054 0.100 . 1 . . . . A 11 PHE CD1 . 25850 1 111 . 1 1 11 11 PHE CD2 C 13 131.054 0.100 . 1 . . . . A 11 PHE CD2 . 25850 1 112 . 1 1 11 11 PHE CE1 C 13 131.550 0.100 . 1 . . . . A 11 PHE CE1 . 25850 1 113 . 1 1 11 11 PHE CE2 C 13 131.550 0.100 . 1 . . . . A 11 PHE CE2 . 25850 1 114 . 1 1 11 11 PHE CZ C 13 129.712 0.100 . 1 . . . . A 11 PHE CZ . 25850 1 115 . 1 1 11 11 PHE N N 15 121.394 0.100 . 1 . . . . A 11 PHE N . 25850 1 116 . 1 1 12 12 GLU H H 1 9.184 0.020 . 1 . . . . A 12 GLU H . 25850 1 117 . 1 1 12 12 GLU HA H 1 4.127 0.020 . 1 . . . . A 12 GLU HA . 25850 1 118 . 1 1 12 12 GLU HB2 H 1 2.249 0.020 . 2 . . . . A 12 GLU HB2 . 25850 1 119 . 1 1 12 12 GLU HB3 H 1 2.037 0.020 . 2 . . . . A 12 GLU HB3 . 25850 1 120 . 1 1 12 12 GLU HG2 H 1 2.497 0.020 . 2 . . . . A 12 GLU HG2 . 25850 1 121 . 1 1 12 12 GLU HG3 H 1 2.173 0.020 . 2 . . . . A 12 GLU HG3 . 25850 1 122 . 1 1 12 12 GLU C C 13 179.600 0.100 . 1 . . . . A 12 GLU C . 25850 1 123 . 1 1 12 12 GLU CA C 13 59.803 0.100 . 1 . . . . A 12 GLU CA . 25850 1 124 . 1 1 12 12 GLU CB C 13 29.488 0.100 . 1 . . . . A 12 GLU CB . 25850 1 125 . 1 1 12 12 GLU CG C 13 37.015 0.100 . 1 . . . . A 12 GLU CG . 25850 1 126 . 1 1 12 12 GLU N N 15 121.864 0.100 . 1 . . . . A 12 GLU N . 25850 1 127 . 1 1 13 13 LYS H H 1 7.800 0.020 . 1 . . . . A 13 LYS H . 25850 1 128 . 1 1 13 13 LYS HA H 1 4.127 0.020 . 1 . . . . A 13 LYS HA . 25850 1 129 . 1 1 13 13 LYS HB2 H 1 1.955 0.020 . 1 . . . . A 13 LYS HB2 . 25850 1 130 . 1 1 13 13 LYS HB3 H 1 1.955 0.020 . 1 . . . . A 13 LYS HB3 . 25850 1 131 . 1 1 13 13 LYS HG2 H 1 1.663 0.020 . 2 . . . . A 13 LYS HG2 . 25850 1 132 . 1 1 13 13 LYS HG3 H 1 1.484 0.020 . 2 . . . . A 13 LYS HG3 . 25850 1 133 . 1 1 13 13 LYS HD2 H 1 1.702 0.020 . 1 . . . . A 13 LYS HD2 . 25850 1 134 . 1 1 13 13 LYS HD3 H 1 1.702 0.020 . 1 . . . . A 13 LYS HD3 . 25850 1 135 . 1 1 13 13 LYS HE2 H 1 2.981 0.020 . 1 . . . . A 13 LYS HE2 . 25850 1 136 . 1 1 13 13 LYS HE3 H 1 2.981 0.020 . 1 . . . . A 13 LYS HE3 . 25850 1 137 . 1 1 13 13 LYS C C 13 179.120 0.100 . 1 . . . . A 13 LYS C . 25850 1 138 . 1 1 13 13 LYS CA C 13 59.308 0.100 . 1 . . . . A 13 LYS CA . 25850 1 139 . 1 1 13 13 LYS CB C 13 32.147 0.100 . 1 . . . . A 13 LYS CB . 25850 1 140 . 1 1 13 13 LYS CG C 13 25.225 0.100 . 1 . . . . A 13 LYS CG . 25850 1 141 . 1 1 13 13 LYS CD C 13 29.106 0.100 . 1 . . . . A 13 LYS CD . 25850 1 142 . 1 1 13 13 LYS CE C 13 42.020 0.100 . 1 . . . . A 13 LYS CE . 25850 1 143 . 1 1 13 13 LYS N N 15 120.472 0.100 . 1 . . . . A 13 LYS N . 25850 1 144 . 1 1 14 14 ALA H H 1 8.001 0.020 . 1 . . . . A 14 ALA H . 25850 1 145 . 1 1 14 14 ALA HA H 1 4.205 0.020 . 1 . . . . A 14 ALA HA . 25850 1 146 . 1 1 14 14 ALA HB1 H 1 1.701 0.020 . 1 . . . . A 14 ALA HB1 . 25850 1 147 . 1 1 14 14 ALA HB2 H 1 1.701 0.020 . 1 . . . . A 14 ALA HB2 . 25850 1 148 . 1 1 14 14 ALA HB3 H 1 1.701 0.020 . 1 . . . . A 14 ALA HB3 . 25850 1 149 . 1 1 14 14 ALA C C 13 180.640 0.100 . 1 . . . . A 14 ALA C . 25850 1 150 . 1 1 14 14 ALA CA C 13 54.756 0.100 . 1 . . . . A 14 ALA CA . 25850 1 151 . 1 1 14 14 ALA CB C 13 17.913 0.100 . 1 . . . . A 14 ALA CB . 25850 1 152 . 1 1 14 14 ALA N N 15 122.753 0.100 . 1 . . . . A 14 ALA N . 25850 1 153 . 1 1 15 15 TYR H H 1 8.906 0.020 . 1 . . . . A 15 TYR H . 25850 1 154 . 1 1 15 15 TYR HA H 1 3.850 0.020 . 1 . . . . A 15 TYR HA . 25850 1 155 . 1 1 15 15 TYR HB2 H 1 3.100 0.020 . 1 . . . . A 15 TYR HB2 . 25850 1 156 . 1 1 15 15 TYR HB3 H 1 3.357 0.020 . 1 . . . . A 15 TYR HB3 . 25850 1 157 . 1 1 15 15 TYR HD1 H 1 7.168 0.020 . 1 . . . . A 15 TYR HD1 . 25850 1 158 . 1 1 15 15 TYR HD2 H 1 7.168 0.020 . 1 . . . . A 15 TYR HD2 . 25850 1 159 . 1 1 15 15 TYR HE1 H 1 6.730 0.020 . 1 . . . . A 15 TYR HE1 . 25850 1 160 . 1 1 15 15 TYR HE2 H 1 6.730 0.020 . 1 . . . . A 15 TYR HE2 . 25850 1 161 . 1 1 15 15 TYR C C 13 175.898 0.100 . 1 . . . . A 15 TYR C . 25850 1 162 . 1 1 15 15 TYR CA C 13 62.008 0.100 . 1 . . . . A 15 TYR CA . 25850 1 163 . 1 1 15 15 TYR CB C 13 37.756 0.100 . 1 . . . . A 15 TYR CB . 25850 1 164 . 1 1 15 15 TYR CD1 C 13 132.590 0.100 . 1 . . . . A 15 TYR CD1 . 25850 1 165 . 1 1 15 15 TYR CD2 C 13 132.590 0.100 . 1 . . . . A 15 TYR CD2 . 25850 1 166 . 1 1 15 15 TYR CE1 C 13 118.412 0.100 . 1 . . . . A 15 TYR CE1 . 25850 1 167 . 1 1 15 15 TYR CE2 C 13 118.412 0.100 . 1 . . . . A 15 TYR CE2 . 25850 1 168 . 1 1 16 16 LYS H H 1 8.059 0.020 . 1 . . . . A 16 LYS H . 25850 1 169 . 1 1 16 16 LYS HA H 1 3.985 0.020 . 1 . . . . A 16 LYS HA . 25850 1 170 . 1 1 16 16 LYS HB2 H 1 1.983 0.020 . 1 . . . . A 16 LYS HB2 . 25850 1 171 . 1 1 16 16 LYS HB3 H 1 1.983 0.020 . 1 . . . . A 16 LYS HB3 . 25850 1 172 . 1 1 16 16 LYS HG2 H 1 1.694 0.020 . 2 . . . . A 16 LYS HG2 . 25850 1 173 . 1 1 16 16 LYS HG3 H 1 1.625 0.020 . 2 . . . . A 16 LYS HG3 . 25850 1 174 . 1 1 16 16 LYS HD2 H 1 1.773 0.020 . 1 . . . . A 16 LYS HD2 . 25850 1 175 . 1 1 16 16 LYS HD3 H 1 1.773 0.020 . 1 . . . . A 16 LYS HD3 . 25850 1 176 . 1 1 16 16 LYS HE2 H 1 3.034 0.020 . 1 . . . . A 16 LYS HE2 . 25850 1 177 . 1 1 16 16 LYS HE3 H 1 3.034 0.020 . 1 . . . . A 16 LYS HE3 . 25850 1 178 . 1 1 16 16 LYS C C 13 179.068 0.100 . 1 . . . . A 16 LYS C . 25850 1 179 . 1 1 16 16 LYS CA C 13 58.622 0.100 . 1 . . . . A 16 LYS CA . 25850 1 180 . 1 1 16 16 LYS CB C 13 32.131 0.100 . 1 . . . . A 16 LYS CB . 25850 1 181 . 1 1 16 16 LYS CG C 13 24.897 0.100 . 1 . . . . A 16 LYS CG . 25850 1 182 . 1 1 16 16 LYS CD C 13 28.710 0.100 . 1 . . . . A 16 LYS CD . 25850 1 183 . 1 1 16 16 LYS CE C 13 42.016 0.100 . 1 . . . . A 16 LYS CE . 25850 1 184 . 1 1 16 16 LYS N N 15 119.082 0.100 . 1 . . . . A 16 LYS N . 25850 1 185 . 1 1 17 17 LYS H H 1 7.900 0.020 . 1 . . . . A 17 LYS H . 25850 1 186 . 1 1 17 17 LYS HA H 1 4.142 0.020 . 1 . . . . A 17 LYS HA . 25850 1 187 . 1 1 17 17 LYS HB2 H 1 1.874 0.020 . 1 . . . . A 17 LYS HB2 . 25850 1 188 . 1 1 17 17 LYS HB3 H 1 1.874 0.020 . 1 . . . . A 17 LYS HB3 . 25850 1 189 . 1 1 17 17 LYS HG2 H 1 1.524 0.020 . 1 . . . . A 17 LYS HG2 . 25850 1 190 . 1 1 17 17 LYS HG3 H 1 1.524 0.020 . 1 . . . . A 17 LYS HG3 . 25850 1 191 . 1 1 17 17 LYS HD2 H 1 1.712 0.020 . 1 . . . . A 17 LYS HD2 . 25850 1 192 . 1 1 17 17 LYS HD3 H 1 1.712 0.020 . 1 . . . . A 17 LYS HD3 . 25850 1 193 . 1 1 17 17 LYS HE2 H 1 2.952 0.020 . 1 . . . . A 17 LYS HE2 . 25850 1 194 . 1 1 17 17 LYS HE3 H 1 2.952 0.020 . 1 . . . . A 17 LYS HE3 . 25850 1 195 . 1 1 17 17 LYS CA C 13 57.951 0.100 . 1 . . . . A 17 LYS CA . 25850 1 196 . 1 1 17 17 LYS CB C 13 31.802 0.100 . 1 . . . . A 17 LYS CB . 25850 1 197 . 1 1 17 17 LYS CG C 13 24.356 0.100 . 1 . . . . A 17 LYS CG . 25850 1 198 . 1 1 17 17 LYS CD C 13 28.354 0.100 . 1 . . . . A 17 LYS CD . 25850 1 199 . 1 1 17 17 LYS CE C 13 41.945 0.100 . 1 . . . . A 17 LYS CE . 25850 1 200 . 1 1 17 17 LYS N N 15 119.708 0.100 . 1 . . . . A 17 LYS N . 25850 1 201 . 1 1 18 18 ALA H H 1 7.854 0.020 . 1 . . . . A 18 ALA H . 25850 1 202 . 1 1 18 18 ALA HA H 1 4.329 0.020 . 1 . . . . A 18 ALA HA . 25850 1 203 . 1 1 18 18 ALA HB1 H 1 1.458 0.020 . 1 . . . . A 18 ALA HB1 . 25850 1 204 . 1 1 18 18 ALA HB2 H 1 1.458 0.020 . 1 . . . . A 18 ALA HB2 . 25850 1 205 . 1 1 18 18 ALA HB3 H 1 1.458 0.020 . 1 . . . . A 18 ALA HB3 . 25850 1 206 . 1 1 18 18 ALA C C 13 179.572 0.100 . 1 . . . . A 18 ALA C . 25850 1 207 . 1 1 18 18 ALA CA C 13 54.110 0.100 . 1 . . . . A 18 ALA CA . 25850 1 208 . 1 1 18 18 ALA CB C 13 18.782 0.100 . 1 . . . . A 18 ALA CB . 25850 1 209 . 1 1 18 18 ALA N N 15 120.860 0.100 . 1 . . . . A 18 ALA N . 25850 1 210 . 1 1 19 19 GLU H H 1 8.690 0.020 . 1 . . . . A 19 GLU H . 25850 1 211 . 1 1 19 19 GLU HA H 1 4.240 0.020 . 1 . . . . A 19 GLU HA . 25850 1 212 . 1 1 19 19 GLU HB2 H 1 2.088 0.020 . 2 . . . . A 19 GLU HB2 . 25850 1 213 . 1 1 19 19 GLU HB3 H 1 1.592 0.020 . 2 . . . . A 19 GLU HB3 . 25850 1 214 . 1 1 19 19 GLU HG2 H 1 2.109 0.020 . 2 . . . . A 19 GLU HG2 . 25850 1 215 . 1 1 19 19 GLU HG3 H 1 2.067 0.020 . 2 . . . . A 19 GLU HG3 . 25850 1 216 . 1 1 19 19 GLU C C 13 180.268 0.100 . 1 . . . . A 19 GLU C . 25850 1 217 . 1 1 19 19 GLU CA C 13 59.147 0.100 . 1 . . . . A 19 GLU CA . 25850 1 218 . 1 1 19 19 GLU CB C 13 29.889 0.100 . 1 . . . . A 19 GLU CB . 25850 1 219 . 1 1 19 19 GLU CG C 13 36.287 0.100 . 1 . . . . A 19 GLU CG . 25850 1 220 . 1 1 19 19 GLU N N 15 120.904 0.100 . 1 . . . . A 19 GLU N . 25850 1 221 . 1 1 20 20 GLU H H 1 7.898 0.020 . 1 . . . . A 20 GLU H . 25850 1 222 . 1 1 20 20 GLU HA H 1 4.024 0.020 . 1 . . . . A 20 GLU HA . 25850 1 223 . 1 1 20 20 GLU HB2 H 1 2.237 0.020 . 2 . . . . A 20 GLU HB2 . 25850 1 224 . 1 1 20 20 GLU HB3 H 1 2.109 0.020 . 2 . . . . A 20 GLU HB3 . 25850 1 225 . 1 1 20 20 GLU HG2 H 1 2.482 0.020 . 2 . . . . A 20 GLU HG2 . 25850 1 226 . 1 1 20 20 GLU HG3 H 1 2.243 0.020 . 2 . . . . A 20 GLU HG3 . 25850 1 227 . 1 1 20 20 GLU C C 13 177.975 0.100 . 1 . . . . A 20 GLU C . 25850 1 228 . 1 1 20 20 GLU CA C 13 58.935 0.100 . 1 . . . . A 20 GLU CA . 25850 1 229 . 1 1 20 20 GLU CB C 13 29.549 0.100 . 1 . . . . A 20 GLU CB . 25850 1 230 . 1 1 20 20 GLU CG C 13 36.228 0.100 . 1 . . . . A 20 GLU CG . 25850 1 231 . 1 1 20 20 GLU N N 15 120.868 0.100 . 1 . . . . A 20 GLU N . 25850 1 232 . 1 1 21 21 LEU H H 1 7.393 0.020 . 1 . . . . A 21 LEU H . 25850 1 233 . 1 1 21 21 LEU HA H 1 4.351 0.020 . 1 . . . . A 21 LEU HA . 25850 1 234 . 1 1 21 21 LEU HB2 H 1 1.637 0.020 . 1 . . . . A 21 LEU HB2 . 25850 1 235 . 1 1 21 21 LEU HB3 H 1 1.637 0.020 . 1 . . . . A 21 LEU HB3 . 25850 1 236 . 1 1 21 21 LEU HG H 1 1.721 0.020 . 1 . . . . A 21 LEU HG . 25850 1 237 . 1 1 21 21 LEU HD11 H 1 0.845 0.020 . 2 . . . . A 21 LEU HD11 . 25850 1 238 . 1 1 21 21 LEU HD12 H 1 0.845 0.020 . 2 . . . . A 21 LEU HD12 . 25850 1 239 . 1 1 21 21 LEU HD13 H 1 0.845 0.020 . 2 . . . . A 21 LEU HD13 . 25850 1 240 . 1 1 21 21 LEU HD21 H 1 0.842 0.020 . 2 . . . . A 21 LEU HD21 . 25850 1 241 . 1 1 21 21 LEU HD22 H 1 0.842 0.020 . 2 . . . . A 21 LEU HD22 . 25850 1 242 . 1 1 21 21 LEU HD23 H 1 0.842 0.020 . 2 . . . . A 21 LEU HD23 . 25850 1 243 . 1 1 21 21 LEU C C 13 176.199 0.100 . 1 . . . . A 21 LEU C . 25850 1 244 . 1 1 21 21 LEU CA C 13 54.158 0.100 . 1 . . . . A 21 LEU CA . 25850 1 245 . 1 1 21 21 LEU CB C 13 41.776 0.100 . 1 . . . . A 21 LEU CB . 25850 1 246 . 1 1 21 21 LEU CG C 13 26.626 0.100 . 1 . . . . A 21 LEU CG . 25850 1 247 . 1 1 21 21 LEU CD1 C 13 25.220 0.100 . 1 . . . . A 21 LEU CD1 . 25850 1 248 . 1 1 21 21 LEU CD2 C 13 22.190 0.100 . 1 . . . . A 21 LEU CD2 . 25850 1 249 . 1 1 21 21 LEU N N 15 116.701 0.100 . 1 . . . . A 21 LEU N . 25850 1 250 . 1 1 22 22 ASN H H 1 7.994 0.020 . 1 . . . . A 22 ASN H . 25850 1 251 . 1 1 22 22 ASN HA H 1 4.278 0.020 . 1 . . . . A 22 ASN HA . 25850 1 252 . 1 1 22 22 ASN HB2 H 1 3.164 0.020 . 2 . . . . A 22 ASN HB2 . 25850 1 253 . 1 1 22 22 ASN HB3 H 1 2.725 0.020 . 2 . . . . A 22 ASN HB3 . 25850 1 254 . 1 1 22 22 ASN HD21 H 1 7.566 0.020 . 1 . . . . A 22 ASN HD21 . 25850 1 255 . 1 1 22 22 ASN HD22 H 1 6.852 0.020 . 1 . . . . A 22 ASN HD22 . 25850 1 256 . 1 1 22 22 ASN C C 13 174.436 0.100 . 1 . . . . A 22 ASN C . 25850 1 257 . 1 1 22 22 ASN CA C 13 54.104 0.100 . 1 . . . . A 22 ASN CA . 25850 1 258 . 1 1 22 22 ASN CB C 13 37.364 0.100 . 1 . . . . A 22 ASN CB . 25850 1 259 . 1 1 22 22 ASN N N 15 118.557 0.100 . 1 . . . . A 22 ASN N . 25850 1 260 . 1 1 22 22 ASN ND2 N 15 112.248 0.100 . 1 . . . . A 22 ASN ND2 . 25850 1 261 . 1 1 23 23 GLN H H 1 8.378 0.020 . 1 . . . . A 23 GLN H . 25850 1 262 . 1 1 23 23 GLN HA H 1 4.557 0.020 . 1 . . . . A 23 GLN HA . 25850 1 263 . 1 1 23 23 GLN HB2 H 1 2.077 0.020 . 1 . . . . A 23 GLN HB2 . 25850 1 264 . 1 1 23 23 GLN HB3 H 1 2.077 0.020 . 1 . . . . A 23 GLN HB3 . 25850 1 265 . 1 1 23 23 GLN HG2 H 1 2.314 0.020 . 2 . . . . A 23 GLN HG2 . 25850 1 266 . 1 1 23 23 GLN HG3 H 1 2.201 0.020 . 2 . . . . A 23 GLN HG3 . 25850 1 267 . 1 1 23 23 GLN HE21 H 1 7.347 0.020 . 1 . . . . A 23 GLN HE21 . 25850 1 268 . 1 1 23 23 GLN HE22 H 1 6.507 0.020 . 1 . . . . A 23 GLN HE22 . 25850 1 269 . 1 1 23 23 GLN C C 13 176.685 0.100 . 1 . . . . A 23 GLN C . 25850 1 270 . 1 1 23 23 GLN CA C 13 53.983 0.100 . 1 . . . . A 23 GLN CA . 25850 1 271 . 1 1 23 23 GLN CB C 13 27.770 0.100 . 1 . . . . A 23 GLN CB . 25850 1 272 . 1 1 23 23 GLN CG C 13 33.498 0.100 . 1 . . . . A 23 GLN CG . 25850 1 273 . 1 1 23 23 GLN N N 15 118.344 0.100 . 1 . . . . A 23 GLN N . 25850 1 274 . 1 1 23 23 GLN NE2 N 15 109.840 0.100 . 1 . . . . A 23 GLN NE2 . 25850 1 275 . 1 1 24 24 GLY H H 1 8.468 0.020 . 1 . . . . A 24 GLY H . 25850 1 276 . 1 1 24 24 GLY HA2 H 1 3.761 0.020 . 1 . . . . A 24 GLY HA2 . 25850 1 277 . 1 1 24 24 GLY HA3 H 1 3.917 0.020 . 1 . . . . A 24 GLY HA3 . 25850 1 278 . 1 1 24 24 GLY C C 13 175.286 0.100 . 1 . . . . A 24 GLY C . 25850 1 279 . 1 1 24 24 GLY CA C 13 47.823 0.100 . 1 . . . . A 24 GLY CA . 25850 1 280 . 1 1 24 24 GLY N N 15 113.071 0.100 . 1 . . . . A 24 GLY N . 25850 1 281 . 1 1 25 25 GLU H H 1 9.067 0.020 . 1 . . . . A 25 GLU H . 25850 1 282 . 1 1 25 25 GLU HA H 1 4.124 0.020 . 1 . . . . A 25 GLU HA . 25850 1 283 . 1 1 25 25 GLU HB2 H 1 2.219 0.020 . 2 . . . . A 25 GLU HB2 . 25850 1 284 . 1 1 25 25 GLU HB3 H 1 2.129 0.020 . 2 . . . . A 25 GLU HB3 . 25850 1 285 . 1 1 25 25 GLU HG2 H 1 2.363 0.020 . 2 . . . . A 25 GLU HG2 . 25850 1 286 . 1 1 25 25 GLU HG3 H 1 2.494 0.020 . 2 . . . . A 25 GLU HG3 . 25850 1 287 . 1 1 25 25 GLU C C 13 176.495 0.100 . 1 . . . . A 25 GLU C . 25850 1 288 . 1 1 25 25 GLU CA C 13 59.621 0.100 . 1 . . . . A 25 GLU CA . 25850 1 289 . 1 1 25 25 GLU CB C 13 28.636 0.100 . 1 . . . . A 25 GLU CB . 25850 1 290 . 1 1 25 25 GLU CG C 13 35.738 0.100 . 1 . . . . A 25 GLU CG . 25850 1 291 . 1 1 25 25 GLU N N 15 120.717 0.100 . 1 . . . . A 25 GLU N . 25850 1 292 . 1 1 26 26 LEU H H 1 7.165 0.020 . 1 . . . . A 26 LEU H . 25850 1 293 . 1 1 26 26 LEU HA H 1 4.222 0.020 . 1 . . . . A 26 LEU HA . 25850 1 294 . 1 1 26 26 LEU HB2 H 1 1.863 0.020 . 2 . . . . A 26 LEU HB2 . 25850 1 295 . 1 1 26 26 LEU HB3 H 1 1.505 0.020 . 2 . . . . A 26 LEU HB3 . 25850 1 296 . 1 1 26 26 LEU HG H 1 1.722 0.020 . 1 . . . . A 26 LEU HG . 25850 1 297 . 1 1 26 26 LEU HD11 H 1 0.935 0.020 . 2 . . . . A 26 LEU HD11 . 25850 1 298 . 1 1 26 26 LEU HD12 H 1 0.935 0.020 . 2 . . . . A 26 LEU HD12 . 25850 1 299 . 1 1 26 26 LEU HD13 H 1 0.935 0.020 . 2 . . . . A 26 LEU HD13 . 25850 1 300 . 1 1 26 26 LEU HD21 H 1 0.894 0.020 . 2 . . . . A 26 LEU HD21 . 25850 1 301 . 1 1 26 26 LEU HD22 H 1 0.894 0.020 . 2 . . . . A 26 LEU HD22 . 25850 1 302 . 1 1 26 26 LEU HD23 H 1 0.894 0.020 . 2 . . . . A 26 LEU HD23 . 25850 1 303 . 1 1 26 26 LEU C C 13 180.590 0.100 . 1 . . . . A 26 LEU C . 25850 1 304 . 1 1 26 26 LEU CA C 13 56.882 0.100 . 1 . . . . A 26 LEU CA . 25850 1 305 . 1 1 26 26 LEU CB C 13 41.231 0.100 . 1 . . . . A 26 LEU CB . 25850 1 306 . 1 1 26 26 LEU CG C 13 27.223 0.100 . 1 . . . . A 26 LEU CG . 25850 1 307 . 1 1 26 26 LEU CD1 C 13 24.716 0.100 . 1 . . . . A 26 LEU CD1 . 25850 1 308 . 1 1 26 26 LEU CD2 C 13 22.418 0.100 . 1 . . . . A 26 LEU CD2 . 25850 1 309 . 1 1 27 27 MET H H 1 8.203 0.020 . 1 . . . . A 27 MET H . 25850 1 310 . 1 1 27 27 MET HA H 1 3.932 0.020 . 1 . . . . A 27 MET HA . 25850 1 311 . 1 1 27 27 MET HB2 H 1 2.421 0.020 . 1 . . . . A 27 MET HB2 . 25850 1 312 . 1 1 27 27 MET HB3 H 1 2.124 0.020 . 1 . . . . A 27 MET HB3 . 25850 1 313 . 1 1 27 27 MET HG2 H 1 1.955 0.020 . 2 . . . . A 27 MET HG2 . 25850 1 314 . 1 1 27 27 MET HG3 H 1 2.290 0.020 . 2 . . . . A 27 MET HG3 . 25850 1 315 . 1 1 27 27 MET HE1 H 1 1.996 0.020 . 1 . . . . A 27 MET HE1 . 25850 1 316 . 1 1 27 27 MET HE2 H 1 1.996 0.020 . 1 . . . . A 27 MET HE2 . 25850 1 317 . 1 1 27 27 MET HE3 H 1 1.996 0.020 . 1 . . . . A 27 MET HE3 . 25850 1 318 . 1 1 27 27 MET CA C 13 59.980 0.100 . 1 . . . . A 27 MET CA . 25850 1 319 . 1 1 27 27 MET CB C 13 34.537 0.100 . 1 . . . . A 27 MET CB . 25850 1 320 . 1 1 27 27 MET CG C 13 32.382 0.100 . 1 . . . . A 27 MET CG . 25850 1 321 . 1 1 27 27 MET CE C 13 16.664 0.100 . 1 . . . . A 27 MET CE . 25850 1 322 . 1 1 27 27 MET N N 15 121.053 0.100 . 1 . . . . A 27 MET N . 25850 1 323 . 1 1 28 28 GLY H H 1 8.527 0.020 . 1 . . . . A 28 GLY H . 25850 1 324 . 1 1 28 28 GLY HA2 H 1 3.198 0.020 . 1 . . . . A 28 GLY HA2 . 25850 1 325 . 1 1 28 28 GLY HA3 H 1 2.816 0.020 . 1 . . . . A 28 GLY HA3 . 25850 1 326 . 1 1 28 28 GLY C C 13 174.900 0.100 . 1 . . . . A 28 GLY C . 25850 1 327 . 1 1 28 28 GLY CA C 13 47.672 0.100 . 1 . . . . A 28 GLY CA . 25850 1 328 . 1 1 28 28 GLY N N 15 106.038 0.100 . 1 . . . . A 28 GLY N . 25850 1 329 . 1 1 29 29 ARG H H 1 8.224 0.020 . 1 . . . . A 29 ARG H . 25850 1 330 . 1 1 29 29 ARG HA H 1 4.195 0.020 . 1 . . . . A 29 ARG HA . 25850 1 331 . 1 1 29 29 ARG HB2 H 1 2.019 0.020 . 1 . . . . A 29 ARG HB2 . 25850 1 332 . 1 1 29 29 ARG HB3 H 1 2.019 0.020 . 1 . . . . A 29 ARG HB3 . 25850 1 333 . 1 1 29 29 ARG HG2 H 1 2.129 0.020 . 2 . . . . A 29 ARG HG2 . 25850 1 334 . 1 1 29 29 ARG HG3 H 1 1.848 0.020 . 2 . . . . A 29 ARG HG3 . 25850 1 335 . 1 1 29 29 ARG HD2 H 1 3.300 0.020 . 2 . . . . A 29 ARG HD2 . 25850 1 336 . 1 1 29 29 ARG HD3 H 1 3.188 0.020 . 2 . . . . A 29 ARG HD3 . 25850 1 337 . 1 1 29 29 ARG C C 13 178.065 0.100 . 1 . . . . A 29 ARG C . 25850 1 338 . 1 1 29 29 ARG CA C 13 59.974 0.100 . 1 . . . . A 29 ARG CA . 25850 1 339 . 1 1 29 29 ARG CB C 13 30.416 0.100 . 1 . . . . A 29 ARG CB . 25850 1 340 . 1 1 29 29 ARG CG C 13 28.013 0.100 . 1 . . . . A 29 ARG CG . 25850 1 341 . 1 1 29 29 ARG CD C 13 43.666 0.100 . 1 . . . . A 29 ARG CD . 25850 1 342 . 1 1 29 29 ARG N N 15 120.201 0.100 . 1 . . . . A 29 ARG N . 25850 1 343 . 1 1 30 30 ALA H H 1 7.876 0.020 . 1 . . . . A 30 ALA H . 25850 1 344 . 1 1 30 30 ALA HA H 1 4.197 0.020 . 1 . . . . A 30 ALA HA . 25850 1 345 . 1 1 30 30 ALA HB1 H 1 1.807 0.020 . 1 . . . . A 30 ALA HB1 . 25850 1 346 . 1 1 30 30 ALA HB2 H 1 1.807 0.020 . 1 . . . . A 30 ALA HB2 . 25850 1 347 . 1 1 30 30 ALA HB3 H 1 1.807 0.020 . 1 . . . . A 30 ALA HB3 . 25850 1 348 . 1 1 30 30 ALA C C 13 179.433 0.100 . 1 . . . . A 30 ALA C . 25850 1 349 . 1 1 30 30 ALA CA C 13 55.838 0.100 . 1 . . . . A 30 ALA CA . 25850 1 350 . 1 1 30 30 ALA CB C 13 18.269 0.100 . 1 . . . . A 30 ALA CB . 25850 1 351 . 1 1 30 30 ALA N N 15 121.394 0.100 . 1 . . . . A 30 ALA N . 25850 1 352 . 1 1 31 31 LEU H H 1 8.084 0.020 . 1 . . . . A 31 LEU H . 25850 1 353 . 1 1 31 31 LEU HA H 1 4.003 0.020 . 1 . . . . A 31 LEU HA . 25850 1 354 . 1 1 31 31 LEU HB2 H 1 1.517 0.020 . 1 . . . . A 31 LEU HB2 . 25850 1 355 . 1 1 31 31 LEU HB3 H 1 2.026 0.020 . 1 . . . . A 31 LEU HB3 . 25850 1 356 . 1 1 31 31 LEU HG H 1 2.044 0.020 . 1 . . . . A 31 LEU HG . 25850 1 357 . 1 1 31 31 LEU HD11 H 1 0.769 0.020 . 2 . . . . A 31 LEU HD11 . 25850 1 358 . 1 1 31 31 LEU HD12 H 1 0.769 0.020 . 2 . . . . A 31 LEU HD12 . 25850 1 359 . 1 1 31 31 LEU HD13 H 1 0.769 0.020 . 2 . . . . A 31 LEU HD13 . 25850 1 360 . 1 1 31 31 LEU HD21 H 1 0.563 0.020 . 2 . . . . A 31 LEU HD21 . 25850 1 361 . 1 1 31 31 LEU HD22 H 1 0.563 0.020 . 2 . . . . A 31 LEU HD22 . 25850 1 362 . 1 1 31 31 LEU HD23 H 1 0.563 0.020 . 2 . . . . A 31 LEU HD23 . 25850 1 363 . 1 1 31 31 LEU C C 13 178.416 0.100 . 1 . . . . A 31 LEU C . 25850 1 364 . 1 1 31 31 LEU CA C 13 57.921 0.100 . 1 . . . . A 31 LEU CA . 25850 1 365 . 1 1 31 31 LEU CB C 13 42.463 0.100 . 1 . . . . A 31 LEU CB . 25850 1 366 . 1 1 31 31 LEU CG C 13 26.045 0.100 . 1 . . . . A 31 LEU CG . 25850 1 367 . 1 1 31 31 LEU CD1 C 13 25.948 0.100 . 1 . . . . A 31 LEU CD1 . 25850 1 368 . 1 1 31 31 LEU CD2 C 13 22.089 0.100 . 1 . . . . A 31 LEU CD2 . 25850 1 369 . 1 1 31 31 LEU N N 15 116.122 0.100 . 1 . . . . A 31 LEU N . 25850 1 370 . 1 1 32 32 TYR H H 1 8.562 0.020 . 1 . . . . A 32 TYR H . 25850 1 371 . 1 1 32 32 TYR HA H 1 4.063 0.020 . 1 . . . . A 32 TYR HA . 25850 1 372 . 1 1 32 32 TYR HB2 H 1 3.197 0.020 . 1 . . . . A 32 TYR HB2 . 25850 1 373 . 1 1 32 32 TYR HB3 H 1 3.302 0.020 . 1 . . . . A 32 TYR HB3 . 25850 1 374 . 1 1 32 32 TYR HD1 H 1 7.131 0.020 . 1 . . . . A 32 TYR HD1 . 25850 1 375 . 1 1 32 32 TYR HD2 H 1 7.131 0.020 . 1 . . . . A 32 TYR HD2 . 25850 1 376 . 1 1 32 32 TYR HE1 H 1 6.580 0.020 . 1 . . . . A 32 TYR HE1 . 25850 1 377 . 1 1 32 32 TYR HE2 H 1 6.580 0.020 . 1 . . . . A 32 TYR HE2 . 25850 1 378 . 1 1 32 32 TYR C C 13 176.310 0.100 . 1 . . . . A 32 TYR C . 25850 1 379 . 1 1 32 32 TYR CA C 13 61.992 0.100 . 1 . . . . A 32 TYR CA . 25850 1 380 . 1 1 32 32 TYR CB C 13 38.659 0.100 . 1 . . . . A 32 TYR CB . 25850 1 381 . 1 1 32 32 TYR CD1 C 13 131.852 0.100 . 1 . . . . A 32 TYR CD1 . 25850 1 382 . 1 1 32 32 TYR CD2 C 13 131.852 0.100 . 1 . . . . A 32 TYR CD2 . 25850 1 383 . 1 1 32 32 TYR CE1 C 13 118.197 0.100 . 1 . . . . A 32 TYR CE1 . 25850 1 384 . 1 1 32 32 TYR CE2 C 13 118.197 0.100 . 1 . . . . A 32 TYR CE2 . 25850 1 385 . 1 1 32 32 TYR N N 15 119.225 0.100 . 1 . . . . A 32 TYR N . 25850 1 386 . 1 1 33 33 ASN H H 1 8.213 0.020 . 1 . . . . A 33 ASN H . 25850 1 387 . 1 1 33 33 ASN HA H 1 4.068 0.020 . 1 . . . . A 33 ASN HA . 25850 1 388 . 1 1 33 33 ASN HB2 H 1 2.015 0.020 . 1 . . . . A 33 ASN HB2 . 25850 1 389 . 1 1 33 33 ASN HB3 H 1 2.015 0.020 . 1 . . . . A 33 ASN HB3 . 25850 1 390 . 1 1 33 33 ASN HD21 H 1 6.800 0.020 . 1 . . . . A 33 ASN HD21 . 25850 1 391 . 1 1 33 33 ASN HD22 H 1 6.800 0.020 . 1 . . . . A 33 ASN HD22 . 25850 1 392 . 1 1 33 33 ASN C C 13 178.353 0.100 . 1 . . . . A 33 ASN C . 25850 1 393 . 1 1 33 33 ASN CA C 13 55.858 0.100 . 1 . . . . A 33 ASN CA . 25850 1 394 . 1 1 33 33 ASN CB C 13 35.968 0.100 . 1 . . . . A 33 ASN CB . 25850 1 395 . 1 1 33 33 ASN N N 15 116.880 0.100 . 1 . . . . A 33 ASN N . 25850 1 396 . 1 1 33 33 ASN ND2 N 15 111.748 0.100 . 1 . . . . A 33 ASN ND2 . 25850 1 397 . 1 1 34 34 ILE H H 1 8.087 0.020 . 1 . . . . A 34 ILE H . 25850 1 398 . 1 1 34 34 ILE HA H 1 3.300 0.020 . 1 . . . . A 34 ILE HA . 25850 1 399 . 1 1 34 34 ILE HB H 1 1.434 0.020 . 1 . . . . A 34 ILE HB . 25850 1 400 . 1 1 34 34 ILE HG12 H 1 2.000 0.020 . 2 . . . . A 34 ILE HG12 . 25850 1 401 . 1 1 34 34 ILE HG13 H 1 0.762 0.020 . 2 . . . . A 34 ILE HG13 . 25850 1 402 . 1 1 34 34 ILE HG21 H 1 -0.211 0.020 . 1 . . . . A 34 ILE HG21 . 25850 1 403 . 1 1 34 34 ILE HG22 H 1 -0.211 0.020 . 1 . . . . A 34 ILE HG22 . 25850 1 404 . 1 1 34 34 ILE HG23 H 1 -0.211 0.020 . 1 . . . . A 34 ILE HG23 . 25850 1 405 . 1 1 34 34 ILE HD11 H 1 0.701 0.020 . 1 . . . . A 34 ILE HD11 . 25850 1 406 . 1 1 34 34 ILE HD12 H 1 0.701 0.020 . 1 . . . . A 34 ILE HD12 . 25850 1 407 . 1 1 34 34 ILE HD13 H 1 0.701 0.020 . 1 . . . . A 34 ILE HD13 . 25850 1 408 . 1 1 34 34 ILE C C 13 177.867 0.100 . 1 . . . . A 34 ILE C . 25850 1 409 . 1 1 34 34 ILE CA C 13 66.528 0.100 . 1 . . . . A 34 ILE CA . 25850 1 410 . 1 1 34 34 ILE CB C 13 37.839 0.100 . 1 . . . . A 34 ILE CB . 25850 1 411 . 1 1 34 34 ILE CG1 C 13 31.430 0.100 . 1 . . . . A 34 ILE CG1 . 25850 1 412 . 1 1 34 34 ILE CG2 C 13 16.110 0.100 . 1 . . . . A 34 ILE CG2 . 25850 1 413 . 1 1 34 34 ILE CD1 C 13 13.277 0.100 . 1 . . . . A 34 ILE CD1 . 25850 1 414 . 1 1 34 34 ILE N N 15 121.401 0.100 . 1 . . . . A 34 ILE N . 25850 1 415 . 1 1 35 35 GLY H H 1 7.922 0.020 . 1 . . . . A 35 GLY H . 25850 1 416 . 1 1 35 35 GLY HA2 H 1 2.989 0.020 . 2 . . . . A 35 GLY HA2 . 25850 1 417 . 1 1 35 35 GLY HA3 H 1 2.946 0.020 . 2 . . . . A 35 GLY HA3 . 25850 1 418 . 1 1 35 35 GLY C C 13 175.048 0.100 . 1 . . . . A 35 GLY C . 25850 1 419 . 1 1 35 35 GLY CA C 13 48.547 0.100 . 1 . . . . A 35 GLY CA . 25850 1 420 . 1 1 35 35 GLY N N 15 107.275 0.100 . 1 . . . . A 35 GLY N . 25850 1 421 . 1 1 36 36 LEU H H 1 8.177 0.020 . 1 . . . . A 36 LEU H . 25850 1 422 . 1 1 36 36 LEU HA H 1 4.048 0.020 . 1 . . . . A 36 LEU HA . 25850 1 423 . 1 1 36 36 LEU HB2 H 1 2.058 0.020 . 1 . . . . A 36 LEU HB2 . 25850 1 424 . 1 1 36 36 LEU HB3 H 1 1.325 0.020 . 1 . . . . A 36 LEU HB3 . 25850 1 425 . 1 1 36 36 LEU HG H 1 1.355 0.020 . 1 . . . . A 36 LEU HG . 25850 1 426 . 1 1 36 36 LEU HD11 H 1 0.774 0.020 . 2 . . . . A 36 LEU HD11 . 25850 1 427 . 1 1 36 36 LEU HD12 H 1 0.774 0.020 . 2 . . . . A 36 LEU HD12 . 25850 1 428 . 1 1 36 36 LEU HD13 H 1 0.774 0.020 . 2 . . . . A 36 LEU HD13 . 25850 1 429 . 1 1 36 36 LEU HD21 H 1 0.795 0.020 . 2 . . . . A 36 LEU HD21 . 25850 1 430 . 1 1 36 36 LEU HD22 H 1 0.795 0.020 . 2 . . . . A 36 LEU HD22 . 25850 1 431 . 1 1 36 36 LEU HD23 H 1 0.795 0.020 . 2 . . . . A 36 LEU HD23 . 25850 1 432 . 1 1 36 36 LEU C C 13 180.804 0.100 . 1 . . . . A 36 LEU C . 25850 1 433 . 1 1 36 36 LEU CA C 13 58.063 0.100 . 1 . . . . A 36 LEU CA . 25850 1 434 . 1 1 36 36 LEU CB C 13 41.701 0.100 . 1 . . . . A 36 LEU CB . 25850 1 435 . 1 1 36 36 LEU CG C 13 25.726 0.100 . 1 . . . . A 36 LEU CG . 25850 1 436 . 1 1 36 36 LEU CD1 C 13 25.781 0.100 . 1 . . . . A 36 LEU CD1 . 25850 1 437 . 1 1 36 36 LEU CD2 C 13 21.944 0.100 . 1 . . . . A 36 LEU CD2 . 25850 1 438 . 1 1 36 36 LEU N N 15 120.414 0.100 . 1 . . . . A 36 LEU N . 25850 1 439 . 1 1 37 37 GLU H H 1 7.750 0.020 . 1 . . . . A 37 GLU H . 25850 1 440 . 1 1 37 37 GLU HA H 1 4.075 0.020 . 1 . . . . A 37 GLU HA . 25850 1 441 . 1 1 37 37 GLU HB2 H 1 2.133 0.020 . 2 . . . . A 37 GLU HB2 . 25850 1 442 . 1 1 37 37 GLU HB3 H 1 2.061 0.020 . 2 . . . . A 37 GLU HB3 . 25850 1 443 . 1 1 37 37 GLU HG2 H 1 2.695 0.020 . 2 . . . . A 37 GLU HG2 . 25850 1 444 . 1 1 37 37 GLU HG3 H 1 2.251 0.020 . 2 . . . . A 37 GLU HG3 . 25850 1 445 . 1 1 37 37 GLU C C 13 179.517 0.100 . 1 . . . . A 37 GLU C . 25850 1 446 . 1 1 37 37 GLU CA C 13 58.603 0.100 . 1 . . . . A 37 GLU CA . 25850 1 447 . 1 1 37 37 GLU CB C 13 29.799 0.100 . 1 . . . . A 37 GLU CB . 25850 1 448 . 1 1 37 37 GLU CG C 13 35.856 0.100 . 1 . . . . A 37 GLU CG . 25850 1 449 . 1 1 37 37 GLU N N 15 120.083 0.100 . 1 . . . . A 37 GLU N . 25850 1 450 . 1 1 38 38 LYS H H 1 8.550 0.020 . 1 . . . . A 38 LYS H . 25850 1 451 . 1 1 38 38 LYS HA H 1 3.862 0.020 . 1 . . . . A 38 LYS HA . 25850 1 452 . 1 1 38 38 LYS HB2 H 1 1.944 0.020 . 2 . . . . A 38 LYS HB2 . 25850 1 453 . 1 1 38 38 LYS HB3 H 1 1.890 0.020 . 2 . . . . A 38 LYS HB3 . 25850 1 454 . 1 1 38 38 LYS HG2 H 1 0.952 0.020 . 2 . . . . A 38 LYS HG2 . 25850 1 455 . 1 1 38 38 LYS HG3 H 1 1.393 0.020 . 2 . . . . A 38 LYS HG3 . 25850 1 456 . 1 1 38 38 LYS HD2 H 1 1.560 0.020 . 2 . . . . A 38 LYS HD2 . 25850 1 457 . 1 1 38 38 LYS HD3 H 1 1.381 0.020 . 2 . . . . A 38 LYS HD3 . 25850 1 458 . 1 1 38 38 LYS HE2 H 1 2.470 0.020 . 2 . . . . A 38 LYS HE2 . 25850 1 459 . 1 1 38 38 LYS HE3 H 1 2.620 0.020 . 2 . . . . A 38 LYS HE3 . 25850 1 460 . 1 1 38 38 LYS C C 13 179.253 0.100 . 1 . . . . A 38 LYS C . 25850 1 461 . 1 1 38 38 LYS CA C 13 57.937 0.100 . 1 . . . . A 38 LYS CA . 25850 1 462 . 1 1 38 38 LYS CB C 13 30.769 0.100 . 1 . . . . A 38 LYS CB . 25850 1 463 . 1 1 38 38 LYS CG C 13 25.488 0.100 . 1 . . . . A 38 LYS CG . 25850 1 464 . 1 1 38 38 LYS CD C 13 28.265 0.100 . 1 . . . . A 38 LYS CD . 25850 1 465 . 1 1 38 38 LYS CE C 13 42.477 0.100 . 1 . . . . A 38 LYS CE . 25850 1 466 . 1 1 38 38 LYS N N 15 118.263 0.100 . 1 . . . . A 38 LYS N . 25850 1 467 . 1 1 39 39 ASN H H 1 8.294 0.020 . 1 . . . . A 39 ASN H . 25850 1 468 . 1 1 39 39 ASN HA H 1 4.193 0.020 . 1 . . . . A 39 ASN HA . 25850 1 469 . 1 1 39 39 ASN HB2 H 1 2.732 0.020 . 1 . . . . A 39 ASN HB2 . 25850 1 470 . 1 1 39 39 ASN HB3 H 1 2.921 0.020 . 1 . . . . A 39 ASN HB3 . 25850 1 471 . 1 1 39 39 ASN HD21 H 1 7.643 0.020 . 1 . . . . A 39 ASN HD21 . 25850 1 472 . 1 1 39 39 ASN HD22 H 1 6.619 0.020 . 1 . . . . A 39 ASN HD22 . 25850 1 473 . 1 1 39 39 ASN C C 13 179.428 0.100 . 1 . . . . A 39 ASN C . 25850 1 474 . 1 1 39 39 ASN CA C 13 56.177 0.100 . 1 . . . . A 39 ASN CA . 25850 1 475 . 1 1 39 39 ASN CB C 13 38.478 0.100 . 1 . . . . A 39 ASN CB . 25850 1 476 . 1 1 39 39 ASN N N 15 118.329 0.100 . 1 . . . . A 39 ASN N . 25850 1 477 . 1 1 39 39 ASN ND2 N 15 109.718 0.100 . 1 . . . . A 39 ASN ND2 . 25850 1 478 . 1 1 40 40 LYS H H 1 7.912 0.020 . 1 . . . . A 40 LYS H . 25850 1 479 . 1 1 40 40 LYS HA H 1 4.047 0.020 . 1 . . . . A 40 LYS HA . 25850 1 480 . 1 1 40 40 LYS HB2 H 1 2.072 0.020 . 2 . . . . A 40 LYS HB2 . 25850 1 481 . 1 1 40 40 LYS HB3 H 1 1.993 0.020 . 2 . . . . A 40 LYS HB3 . 25850 1 482 . 1 1 40 40 LYS HG2 H 1 1.702 0.020 . 2 . . . . A 40 LYS HG2 . 25850 1 483 . 1 1 40 40 LYS HG3 H 1 1.495 0.020 . 2 . . . . A 40 LYS HG3 . 25850 1 484 . 1 1 40 40 LYS HD2 H 1 1.723 0.020 . 1 . . . . A 40 LYS HD2 . 25850 1 485 . 1 1 40 40 LYS HD3 H 1 1.723 0.020 . 1 . . . . A 40 LYS HD3 . 25850 1 486 . 1 1 40 40 LYS HE2 H 1 2.934 0.020 . 2 . . . . A 40 LYS HE2 . 25850 1 487 . 1 1 40 40 LYS HE3 H 1 2.817 0.020 . 2 . . . . A 40 LYS HE3 . 25850 1 488 . 1 1 40 40 LYS C C 13 178.229 0.100 . 1 . . . . A 40 LYS C . 25850 1 489 . 1 1 40 40 LYS CA C 13 59.471 0.100 . 1 . . . . A 40 LYS CA . 25850 1 490 . 1 1 40 40 LYS CB C 13 32.427 0.100 . 1 . . . . A 40 LYS CB . 25850 1 491 . 1 1 40 40 LYS CG C 13 25.190 0.100 . 1 . . . . A 40 LYS CG . 25850 1 492 . 1 1 40 40 LYS CD C 13 29.594 0.100 . 1 . . . . A 40 LYS CD . 25850 1 493 . 1 1 40 40 LYS CE C 13 41.925 0.100 . 1 . . . . A 40 LYS CE . 25850 1 494 . 1 1 40 40 LYS N N 15 121.176 0.100 . 1 . . . . A 40 LYS N . 25850 1 495 . 1 1 41 41 MET H H 1 7.389 0.020 . 1 . . . . A 41 MET H . 25850 1 496 . 1 1 41 41 MET HA H 1 4.512 0.020 . 1 . . . . A 41 MET HA . 25850 1 497 . 1 1 41 41 MET HB2 H 1 2.299 0.020 . 2 . . . . A 41 MET HB2 . 25850 1 498 . 1 1 41 41 MET HB3 H 1 2.186 0.020 . 2 . . . . A 41 MET HB3 . 25850 1 499 . 1 1 41 41 MET HG2 H 1 2.710 0.020 . 2 . . . . A 41 MET HG2 . 25850 1 500 . 1 1 41 41 MET HG3 H 1 2.659 0.020 . 2 . . . . A 41 MET HG3 . 25850 1 501 . 1 1 41 41 MET HE1 H 1 2.085 0.020 . 1 . . . . A 41 MET HE1 . 25850 1 502 . 1 1 41 41 MET HE2 H 1 2.085 0.020 . 1 . . . . A 41 MET HE2 . 25850 1 503 . 1 1 41 41 MET HE3 H 1 2.085 0.020 . 1 . . . . A 41 MET HE3 . 25850 1 504 . 1 1 41 41 MET C C 13 175.915 0.100 . 1 . . . . A 41 MET C . 25850 1 505 . 1 1 41 41 MET CA C 13 55.529 0.100 . 1 . . . . A 41 MET CA . 25850 1 506 . 1 1 41 41 MET CB C 13 34.022 0.100 . 1 . . . . A 41 MET CB . 25850 1 507 . 1 1 41 41 MET CG C 13 31.711 0.100 . 1 . . . . A 41 MET CG . 25850 1 508 . 1 1 41 41 MET CE C 13 17.074 0.100 . 1 . . . . A 41 MET CE . 25850 1 509 . 1 1 41 41 MET N N 15 114.548 0.100 . 1 . . . . A 41 MET N . 25850 1 510 . 1 1 42 42 GLY H H 1 7.929 0.020 . 1 . . . . A 42 GLY H . 25850 1 511 . 1 1 42 42 GLY HA2 H 1 4.300 0.020 . 2 . . . . A 42 GLY HA2 . 25850 1 512 . 1 1 42 42 GLY HA3 H 1 3.782 0.020 . 2 . . . . A 42 GLY HA3 . 25850 1 513 . 1 1 42 42 GLY C C 13 175.041 0.100 . 1 . . . . A 42 GLY C . 25850 1 514 . 1 1 42 42 GLY CA C 13 45.335 0.100 . 1 . . . . A 42 GLY CA . 25850 1 515 . 1 1 42 42 GLY N N 15 107.409 0.100 . 1 . . . . A 42 GLY N . 25850 1 516 . 1 1 43 43 LYS H H 1 8.040 0.020 . 1 . . . . A 43 LYS H . 25850 1 517 . 1 1 43 43 LYS HA H 1 4.684 0.020 . 1 . . . . A 43 LYS HA . 25850 1 518 . 1 1 43 43 LYS HB2 H 1 1.922 0.020 . 2 . . . . A 43 LYS HB2 . 25850 1 519 . 1 1 43 43 LYS HB3 H 1 1.688 0.020 . 2 . . . . A 43 LYS HB3 . 25850 1 520 . 1 1 43 43 LYS HG2 H 1 1.333 0.020 . 1 . . . . A 43 LYS HG2 . 25850 1 521 . 1 1 43 43 LYS HG3 H 1 1.333 0.020 . 1 . . . . A 43 LYS HG3 . 25850 1 522 . 1 1 43 43 LYS HD2 H 1 1.585 0.020 . 2 . . . . A 43 LYS HD2 . 25850 1 523 . 1 1 43 43 LYS HD3 H 1 1.736 0.020 . 2 . . . . A 43 LYS HD3 . 25850 1 524 . 1 1 43 43 LYS HE2 H 1 3.085 0.020 . 2 . . . . A 43 LYS HE2 . 25850 1 525 . 1 1 43 43 LYS HE3 H 1 2.973 0.020 . 2 . . . . A 43 LYS HE3 . 25850 1 526 . 1 1 43 43 LYS C C 13 176.514 0.100 . 1 . . . . A 43 LYS C . 25850 1 527 . 1 1 43 43 LYS CA C 13 53.791 0.100 . 1 . . . . A 43 LYS CA . 25850 1 528 . 1 1 43 43 LYS CB C 13 30.065 0.100 . 1 . . . . A 43 LYS CB . 25850 1 529 . 1 1 43 43 LYS CG C 13 24.493 0.100 . 1 . . . . A 43 LYS CG . 25850 1 530 . 1 1 43 43 LYS CD C 13 29.240 0.100 . 1 . . . . A 43 LYS CD . 25850 1 531 . 1 1 43 43 LYS CE C 13 42.290 0.100 . 1 . . . . A 43 LYS CE . 25850 1 532 . 1 1 43 43 LYS N N 15 124.326 0.100 . 1 . . . . A 43 LYS N . 25850 1 533 . 1 1 44 44 VAL H H 1 7.439 0.020 . 1 . . . . A 44 VAL H . 25850 1 534 . 1 1 44 44 VAL HA H 1 3.580 0.020 . 1 . . . . A 44 VAL HA . 25850 1 535 . 1 1 44 44 VAL HB H 1 2.014 0.020 . 1 . . . . A 44 VAL HB . 25850 1 536 . 1 1 44 44 VAL HG11 H 1 1.020 0.020 . 2 . . . . A 44 VAL HG11 . 25850 1 537 . 1 1 44 44 VAL HG12 H 1 1.020 0.020 . 2 . . . . A 44 VAL HG12 . 25850 1 538 . 1 1 44 44 VAL HG13 H 1 1.020 0.020 . 2 . . . . A 44 VAL HG13 . 25850 1 539 . 1 1 44 44 VAL HG21 H 1 1.046 0.020 . 2 . . . . A 44 VAL HG21 . 25850 1 540 . 1 1 44 44 VAL HG22 H 1 1.046 0.020 . 2 . . . . A 44 VAL HG22 . 25850 1 541 . 1 1 44 44 VAL HG23 H 1 1.046 0.020 . 2 . . . . A 44 VAL HG23 . 25850 1 542 . 1 1 44 44 VAL C C 13 177.096 0.100 . 1 . . . . A 44 VAL C . 25850 1 543 . 1 1 44 44 VAL CA C 13 66.166 0.100 . 1 . . . . A 44 VAL CA . 25850 1 544 . 1 1 44 44 VAL CB C 13 31.869 0.100 . 1 . . . . A 44 VAL CB . 25850 1 545 . 1 1 44 44 VAL CG1 C 13 22.043 0.100 . 1 . . . . A 44 VAL CG1 . 25850 1 546 . 1 1 44 44 VAL CG2 C 13 22.052 0.100 . 1 . . . . A 44 VAL CG2 . 25850 1 547 . 1 1 44 44 VAL N N 15 121.020 0.100 . 1 . . . . A 44 VAL N . 25850 1 548 . 1 1 45 45 LYS H H 1 8.427 0.020 . 1 . . . . A 45 LYS H . 25850 1 549 . 1 1 45 45 LYS HA H 1 3.950 0.020 . 1 . . . . A 45 LYS HA . 25850 1 550 . 1 1 45 45 LYS HB2 H 1 1.894 0.020 . 1 . . . . A 45 LYS HB2 . 25850 1 551 . 1 1 45 45 LYS HB3 H 1 1.846 0.020 . 1 . . . . A 45 LYS HB3 . 25850 1 552 . 1 1 45 45 LYS HG2 H 1 1.583 0.020 . 2 . . . . A 45 LYS HG2 . 25850 1 553 . 1 1 45 45 LYS HG3 H 1 1.398 0.020 . 2 . . . . A 45 LYS HG3 . 25850 1 554 . 1 1 45 45 LYS HD2 H 1 1.710 0.020 . 1 . . . . A 45 LYS HD2 . 25850 1 555 . 1 1 45 45 LYS HD3 H 1 1.710 0.020 . 1 . . . . A 45 LYS HD3 . 25850 1 556 . 1 1 45 45 LYS HE2 H 1 3.003 0.020 . 1 . . . . A 45 LYS HE2 . 25850 1 557 . 1 1 45 45 LYS HE3 H 1 3.003 0.020 . 1 . . . . A 45 LYS HE3 . 25850 1 558 . 1 1 45 45 LYS C C 13 179.726 0.100 . 1 . . . . A 45 LYS C . 25850 1 559 . 1 1 45 45 LYS CA C 13 60.153 0.100 . 1 . . . . A 45 LYS CA . 25850 1 560 . 1 1 45 45 LYS CB C 13 31.446 0.100 . 1 . . . . A 45 LYS CB . 25850 1 561 . 1 1 45 45 LYS CG C 13 25.726 0.100 . 1 . . . . A 45 LYS CG . 25850 1 562 . 1 1 45 45 LYS CD C 13 29.260 0.100 . 1 . . . . A 45 LYS CD . 25850 1 563 . 1 1 45 45 LYS CE C 13 42.005 0.100 . 1 . . . . A 45 LYS CE . 25850 1 564 . 1 1 45 45 LYS N N 15 119.164 0.100 . 1 . . . . A 45 LYS N . 25850 1 565 . 1 1 46 46 GLU H H 1 7.867 0.020 . 1 . . . . A 46 GLU H . 25850 1 566 . 1 1 46 46 GLU HA H 1 4.092 0.020 . 1 . . . . A 46 GLU HA . 25850 1 567 . 1 1 46 46 GLU HB2 H 1 1.961 0.020 . 2 . . . . A 46 GLU HB2 . 25850 1 568 . 1 1 46 46 GLU HB3 H 1 2.037 0.020 . 2 . . . . A 46 GLU HB3 . 25850 1 569 . 1 1 46 46 GLU HG2 H 1 2.380 0.020 . 2 . . . . A 46 GLU HG2 . 25850 1 570 . 1 1 46 46 GLU HG3 H 1 2.321 0.020 . 2 . . . . A 46 GLU HG3 . 25850 1 571 . 1 1 46 46 GLU C C 13 178.490 0.100 . 1 . . . . A 46 GLU C . 25850 1 572 . 1 1 46 46 GLU CA C 13 59.327 0.100 . 1 . . . . A 46 GLU CA . 25850 1 573 . 1 1 46 46 GLU CB C 13 29.764 0.100 . 1 . . . . A 46 GLU CB . 25850 1 574 . 1 1 46 46 GLU CG C 13 37.303 0.100 . 1 . . . . A 46 GLU CG . 25850 1 575 . 1 1 46 46 GLU N N 15 118.446 0.100 . 1 . . . . A 46 GLU N . 25850 1 576 . 1 1 47 47 ALA H H 1 8.315 0.020 . 1 . . . . A 47 ALA H . 25850 1 577 . 1 1 47 47 ALA HA H 1 3.513 0.020 . 1 . . . . A 47 ALA HA . 25850 1 578 . 1 1 47 47 ALA HB1 H 1 1.210 0.020 . 1 . . . . A 47 ALA HB1 . 25850 1 579 . 1 1 47 47 ALA HB2 H 1 1.210 0.020 . 1 . . . . A 47 ALA HB2 . 25850 1 580 . 1 1 47 47 ALA HB3 H 1 1.210 0.020 . 1 . . . . A 47 ALA HB3 . 25850 1 581 . 1 1 47 47 ALA C C 13 178.065 0.100 . 1 . . . . A 47 ALA C . 25850 1 582 . 1 1 47 47 ALA CA C 13 55.905 0.100 . 1 . . . . A 47 ALA CA . 25850 1 583 . 1 1 47 47 ALA CB C 13 18.256 0.100 . 1 . . . . A 47 ALA CB . 25850 1 584 . 1 1 47 47 ALA N N 15 122.279 0.100 . 1 . . . . A 47 ALA N . 25850 1 585 . 1 1 48 48 ILE H H 1 8.077 0.020 . 1 . . . . A 48 ILE H . 25850 1 586 . 1 1 48 48 ILE HA H 1 3.401 0.020 . 1 . . . . A 48 ILE HA . 25850 1 587 . 1 1 48 48 ILE HB H 1 1.927 0.020 . 1 . . . . A 48 ILE HB . 25850 1 588 . 1 1 48 48 ILE HG12 H 1 1.814 0.020 . 2 . . . . A 48 ILE HG12 . 25850 1 589 . 1 1 48 48 ILE HG13 H 1 0.668 0.020 . 2 . . . . A 48 ILE HG13 . 25850 1 590 . 1 1 48 48 ILE HG21 H 1 0.855 0.020 . 1 . . . . A 48 ILE HG21 . 25850 1 591 . 1 1 48 48 ILE HG22 H 1 0.855 0.020 . 1 . . . . A 48 ILE HG22 . 25850 1 592 . 1 1 48 48 ILE HG23 H 1 0.855 0.020 . 1 . . . . A 48 ILE HG23 . 25850 1 593 . 1 1 48 48 ILE HD11 H 1 0.688 0.020 . 1 . . . . A 48 ILE HD11 . 25850 1 594 . 1 1 48 48 ILE HD12 H 1 0.688 0.020 . 1 . . . . A 48 ILE HD12 . 25850 1 595 . 1 1 48 48 ILE HD13 H 1 0.688 0.020 . 1 . . . . A 48 ILE HD13 . 25850 1 596 . 1 1 48 48 ILE C C 13 176.808 0.100 . 1 . . . . A 48 ILE C . 25850 1 597 . 1 1 48 48 ILE CA C 13 66.282 0.100 . 1 . . . . A 48 ILE CA . 25850 1 598 . 1 1 48 48 ILE CB C 13 38.375 0.100 . 1 . . . . A 48 ILE CB . 25850 1 599 . 1 1 48 48 ILE CG1 C 13 31.365 0.100 . 1 . . . . A 48 ILE CG1 . 25850 1 600 . 1 1 48 48 ILE CG2 C 13 16.722 0.100 . 1 . . . . A 48 ILE CG2 . 25850 1 601 . 1 1 48 48 ILE CD1 C 13 13.924 0.100 . 1 . . . . A 48 ILE CD1 . 25850 1 602 . 1 1 48 48 ILE N N 15 115.863 0.100 . 1 . . . . A 48 ILE N . 25850 1 603 . 1 1 49 49 GLU H H 1 7.175 0.020 . 1 . . . . A 49 GLU H . 25850 1 604 . 1 1 49 49 GLU HA H 1 3.920 0.020 . 1 . . . . A 49 GLU HA . 25850 1 605 . 1 1 49 49 GLU HB2 H 1 1.916 0.020 . 2 . . . . A 49 GLU HB2 . 25850 1 606 . 1 1 49 49 GLU HB3 H 1 2.073 0.020 . 2 . . . . A 49 GLU HB3 . 25850 1 607 . 1 1 49 49 GLU HG2 H 1 2.276 0.020 . 2 . . . . A 49 GLU HG2 . 25850 1 608 . 1 1 49 49 GLU HG3 H 1 2.055 0.020 . 2 . . . . A 49 GLU HG3 . 25850 1 609 . 1 1 49 49 GLU C C 13 179.914 0.100 . 1 . . . . A 49 GLU C . 25850 1 610 . 1 1 49 49 GLU CA C 13 59.535 0.100 . 1 . . . . A 49 GLU CA . 25850 1 611 . 1 1 49 49 GLU CB C 13 28.995 0.100 . 1 . . . . A 49 GLU CB . 25850 1 612 . 1 1 49 49 GLU CG C 13 35.842 0.100 . 1 . . . . A 49 GLU CG . 25850 1 613 . 1 1 49 49 GLU N N 15 116.853 0.100 . 1 . . . . A 49 GLU N . 25850 1 614 . 1 1 50 50 TYR H H 1 7.676 0.020 . 1 . . . . A 50 TYR H . 25850 1 615 . 1 1 50 50 TYR HA H 1 3.774 0.020 . 1 . . . . A 50 TYR HA . 25850 1 616 . 1 1 50 50 TYR HB2 H 1 2.447 0.020 . 1 . . . . A 50 TYR HB2 . 25850 1 617 . 1 1 50 50 TYR HB3 H 1 3.076 0.020 . 1 . . . . A 50 TYR HB3 . 25850 1 618 . 1 1 50 50 TYR HD1 H 1 7.163 0.020 . 1 . . . . A 50 TYR HD1 . 25850 1 619 . 1 1 50 50 TYR HD2 H 1 7.163 0.020 . 1 . . . . A 50 TYR HD2 . 25850 1 620 . 1 1 50 50 TYR HE1 H 1 6.633 0.020 . 1 . . . . A 50 TYR HE1 . 25850 1 621 . 1 1 50 50 TYR HE2 H 1 6.633 0.020 . 1 . . . . A 50 TYR HE2 . 25850 1 622 . 1 1 50 50 TYR C C 13 178.462 0.100 . 1 . . . . A 50 TYR C . 25850 1 623 . 1 1 50 50 TYR CA C 13 64.368 0.100 . 1 . . . . A 50 TYR CA . 25850 1 624 . 1 1 50 50 TYR CB C 13 37.345 0.100 . 1 . . . . A 50 TYR CB . 25850 1 625 . 1 1 50 50 TYR CD1 C 13 132.409 0.100 . 1 . . . . A 50 TYR CD1 . 25850 1 626 . 1 1 50 50 TYR CD2 C 13 132.409 0.100 . 1 . . . . A 50 TYR CD2 . 25850 1 627 . 1 1 50 50 TYR CE1 C 13 118.343 0.100 . 1 . . . . A 50 TYR CE1 . 25850 1 628 . 1 1 50 50 TYR CE2 C 13 118.343 0.100 . 1 . . . . A 50 TYR CE2 . 25850 1 629 . 1 1 50 50 TYR N N 15 117.578 0.100 . 1 . . . . A 50 TYR N . 25850 1 630 . 1 1 51 51 PHE H H 1 9.013 0.020 . 1 . . . . A 51 PHE H . 25850 1 631 . 1 1 51 51 PHE HA H 1 4.711 0.020 . 1 . . . . A 51 PHE HA . 25850 1 632 . 1 1 51 51 PHE HB2 H 1 3.216 0.020 . 1 . . . . A 51 PHE HB2 . 25850 1 633 . 1 1 51 51 PHE HB3 H 1 3.327 0.020 . 1 . . . . A 51 PHE HB3 . 25850 1 634 . 1 1 51 51 PHE HD1 H 1 6.933 0.020 . 1 . . . . A 51 PHE HD1 . 25850 1 635 . 1 1 51 51 PHE HD2 H 1 6.933 0.020 . 1 . . . . A 51 PHE HD2 . 25850 1 636 . 1 1 51 51 PHE HE1 H 1 6.989 0.020 . 1 . . . . A 51 PHE HE1 . 25850 1 637 . 1 1 51 51 PHE HE2 H 1 6.989 0.020 . 1 . . . . A 51 PHE HE2 . 25850 1 638 . 1 1 51 51 PHE HZ H 1 6.887 0.020 . 1 . . . . A 51 PHE HZ . 25850 1 639 . 1 1 51 51 PHE C C 13 178.720 0.100 . 1 . . . . A 51 PHE C . 25850 1 640 . 1 1 51 51 PHE CA C 13 58.958 0.100 . 1 . . . . A 51 PHE CA . 25850 1 641 . 1 1 51 51 PHE CB C 13 37.771 0.100 . 1 . . . . A 51 PHE CB . 25850 1 642 . 1 1 51 51 PHE CD1 C 13 129.209 0.100 . 1 . . . . A 51 PHE CD1 . 25850 1 643 . 1 1 51 51 PHE CD2 C 13 129.209 0.100 . 1 . . . . A 51 PHE CD2 . 25850 1 644 . 1 1 51 51 PHE CE1 C 13 131.465 0.100 . 1 . . . . A 51 PHE CE1 . 25850 1 645 . 1 1 51 51 PHE CE2 C 13 131.465 0.100 . 1 . . . . A 51 PHE CE2 . 25850 1 646 . 1 1 51 51 PHE CZ C 13 129.087 0.100 . 1 . . . . A 51 PHE CZ . 25850 1 647 . 1 1 51 51 PHE N N 15 119.480 0.100 . 1 . . . . A 51 PHE N . 25850 1 648 . 1 1 52 52 LEU H H 1 8.906 0.020 . 1 . . . . A 52 LEU H . 25850 1 649 . 1 1 52 52 LEU HA H 1 4.093 0.020 . 1 . . . . A 52 LEU HA . 25850 1 650 . 1 1 52 52 LEU HB2 H 1 1.984 0.020 . 1 . . . . A 52 LEU HB2 . 25850 1 651 . 1 1 52 52 LEU HB3 H 1 1.520 0.020 . 1 . . . . A 52 LEU HB3 . 25850 1 652 . 1 1 52 52 LEU HG H 1 1.866 0.020 . 1 . . . . A 52 LEU HG . 25850 1 653 . 1 1 52 52 LEU HD11 H 1 0.932 0.020 . 2 . . . . A 52 LEU HD11 . 25850 1 654 . 1 1 52 52 LEU HD12 H 1 0.932 0.020 . 2 . . . . A 52 LEU HD12 . 25850 1 655 . 1 1 52 52 LEU HD13 H 1 0.932 0.020 . 2 . . . . A 52 LEU HD13 . 25850 1 656 . 1 1 52 52 LEU HD21 H 1 0.973 0.020 . 2 . . . . A 52 LEU HD21 . 25850 1 657 . 1 1 52 52 LEU HD22 H 1 0.973 0.020 . 2 . . . . A 52 LEU HD22 . 25850 1 658 . 1 1 52 52 LEU HD23 H 1 0.973 0.020 . 2 . . . . A 52 LEU HD23 . 25850 1 659 . 1 1 52 52 LEU C C 13 180.229 0.100 . 1 . . . . A 52 LEU C . 25850 1 660 . 1 1 52 52 LEU CA C 13 58.252 0.100 . 1 . . . . A 52 LEU CA . 25850 1 661 . 1 1 52 52 LEU CB C 13 42.160 0.100 . 1 . . . . A 52 LEU CB . 25850 1 662 . 1 1 52 52 LEU CG C 13 26.663 0.100 . 1 . . . . A 52 LEU CG . 25850 1 663 . 1 1 52 52 LEU CD1 C 13 25.523 0.100 . 1 . . . . A 52 LEU CD1 . 25850 1 664 . 1 1 52 52 LEU CD2 C 13 23.868 0.100 . 1 . . . . A 52 LEU CD2 . 25850 1 665 . 1 1 52 52 LEU N N 15 120.365 0.100 . 1 . . . . A 52 LEU N . 25850 1 666 . 1 1 53 53 ARG H H 1 7.846 0.020 . 1 . . . . A 53 ARG H . 25850 1 667 . 1 1 53 53 ARG HA H 1 3.929 0.020 . 1 . . . . A 53 ARG HA . 25850 1 668 . 1 1 53 53 ARG HB2 H 1 1.735 0.020 . 1 . . . . A 53 ARG HB2 . 25850 1 669 . 1 1 53 53 ARG HB3 H 1 1.944 0.020 . 1 . . . . A 53 ARG HB3 . 25850 1 670 . 1 1 53 53 ARG HG2 H 1 1.944 0.020 . 2 . . . . A 53 ARG HG2 . 25850 1 671 . 1 1 53 53 ARG HG3 H 1 1.563 0.020 . 2 . . . . A 53 ARG HG3 . 25850 1 672 . 1 1 53 53 ARG HD2 H 1 2.936 0.020 . 2 . . . . A 53 ARG HD2 . 25850 1 673 . 1 1 53 53 ARG HD3 H 1 2.636 0.020 . 2 . . . . A 53 ARG HD3 . 25850 1 674 . 1 1 53 53 ARG C C 13 179.087 0.100 . 1 . . . . A 53 ARG C . 25850 1 675 . 1 1 53 53 ARG CA C 13 59.580 0.100 . 1 . . . . A 53 ARG CA . 25850 1 676 . 1 1 53 53 ARG CB C 13 31.418 0.100 . 1 . . . . A 53 ARG CB . 25850 1 677 . 1 1 53 53 ARG CG C 13 27.302 0.100 . 1 . . . . A 53 ARG CG . 25850 1 678 . 1 1 53 53 ARG CD C 13 43.972 0.100 . 1 . . . . A 53 ARG CD . 25850 1 679 . 1 1 53 53 ARG N N 15 119.294 0.100 . 1 . . . . A 53 ARG N . 25850 1 680 . 1 1 54 54 ALA H H 1 8.892 0.020 . 1 . . . . A 54 ALA H . 25850 1 681 . 1 1 54 54 ALA HA H 1 3.693 0.020 . 1 . . . . A 54 ALA HA . 25850 1 682 . 1 1 54 54 ALA HB1 H 1 1.618 0.020 . 1 . . . . A 54 ALA HB1 . 25850 1 683 . 1 1 54 54 ALA HB2 H 1 1.618 0.020 . 1 . . . . A 54 ALA HB2 . 25850 1 684 . 1 1 54 54 ALA HB3 H 1 1.618 0.020 . 1 . . . . A 54 ALA HB3 . 25850 1 685 . 1 1 54 54 ALA C C 13 177.631 0.100 . 1 . . . . A 54 ALA C . 25850 1 686 . 1 1 54 54 ALA CA C 13 55.115 0.100 . 1 . . . . A 54 ALA CA . 25850 1 687 . 1 1 54 54 ALA CB C 13 17.612 0.100 . 1 . . . . A 54 ALA CB . 25850 1 688 . 1 1 54 54 ALA N N 15 121.351 0.100 . 1 . . . . A 54 ALA N . 25850 1 689 . 1 1 55 55 LYS H H 1 8.626 0.020 . 1 . . . . A 55 LYS H . 25850 1 690 . 1 1 55 55 LYS HA H 1 3.835 0.020 . 1 . . . . A 55 LYS HA . 25850 1 691 . 1 1 55 55 LYS HB2 H 1 1.933 0.020 . 1 . . . . A 55 LYS HB2 . 25850 1 692 . 1 1 55 55 LYS HB3 H 1 2.156 0.020 . 1 . . . . A 55 LYS HB3 . 25850 1 693 . 1 1 55 55 LYS HG2 H 1 1.709 0.020 . 2 . . . . A 55 LYS HG2 . 25850 1 694 . 1 1 55 55 LYS HG3 H 1 1.481 0.020 . 2 . . . . A 55 LYS HG3 . 25850 1 695 . 1 1 55 55 LYS HD2 H 1 1.673 0.020 . 2 . . . . A 55 LYS HD2 . 25850 1 696 . 1 1 55 55 LYS HD3 H 1 1.708 0.020 . 2 . . . . A 55 LYS HD3 . 25850 1 697 . 1 1 55 55 LYS HE2 H 1 3.082 0.020 . 1 . . . . A 55 LYS HE2 . 25850 1 698 . 1 1 55 55 LYS HE3 H 1 3.082 0.020 . 1 . . . . A 55 LYS HE3 . 25850 1 699 . 1 1 55 55 LYS C C 13 176.970 0.100 . 1 . . . . A 55 LYS C . 25850 1 700 . 1 1 55 55 LYS CA C 13 60.725 0.100 . 1 . . . . A 55 LYS CA . 25850 1 701 . 1 1 55 55 LYS CB C 13 32.602 0.100 . 1 . . . . A 55 LYS CB . 25850 1 702 . 1 1 55 55 LYS CG C 13 25.577 0.100 . 1 . . . . A 55 LYS CG . 25850 1 703 . 1 1 55 55 LYS CD C 13 29.151 0.100 . 1 . . . . A 55 LYS CD . 25850 1 704 . 1 1 55 55 LYS CE C 13 42.182 0.100 . 1 . . . . A 55 LYS CE . 25850 1 705 . 1 1 55 55 LYS N N 15 117.135 0.100 . 1 . . . . A 55 LYS N . 25850 1 706 . 1 1 56 56 LYS H H 1 7.652 0.020 . 1 . . . . A 56 LYS H . 25850 1 707 . 1 1 56 56 LYS HA H 1 4.171 0.020 . 1 . . . . A 56 LYS HA . 25850 1 708 . 1 1 56 56 LYS HB2 H 1 1.949 0.020 . 1 . . . . A 56 LYS HB2 . 25850 1 709 . 1 1 56 56 LYS HB3 H 1 1.949 0.020 . 1 . . . . A 56 LYS HB3 . 25850 1 710 . 1 1 56 56 LYS HG2 H 1 1.634 0.020 . 2 . . . . A 56 LYS HG2 . 25850 1 711 . 1 1 56 56 LYS HG3 H 1 1.484 0.020 . 2 . . . . A 56 LYS HG3 . 25850 1 712 . 1 1 56 56 LYS HD2 H 1 1.706 0.020 . 1 . . . . A 56 LYS HD2 . 25850 1 713 . 1 1 56 56 LYS HD3 H 1 1.706 0.020 . 1 . . . . A 56 LYS HD3 . 25850 1 714 . 1 1 56 56 LYS HE2 H 1 2.982 0.020 . 1 . . . . A 56 LYS HE2 . 25850 1 715 . 1 1 56 56 LYS HE3 H 1 2.982 0.020 . 1 . . . . A 56 LYS HE3 . 25850 1 716 . 1 1 56 56 LYS C C 13 180.037 0.100 . 1 . . . . A 56 LYS C . 25850 1 717 . 1 1 56 56 LYS CA C 13 59.606 0.100 . 1 . . . . A 56 LYS CA . 25850 1 718 . 1 1 56 56 LYS CB C 13 32.349 0.100 . 1 . . . . A 56 LYS CB . 25850 1 719 . 1 1 56 56 LYS CG C 13 25.084 0.100 . 1 . . . . A 56 LYS CG . 25850 1 720 . 1 1 56 56 LYS CD C 13 29.242 0.100 . 1 . . . . A 56 LYS CD . 25850 1 721 . 1 1 56 56 LYS CE C 13 41.964 0.100 . 1 . . . . A 56 LYS CE . 25850 1 722 . 1 1 56 56 LYS N N 15 116.695 0.100 . 1 . . . . A 56 LYS N . 25850 1 723 . 1 1 57 57 VAL H H 1 7.583 0.020 . 1 . . . . A 57 VAL H . 25850 1 724 . 1 1 57 57 VAL HA H 1 3.753 0.020 . 1 . . . . A 57 VAL HA . 25850 1 725 . 1 1 57 57 VAL HB H 1 1.839 0.020 . 1 . . . . A 57 VAL HB . 25850 1 726 . 1 1 57 57 VAL HG11 H 1 0.824 0.020 . 2 . . . . A 57 VAL HG11 . 25850 1 727 . 1 1 57 57 VAL HG12 H 1 0.824 0.020 . 2 . . . . A 57 VAL HG12 . 25850 1 728 . 1 1 57 57 VAL HG13 H 1 0.824 0.020 . 2 . . . . A 57 VAL HG13 . 25850 1 729 . 1 1 57 57 VAL HG21 H 1 0.973 0.020 . 2 . . . . A 57 VAL HG21 . 25850 1 730 . 1 1 57 57 VAL HG22 H 1 0.973 0.020 . 2 . . . . A 57 VAL HG22 . 25850 1 731 . 1 1 57 57 VAL HG23 H 1 0.973 0.020 . 2 . . . . A 57 VAL HG23 . 25850 1 732 . 1 1 57 57 VAL C C 13 178.174 0.100 . 1 . . . . A 57 VAL C . 25850 1 733 . 1 1 57 57 VAL CA C 13 66.226 0.100 . 1 . . . . A 57 VAL CA . 25850 1 734 . 1 1 57 57 VAL CB C 13 31.424 0.100 . 1 . . . . A 57 VAL CB . 25850 1 735 . 1 1 57 57 VAL CG1 C 13 22.248 0.100 . 1 . . . . A 57 VAL CG1 . 25850 1 736 . 1 1 57 57 VAL CG2 C 13 22.746 0.100 . 1 . . . . A 57 VAL CG2 . 25850 1 737 . 1 1 57 57 VAL N N 15 120.809 0.100 . 1 . . . . A 57 VAL N . 25850 1 738 . 1 1 58 58 PHE H H 1 8.871 0.020 . 1 . . . . A 58 PHE H . 25850 1 739 . 1 1 58 58 PHE HA H 1 4.521 0.020 . 1 . . . . A 58 PHE HA . 25850 1 740 . 1 1 58 58 PHE HB2 H 1 2.841 0.020 . 1 . . . . A 58 PHE HB2 . 25850 1 741 . 1 1 58 58 PHE HB3 H 1 3.631 0.020 . 1 . . . . A 58 PHE HB3 . 25850 1 742 . 1 1 58 58 PHE HD1 H 1 6.956 0.020 . 1 . . . . A 58 PHE HD1 . 25850 1 743 . 1 1 58 58 PHE HD2 H 1 6.956 0.020 . 1 . . . . A 58 PHE HD2 . 25850 1 744 . 1 1 58 58 PHE HE1 H 1 7.075 0.020 . 1 . . . . A 58 PHE HE1 . 25850 1 745 . 1 1 58 58 PHE HE2 H 1 7.075 0.020 . 1 . . . . A 58 PHE HE2 . 25850 1 746 . 1 1 58 58 PHE HZ H 1 6.843 0.020 . 1 . . . . A 58 PHE HZ . 25850 1 747 . 1 1 58 58 PHE C C 13 179.187 0.100 . 1 . . . . A 58 PHE C . 25850 1 748 . 1 1 58 58 PHE CA C 13 59.849 0.100 . 1 . . . . A 58 PHE CA . 25850 1 749 . 1 1 58 58 PHE CB C 13 37.753 0.100 . 1 . . . . A 58 PHE CB . 25850 1 750 . 1 1 58 58 PHE CD1 C 13 130.820 0.100 . 1 . . . . A 58 PHE CD1 . 25850 1 751 . 1 1 58 58 PHE CD2 C 13 130.820 0.100 . 1 . . . . A 58 PHE CD2 . 25850 1 752 . 1 1 58 58 PHE CE1 C 13 130.657 0.100 . 1 . . . . A 58 PHE CE1 . 25850 1 753 . 1 1 58 58 PHE CE2 C 13 130.657 0.100 . 1 . . . . A 58 PHE CE2 . 25850 1 754 . 1 1 58 58 PHE CZ C 13 128.812 0.100 . 1 . . . . A 58 PHE CZ . 25850 1 755 . 1 1 58 58 PHE N N 15 118.864 0.100 . 1 . . . . A 58 PHE N . 25850 1 756 . 1 1 59 59 ASP H H 1 9.157 0.020 . 1 . . . . A 59 ASP H . 25850 1 757 . 1 1 59 59 ASP HA H 1 4.444 0.020 . 1 . . . . A 59 ASP HA . 25850 1 758 . 1 1 59 59 ASP HB2 H 1 2.814 0.020 . 1 . . . . A 59 ASP HB2 . 25850 1 759 . 1 1 59 59 ASP HB3 H 1 2.560 0.020 . 1 . . . . A 59 ASP HB3 . 25850 1 760 . 1 1 59 59 ASP C C 13 180.066 0.100 . 1 . . . . A 59 ASP C . 25850 1 761 . 1 1 59 59 ASP CA C 13 57.201 0.100 . 1 . . . . A 59 ASP CA . 25850 1 762 . 1 1 59 59 ASP CB C 13 39.713 0.100 . 1 . . . . A 59 ASP CB . 25850 1 763 . 1 1 59 59 ASP N N 15 119.714 0.100 . 1 . . . . A 59 ASP N . 25850 1 764 . 1 1 60 60 ALA H H 1 7.742 0.020 . 1 . . . . A 60 ALA H . 25850 1 765 . 1 1 60 60 ALA HA H 1 4.087 0.020 . 1 . . . . A 60 ALA HA . 25850 1 766 . 1 1 60 60 ALA HB1 H 1 1.594 0.020 . 1 . . . . A 60 ALA HB1 . 25850 1 767 . 1 1 60 60 ALA HB2 H 1 1.594 0.020 . 1 . . . . A 60 ALA HB2 . 25850 1 768 . 1 1 60 60 ALA HB3 H 1 1.594 0.020 . 1 . . . . A 60 ALA HB3 . 25850 1 769 . 1 1 60 60 ALA C C 13 179.389 0.100 . 1 . . . . A 60 ALA C . 25850 1 770 . 1 1 60 60 ALA CA C 13 54.760 0.100 . 1 . . . . A 60 ALA CA . 25850 1 771 . 1 1 60 60 ALA CB C 13 18.025 0.100 . 1 . . . . A 60 ALA CB . 25850 1 772 . 1 1 60 60 ALA N N 15 124.290 0.100 . 1 . . . . A 60 ALA N . 25850 1 773 . 1 1 61 61 GLU H H 1 7.908 0.020 . 1 . . . . A 61 GLU H . 25850 1 774 . 1 1 61 61 GLU HA H 1 4.259 0.020 . 1 . . . . A 61 GLU HA . 25850 1 775 . 1 1 61 61 GLU HB2 H 1 2.491 0.020 . 2 . . . . A 61 GLU HB2 . 25850 1 776 . 1 1 61 61 GLU HB3 H 1 1.949 0.020 . 2 . . . . A 61 GLU HB3 . 25850 1 777 . 1 1 61 61 GLU HG2 H 1 2.496 0.020 . 2 . . . . A 61 GLU HG2 . 25850 1 778 . 1 1 61 61 GLU HG3 H 1 2.122 0.020 . 2 . . . . A 61 GLU HG3 . 25850 1 779 . 1 1 61 61 GLU C C 13 175.970 0.100 . 1 . . . . A 61 GLU C . 25850 1 780 . 1 1 61 61 GLU CA C 13 55.049 0.100 . 1 . . . . A 61 GLU CA . 25850 1 781 . 1 1 61 61 GLU CB C 13 29.724 0.100 . 1 . . . . A 61 GLU CB . 25850 1 782 . 1 1 61 61 GLU CG C 13 35.649 0.100 . 1 . . . . A 61 GLU CG . 25850 1 783 . 1 1 61 61 GLU N N 15 114.493 0.100 . 1 . . . . A 61 GLU N . 25850 1 784 . 1 1 62 62 HIS H H 1 7.830 0.020 . 1 . . . . A 62 HIS H . 25850 1 785 . 1 1 62 62 HIS HA H 1 4.264 0.020 . 1 . . . . A 62 HIS HA . 25850 1 786 . 1 1 62 62 HIS HB2 H 1 3.448 0.020 . 2 . . . . A 62 HIS HB2 . 25850 1 787 . 1 1 62 62 HIS HB3 H 1 3.541 0.020 . 2 . . . . A 62 HIS HB3 . 25850 1 788 . 1 1 62 62 HIS HD2 H 1 7.261 0.020 . 1 . . . . A 62 HIS HD2 . 25850 1 789 . 1 1 62 62 HIS HE1 H 1 8.436 0.020 . 1 . . . . A 62 HIS HE1 . 25850 1 790 . 1 1 62 62 HIS C C 13 173.916 0.100 . 1 . . . . A 62 HIS C . 25850 1 791 . 1 1 62 62 HIS CA C 13 56.531 0.100 . 1 . . . . A 62 HIS CA . 25850 1 792 . 1 1 62 62 HIS CB C 13 26.039 0.100 . 1 . . . . A 62 HIS CB . 25850 1 793 . 1 1 62 62 HIS CD2 C 13 119.749 0.100 . 1 . . . . A 62 HIS CD2 . 25850 1 794 . 1 1 62 62 HIS CE1 C 13 136.156 0.100 . 1 . . . . A 62 HIS CE1 . 25850 1 795 . 1 1 62 62 HIS N N 15 115.130 0.100 . 1 . . . . A 62 HIS N . 25850 1 796 . 1 1 62 62 HIS ND1 N 15 182.997 0.100 . 1 . . . . A 62 HIS ND1 . 25850 1 797 . 1 1 62 62 HIS NE2 N 15 175.409 0.100 . 1 . . . . A 62 HIS NE2 . 25850 1 798 . 1 1 63 63 ASP H H 1 8.521 0.020 . 1 . . . . A 63 ASP H . 25850 1 799 . 1 1 63 63 ASP HA H 1 4.854 0.020 . 1 . . . . A 63 ASP HA . 25850 1 800 . 1 1 63 63 ASP HB2 H 1 3.029 0.020 . 2 . . . . A 63 ASP HB2 . 25850 1 801 . 1 1 63 63 ASP HB3 H 1 2.607 0.020 . 2 . . . . A 63 ASP HB3 . 25850 1 802 . 1 1 63 63 ASP C C 13 176.143 0.100 . 1 . . . . A 63 ASP C . 25850 1 803 . 1 1 63 63 ASP CA C 13 52.127 0.100 . 1 . . . . A 63 ASP CA . 25850 1 804 . 1 1 63 63 ASP CB C 13 40.068 0.100 . 1 . . . . A 63 ASP CB . 25850 1 805 . 1 1 63 63 ASP N N 15 118.507 0.100 . 1 . . . . A 63 ASP N . 25850 1 806 . 1 1 64 64 THR H H 1 7.907 0.020 . 1 . . . . A 64 THR H . 25850 1 807 . 1 1 64 64 THR HA H 1 3.869 0.020 . 1 . . . . A 64 THR HA . 25850 1 808 . 1 1 64 64 THR HB H 1 4.108 0.020 . 1 . . . . A 64 THR HB . 25850 1 809 . 1 1 64 64 THR HG21 H 1 1.207 0.020 . 1 . . . . A 64 THR HG21 . 25850 1 810 . 1 1 64 64 THR HG22 H 1 1.207 0.020 . 1 . . . . A 64 THR HG22 . 25850 1 811 . 1 1 64 64 THR HG23 H 1 1.207 0.020 . 1 . . . . A 64 THR HG23 . 25850 1 812 . 1 1 64 64 THR C C 13 176.814 0.100 . 1 . . . . A 64 THR C . 25850 1 813 . 1 1 64 64 THR CA C 13 65.198 0.100 . 1 . . . . A 64 THR CA . 25850 1 814 . 1 1 64 64 THR CB C 13 68.315 0.100 . 1 . . . . A 64 THR CB . 25850 1 815 . 1 1 64 64 THR CG2 C 13 21.854 0.100 . 1 . . . . A 64 THR CG2 . 25850 1 816 . 1 1 64 64 THR N N 15 119.037 0.100 . 1 . . . . A 64 THR N . 25850 1 817 . 1 1 65 65 ASP H H 1 8.375 0.020 . 1 . . . . A 65 ASP H . 25850 1 818 . 1 1 65 65 ASP HA H 1 4.287 0.020 . 1 . . . . A 65 ASP HA . 25850 1 819 . 1 1 65 65 ASP HB2 H 1 2.455 0.020 . 2 . . . . A 65 ASP HB2 . 25850 1 820 . 1 1 65 65 ASP HB3 H 1 2.608 0.020 . 2 . . . . A 65 ASP HB3 . 25850 1 821 . 1 1 65 65 ASP C C 13 178.326 0.100 . 1 . . . . A 65 ASP C . 25850 1 822 . 1 1 65 65 ASP CA C 13 57.350 0.100 . 1 . . . . A 65 ASP CA . 25850 1 823 . 1 1 65 65 ASP CB C 13 41.121 0.100 . 1 . . . . A 65 ASP CB . 25850 1 824 . 1 1 65 65 ASP N N 15 122.892 0.100 . 1 . . . . A 65 ASP N . 25850 1 825 . 1 1 66 66 GLY H H 1 8.234 0.020 . 1 . . . . A 66 GLY H . 25850 1 826 . 1 1 66 66 GLY HA2 H 1 2.722 0.020 . 2 . . . . A 66 GLY HA2 . 25850 1 827 . 1 1 66 66 GLY HA3 H 1 1.567 0.020 . 2 . . . . A 66 GLY HA3 . 25850 1 828 . 1 1 66 66 GLY C C 13 175.861 0.100 . 1 . . . . A 66 GLY C . 25850 1 829 . 1 1 66 66 GLY CA C 13 46.136 0.100 . 1 . . . . A 66 GLY CA . 25850 1 830 . 1 1 66 66 GLY N N 15 109.334 0.100 . 1 . . . . A 66 GLY N . 25850 1 831 . 1 1 67 67 ALA H H 1 7.949 0.020 . 1 . . . . A 67 ALA H . 25850 1 832 . 1 1 67 67 ALA HA H 1 3.892 0.020 . 1 . . . . A 67 ALA HA . 25850 1 833 . 1 1 67 67 ALA HB1 H 1 1.476 0.020 . 1 . . . . A 67 ALA HB1 . 25850 1 834 . 1 1 67 67 ALA HB2 H 1 1.476 0.020 . 1 . . . . A 67 ALA HB2 . 25850 1 835 . 1 1 67 67 ALA HB3 H 1 1.476 0.020 . 1 . . . . A 67 ALA HB3 . 25850 1 836 . 1 1 67 67 ALA C C 13 179.384 0.100 . 1 . . . . A 67 ALA C . 25850 1 837 . 1 1 67 67 ALA CA C 13 55.960 0.100 . 1 . . . . A 67 ALA CA . 25850 1 838 . 1 1 67 67 ALA CB C 13 18.611 0.100 . 1 . . . . A 67 ALA CB . 25850 1 839 . 1 1 67 67 ALA N N 15 122.888 0.100 . 1 . . . . A 67 ALA N . 25850 1 840 . 1 1 68 68 ARG H H 1 7.917 0.020 . 1 . . . . A 68 ARG H . 25850 1 841 . 1 1 68 68 ARG HA H 1 3.993 0.020 . 1 . . . . A 68 ARG HA . 25850 1 842 . 1 1 68 68 ARG HB2 H 1 1.912 0.020 . 1 . . . . A 68 ARG HB2 . 25850 1 843 . 1 1 68 68 ARG HB3 H 1 1.912 0.020 . 1 . . . . A 68 ARG HB3 . 25850 1 844 . 1 1 68 68 ARG HG2 H 1 1.757 0.020 . 2 . . . . A 68 ARG HG2 . 25850 1 845 . 1 1 68 68 ARG HG3 H 1 1.571 0.020 . 2 . . . . A 68 ARG HG3 . 25850 1 846 . 1 1 68 68 ARG HD2 H 1 3.177 0.020 . 1 . . . . A 68 ARG HD2 . 25850 1 847 . 1 1 68 68 ARG HD3 H 1 3.177 0.020 . 1 . . . . A 68 ARG HD3 . 25850 1 848 . 1 1 68 68 ARG C C 13 179.355 0.100 . 1 . . . . A 68 ARG C . 25850 1 849 . 1 1 68 68 ARG CA C 13 59.234 0.100 . 1 . . . . A 68 ARG CA . 25850 1 850 . 1 1 68 68 ARG CB C 13 29.799 0.100 . 1 . . . . A 68 ARG CB . 25850 1 851 . 1 1 68 68 ARG CG C 13 27.434 0.100 . 1 . . . . A 68 ARG CG . 25850 1 852 . 1 1 68 68 ARG CD C 13 43.233 0.100 . 1 . . . . A 68 ARG CD . 25850 1 853 . 1 1 68 68 ARG N N 15 118.221 0.100 . 1 . . . . A 68 ARG N . 25850 1 854 . 1 1 69 69 ARG H H 1 7.749 0.020 . 1 . . . . A 69 ARG H . 25850 1 855 . 1 1 69 69 ARG HA H 1 3.923 0.020 . 1 . . . . A 69 ARG HA . 25850 1 856 . 1 1 69 69 ARG HB2 H 1 1.590 0.020 . 2 . . . . A 69 ARG HB2 . 25850 1 857 . 1 1 69 69 ARG HB3 H 1 1.528 0.020 . 2 . . . . A 69 ARG HB3 . 25850 1 858 . 1 1 69 69 ARG HG2 H 1 1.591 0.020 . 2 . . . . A 69 ARG HG2 . 25850 1 859 . 1 1 69 69 ARG HG3 H 1 1.432 0.020 . 2 . . . . A 69 ARG HG3 . 25850 1 860 . 1 1 69 69 ARG HD2 H 1 3.028 0.020 . 2 . . . . A 69 ARG HD2 . 25850 1 861 . 1 1 69 69 ARG HD3 H 1 2.809 0.020 . 2 . . . . A 69 ARG HD3 . 25850 1 862 . 1 1 69 69 ARG C C 13 179.120 0.100 . 1 . . . . A 69 ARG C . 25850 1 863 . 1 1 69 69 ARG CA C 13 59.310 0.100 . 1 . . . . A 69 ARG CA . 25850 1 864 . 1 1 69 69 ARG CB C 13 29.189 0.100 . 1 . . . . A 69 ARG CB . 25850 1 865 . 1 1 69 69 ARG CG C 13 27.725 0.100 . 1 . . . . A 69 ARG CG . 25850 1 866 . 1 1 69 69 ARG CD C 13 43.253 0.100 . 1 . . . . A 69 ARG CD . 25850 1 867 . 1 1 69 69 ARG N N 15 120.551 0.100 . 1 . . . . A 69 ARG N . 25850 1 868 . 1 1 70 70 ALA H H 1 8.245 0.020 . 1 . . . . A 70 ALA H . 25850 1 869 . 1 1 70 70 ALA HA H 1 4.016 0.020 . 1 . . . . A 70 ALA HA . 25850 1 870 . 1 1 70 70 ALA HB1 H 1 1.588 0.020 . 1 . . . . A 70 ALA HB1 . 25850 1 871 . 1 1 70 70 ALA HB2 H 1 1.588 0.020 . 1 . . . . A 70 ALA HB2 . 25850 1 872 . 1 1 70 70 ALA HB3 H 1 1.588 0.020 . 1 . . . . A 70 ALA HB3 . 25850 1 873 . 1 1 70 70 ALA C C 13 178.438 0.100 . 1 . . . . A 70 ALA C . 25850 1 874 . 1 1 70 70 ALA CA C 13 55.536 0.100 . 1 . . . . A 70 ALA CA . 25850 1 875 . 1 1 70 70 ALA CB C 13 17.216 0.100 . 1 . . . . A 70 ALA CB . 25850 1 876 . 1 1 70 70 ALA N N 15 121.098 0.100 . 1 . . . . A 70 ALA N . 25850 1 877 . 1 1 71 71 ALA H H 1 8.565 0.020 . 1 . . . . A 71 ALA H . 25850 1 878 . 1 1 71 71 ALA HA H 1 4.047 0.020 . 1 . . . . A 71 ALA HA . 25850 1 879 . 1 1 71 71 ALA HB1 H 1 1.509 0.020 . 1 . . . . A 71 ALA HB1 . 25850 1 880 . 1 1 71 71 ALA HB2 H 1 1.509 0.020 . 1 . . . . A 71 ALA HB2 . 25850 1 881 . 1 1 71 71 ALA HB3 H 1 1.509 0.020 . 1 . . . . A 71 ALA HB3 . 25850 1 882 . 1 1 71 71 ALA C C 13 180.219 0.100 . 1 . . . . A 71 ALA C . 25850 1 883 . 1 1 71 71 ALA CA C 13 55.083 0.100 . 1 . . . . A 71 ALA CA . 25850 1 884 . 1 1 71 71 ALA CB C 13 18.198 0.100 . 1 . . . . A 71 ALA CB . 25850 1 885 . 1 1 71 71 ALA N N 15 119.333 0.100 . 1 . . . . A 71 ALA N . 25850 1 886 . 1 1 72 72 LYS H H 1 8.108 0.020 . 1 . . . . A 72 LYS H . 25850 1 887 . 1 1 72 72 LYS HA H 1 4.107 0.020 . 1 . . . . A 72 LYS HA . 25850 1 888 . 1 1 72 72 LYS HB2 H 1 1.993 0.020 . 2 . . . . A 72 LYS HB2 . 25850 1 889 . 1 1 72 72 LYS HB3 H 1 1.874 0.020 . 2 . . . . A 72 LYS HB3 . 25850 1 890 . 1 1 72 72 LYS HG2 H 1 1.442 0.020 . 2 . . . . A 72 LYS HG2 . 25850 1 891 . 1 1 72 72 LYS HG3 H 1 1.369 0.020 . 2 . . . . A 72 LYS HG3 . 25850 1 892 . 1 1 72 72 LYS HD2 H 1 1.715 0.020 . 1 . . . . A 72 LYS HD2 . 25850 1 893 . 1 1 72 72 LYS HD3 H 1 1.715 0.020 . 1 . . . . A 72 LYS HD3 . 25850 1 894 . 1 1 72 72 LYS HE2 H 1 2.957 0.020 . 1 . . . . A 72 LYS HE2 . 25850 1 895 . 1 1 72 72 LYS HE3 H 1 2.957 0.020 . 1 . . . . A 72 LYS HE3 . 25850 1 896 . 1 1 72 72 LYS C C 13 179.155 0.100 . 1 . . . . A 72 LYS C . 25850 1 897 . 1 1 72 72 LYS CA C 13 59.271 0.100 . 1 . . . . A 72 LYS CA . 25850 1 898 . 1 1 72 72 LYS CB C 13 31.786 0.100 . 1 . . . . A 72 LYS CB . 25850 1 899 . 1 1 72 72 LYS CG C 13 24.563 0.100 . 1 . . . . A 72 LYS CG . 25850 1 900 . 1 1 72 72 LYS CD C 13 29.182 0.100 . 1 . . . . A 72 LYS CD . 25850 1 901 . 1 1 72 72 LYS CE C 13 42.091 0.100 . 1 . . . . A 72 LYS CE . 25850 1 902 . 1 1 72 72 LYS N N 15 121.188 0.100 . 1 . . . . A 72 LYS N . 25850 1 903 . 1 1 73 73 SER H H 1 8.057 0.020 . 1 . . . . A 73 SER H . 25850 1 904 . 1 1 73 73 SER HA H 1 3.957 0.020 . 1 . . . . A 73 SER HA . 25850 1 905 . 1 1 73 73 SER HB2 H 1 2.987 0.020 . 2 . . . . A 73 SER HB2 . 25850 1 906 . 1 1 73 73 SER HB3 H 1 2.560 0.020 . 2 . . . . A 73 SER HB3 . 25850 1 907 . 1 1 73 73 SER C C 13 176.394 0.100 . 1 . . . . A 73 SER C . 25850 1 908 . 1 1 73 73 SER CA C 13 62.753 0.100 . 1 . . . . A 73 SER CA . 25850 1 909 . 1 1 73 73 SER CB C 13 60.718 0.100 . 1 . . . . A 73 SER CB . 25850 1 910 . 1 1 73 73 SER N N 15 116.976 0.100 . 1 . . . . A 73 SER N . 25850 1 911 . 1 1 74 74 LEU H H 1 8.341 0.020 . 1 . . . . A 74 LEU H . 25850 1 912 . 1 1 74 74 LEU HA H 1 3.831 0.020 . 1 . . . . A 74 LEU HA . 25850 1 913 . 1 1 74 74 LEU HB2 H 1 1.800 0.020 . 2 . . . . A 74 LEU HB2 . 25850 1 914 . 1 1 74 74 LEU HB3 H 1 1.701 0.020 . 2 . . . . A 74 LEU HB3 . 25850 1 915 . 1 1 74 74 LEU HG H 1 1.579 0.020 . 1 . . . . A 74 LEU HG . 25850 1 916 . 1 1 74 74 LEU HD11 H 1 0.872 0.020 . 2 . . . . A 74 LEU HD11 . 25850 1 917 . 1 1 74 74 LEU HD12 H 1 0.872 0.020 . 2 . . . . A 74 LEU HD12 . 25850 1 918 . 1 1 74 74 LEU HD13 H 1 0.872 0.020 . 2 . . . . A 74 LEU HD13 . 25850 1 919 . 1 1 74 74 LEU HD21 H 1 1.056 0.020 . 2 . . . . A 74 LEU HD21 . 25850 1 920 . 1 1 74 74 LEU HD22 H 1 1.056 0.020 . 2 . . . . A 74 LEU HD22 . 25850 1 921 . 1 1 74 74 LEU HD23 H 1 1.056 0.020 . 2 . . . . A 74 LEU HD23 . 25850 1 922 . 1 1 74 74 LEU C C 13 176.704 0.100 . 1 . . . . A 74 LEU C . 25850 1 923 . 1 1 74 74 LEU CA C 13 58.545 0.100 . 1 . . . . A 74 LEU CA . 25850 1 924 . 1 1 74 74 LEU CB C 13 41.862 0.100 . 1 . . . . A 74 LEU CB . 25850 1 925 . 1 1 74 74 LEU CG C 13 27.298 0.100 . 1 . . . . A 74 LEU CG . 25850 1 926 . 1 1 74 74 LEU CD1 C 13 25.025 0.100 . 1 . . . . A 74 LEU CD1 . 25850 1 927 . 1 1 74 74 LEU CD2 C 13 26.021 0.100 . 1 . . . . A 74 LEU CD2 . 25850 1 928 . 1 1 74 74 LEU N N 15 123.741 0.100 . 1 . . . . A 74 LEU N . 25850 1 929 . 1 1 75 75 SER H H 1 8.055 0.020 . 1 . . . . A 75 SER H . 25850 1 930 . 1 1 75 75 SER HA H 1 4.277 0.020 . 1 . . . . A 75 SER HA . 25850 1 931 . 1 1 75 75 SER HB2 H 1 4.069 0.020 . 1 . . . . A 75 SER HB2 . 25850 1 932 . 1 1 75 75 SER HB3 H 1 4.069 0.020 . 1 . . . . A 75 SER HB3 . 25850 1 933 . 1 1 75 75 SER C C 13 177.668 0.100 . 1 . . . . A 75 SER C . 25850 1 934 . 1 1 75 75 SER CA C 13 61.926 0.100 . 1 . . . . A 75 SER CA . 25850 1 935 . 1 1 75 75 SER CB C 13 62.702 0.100 . 1 . . . . A 75 SER CB . 25850 1 936 . 1 1 75 75 SER N N 15 113.508 0.100 . 1 . . . . A 75 SER N . 25850 1 937 . 1 1 76 76 GLU H H 1 7.874 0.020 . 1 . . . . A 76 GLU H . 25850 1 938 . 1 1 76 76 GLU HA H 1 4.041 0.020 . 1 . . . . A 76 GLU HA . 25850 1 939 . 1 1 76 76 GLU HB2 H 1 2.107 0.020 . 2 . . . . A 76 GLU HB2 . 25850 1 940 . 1 1 76 76 GLU HB3 H 1 1.999 0.020 . 2 . . . . A 76 GLU HB3 . 25850 1 941 . 1 1 76 76 GLU HG2 H 1 2.202 0.020 . 2 . . . . A 76 GLU HG2 . 25850 1 942 . 1 1 76 76 GLU HG3 H 1 2.480 0.020 . 2 . . . . A 76 GLU HG3 . 25850 1 943 . 1 1 76 76 GLU C C 13 178.836 0.100 . 1 . . . . A 76 GLU C . 25850 1 944 . 1 1 76 76 GLU CA C 13 58.928 0.100 . 1 . . . . A 76 GLU CA . 25850 1 945 . 1 1 76 76 GLU CB C 13 29.684 0.100 . 1 . . . . A 76 GLU CB . 25850 1 946 . 1 1 76 76 GLU CG C 13 36.289 0.100 . 1 . . . . A 76 GLU CG . 25850 1 947 . 1 1 76 76 GLU N N 15 119.999 0.100 . 1 . . . . A 76 GLU N . 25850 1 948 . 1 1 77 77 ALA H H 1 8.043 0.020 . 1 . . . . A 77 ALA H . 25850 1 949 . 1 1 77 77 ALA HA H 1 4.242 0.020 . 1 . . . . A 77 ALA HA . 25850 1 950 . 1 1 77 77 ALA HB1 H 1 1.471 0.020 . 1 . . . . A 77 ALA HB1 . 25850 1 951 . 1 1 77 77 ALA HB2 H 1 1.471 0.020 . 1 . . . . A 77 ALA HB2 . 25850 1 952 . 1 1 77 77 ALA HB3 H 1 1.471 0.020 . 1 . . . . A 77 ALA HB3 . 25850 1 953 . 1 1 77 77 ALA C C 13 180.005 0.100 . 1 . . . . A 77 ALA C . 25850 1 954 . 1 1 77 77 ALA CA C 13 55.031 0.100 . 1 . . . . A 77 ALA CA . 25850 1 955 . 1 1 77 77 ALA CB C 13 18.237 0.100 . 1 . . . . A 77 ALA CB . 25850 1 956 . 1 1 77 77 ALA N N 15 123.551 0.100 . 1 . . . . A 77 ALA N . 25850 1 957 . 1 1 78 78 TYR H H 1 8.699 0.020 . 1 . . . . A 78 TYR H . 25850 1 958 . 1 1 78 78 TYR HA H 1 4.418 0.020 . 1 . . . . A 78 TYR HA . 25850 1 959 . 1 1 78 78 TYR HB2 H 1 3.047 0.020 . 1 . . . . A 78 TYR HB2 . 25850 1 960 . 1 1 78 78 TYR HB3 H 1 3.175 0.020 . 1 . . . . A 78 TYR HB3 . 25850 1 961 . 1 1 78 78 TYR HD1 H 1 7.133 0.020 . 1 . . . . A 78 TYR HD1 . 25850 1 962 . 1 1 78 78 TYR HD2 H 1 7.133 0.020 . 1 . . . . A 78 TYR HD2 . 25850 1 963 . 1 1 78 78 TYR HE1 H 1 6.800 0.020 . 1 . . . . A 78 TYR HE1 . 25850 1 964 . 1 1 78 78 TYR HE2 H 1 6.800 0.020 . 1 . . . . A 78 TYR HE2 . 25850 1 965 . 1 1 78 78 TYR C C 13 178.901 0.100 . 1 . . . . A 78 TYR C . 25850 1 966 . 1 1 78 78 TYR CA C 13 60.302 0.100 . 1 . . . . A 78 TYR CA . 25850 1 967 . 1 1 78 78 TYR CB C 13 37.416 0.100 . 1 . . . . A 78 TYR CB . 25850 1 968 . 1 1 78 78 TYR CD1 C 13 132.160 0.100 . 1 . . . . A 78 TYR CD1 . 25850 1 969 . 1 1 78 78 TYR CD2 C 13 132.160 0.100 . 1 . . . . A 78 TYR CD2 . 25850 1 970 . 1 1 78 78 TYR CE1 C 13 117.886 0.100 . 1 . . . . A 78 TYR CE1 . 25850 1 971 . 1 1 78 78 TYR CE2 C 13 117.886 0.100 . 1 . . . . A 78 TYR CE2 . 25850 1 972 . 1 1 78 78 TYR N N 15 116.371 0.100 . 1 . . . . A 78 TYR N . 25850 1 973 . 1 1 79 79 GLN H H 1 7.667 0.020 . 1 . . . . A 79 GLN H . 25850 1 974 . 1 1 79 79 GLN HA H 1 4.212 0.020 . 1 . . . . A 79 GLN HA . 25850 1 975 . 1 1 79 79 GLN HB2 H 1 2.229 0.020 . 1 . . . . A 79 GLN HB2 . 25850 1 976 . 1 1 79 79 GLN HB3 H 1 2.229 0.020 . 1 . . . . A 79 GLN HB3 . 25850 1 977 . 1 1 79 79 GLN HG2 H 1 2.629 0.020 . 2 . . . . A 79 GLN HG2 . 25850 1 978 . 1 1 79 79 GLN HG3 H 1 2.465 0.020 . 2 . . . . A 79 GLN HG3 . 25850 1 979 . 1 1 79 79 GLN HE21 H 1 7.439 0.020 . 1 . . . . A 79 GLN HE21 . 25850 1 980 . 1 1 79 79 GLN HE22 H 1 6.870 0.020 . 1 . . . . A 79 GLN HE22 . 25850 1 981 . 1 1 79 79 GLN C C 13 177.778 0.100 . 1 . . . . A 79 GLN C . 25850 1 982 . 1 1 79 79 GLN CA C 13 57.922 0.100 . 1 . . . . A 79 GLN CA . 25850 1 983 . 1 1 79 79 GLN CB C 13 28.659 0.100 . 1 . . . . A 79 GLN CB . 25850 1 984 . 1 1 79 79 GLN CG C 13 34.124 0.100 . 1 . . . . A 79 GLN CG . 25850 1 985 . 1 1 79 79 GLN N N 15 116.649 0.100 . 1 . . . . A 79 GLN N . 25850 1 986 . 1 1 79 79 GLN NE2 N 15 111.896 0.100 . 1 . . . . A 79 GLN NE2 . 25850 1 987 . 1 1 80 80 LYS H H 1 7.766 0.020 . 1 . . . . A 80 LYS H . 25850 1 988 . 1 1 80 80 LYS HA H 1 4.293 0.020 . 1 . . . . A 80 LYS HA . 25850 1 989 . 1 1 80 80 LYS HB2 H 1 2.074 0.020 . 1 . . . . A 80 LYS HB2 . 25850 1 990 . 1 1 80 80 LYS HB3 H 1 2.074 0.020 . 1 . . . . A 80 LYS HB3 . 25850 1 991 . 1 1 80 80 LYS HG2 H 1 1.642 0.020 . 2 . . . . A 80 LYS HG2 . 25850 1 992 . 1 1 80 80 LYS HG3 H 1 1.519 0.020 . 2 . . . . A 80 LYS HG3 . 25850 1 993 . 1 1 80 80 LYS HD2 H 1 1.739 0.020 . 1 . . . . A 80 LYS HD2 . 25850 1 994 . 1 1 80 80 LYS HD3 H 1 1.739 0.020 . 1 . . . . A 80 LYS HD3 . 25850 1 995 . 1 1 80 80 LYS HE2 H 1 3.003 0.020 . 1 . . . . A 80 LYS HE2 . 25850 1 996 . 1 1 80 80 LYS HE3 H 1 3.003 0.020 . 1 . . . . A 80 LYS HE3 . 25850 1 997 . 1 1 80 80 LYS C C 13 178.038 0.100 . 1 . . . . A 80 LYS C . 25850 1 998 . 1 1 80 80 LYS CA C 13 57.474 0.100 . 1 . . . . A 80 LYS CA . 25850 1 999 . 1 1 80 80 LYS CB C 13 32.816 0.100 . 1 . . . . A 80 LYS CB . 25850 1 1000 . 1 1 80 80 LYS CG C 13 24.961 0.100 . 1 . . . . A 80 LYS CG . 25850 1 1001 . 1 1 80 80 LYS CD C 13 29.033 0.100 . 1 . . . . A 80 LYS CD . 25850 1 1002 . 1 1 80 80 LYS CE C 13 42.043 0.100 . 1 . . . . A 80 LYS CE . 25850 1 1003 . 1 1 80 80 LYS N N 15 118.855 0.100 . 1 . . . . A 80 LYS N . 25850 1 1004 . 1 1 81 81 VAL H H 1 7.821 0.020 . 1 . . . . A 81 VAL H . 25850 1 1005 . 1 1 81 81 VAL HA H 1 4.076 0.020 . 1 . . . . A 81 VAL HA . 25850 1 1006 . 1 1 81 81 VAL HB H 1 2.239 0.020 . 1 . . . . A 81 VAL HB . 25850 1 1007 . 1 1 81 81 VAL HG11 H 1 0.999 0.020 . 2 . . . . A 81 VAL HG11 . 25850 1 1008 . 1 1 81 81 VAL HG12 H 1 0.999 0.020 . 2 . . . . A 81 VAL HG12 . 25850 1 1009 . 1 1 81 81 VAL HG13 H 1 0.999 0.020 . 2 . . . . A 81 VAL HG13 . 25850 1 1010 . 1 1 81 81 VAL HG21 H 1 1.048 0.020 . 2 . . . . A 81 VAL HG21 . 25850 1 1011 . 1 1 81 81 VAL HG22 H 1 1.048 0.020 . 2 . . . . A 81 VAL HG22 . 25850 1 1012 . 1 1 81 81 VAL HG23 H 1 1.048 0.020 . 2 . . . . A 81 VAL HG23 . 25850 1 1013 . 1 1 81 81 VAL C C 13 176.805 0.100 . 1 . . . . A 81 VAL C . 25850 1 1014 . 1 1 81 81 VAL CA C 13 63.409 0.100 . 1 . . . . A 81 VAL CA . 25850 1 1015 . 1 1 81 81 VAL CB C 13 32.423 0.100 . 1 . . . . A 81 VAL CB . 25850 1 1016 . 1 1 81 81 VAL CG1 C 13 21.293 0.100 . 1 . . . . A 81 VAL CG1 . 25850 1 1017 . 1 1 81 81 VAL CG2 C 13 21.480 0.100 . 1 . . . . A 81 VAL CG2 . 25850 1 1018 . 1 1 81 81 VAL N N 15 117.863 0.100 . 1 . . . . A 81 VAL N . 25850 1 1019 . 1 1 82 82 GLU H H 1 8.329 0.020 . 1 . . . . A 82 GLU H . 25850 1 1020 . 1 1 82 82 GLU HA H 1 4.277 0.020 . 1 . . . . A 82 GLU HA . 25850 1 1021 . 1 1 82 82 GLU HB2 H 1 2.095 0.020 . 2 . . . . A 82 GLU HB2 . 25850 1 1022 . 1 1 82 82 GLU HB3 H 1 2.051 0.020 . 2 . . . . A 82 GLU HB3 . 25850 1 1023 . 1 1 82 82 GLU HG2 H 1 2.364 0.020 . 2 . . . . A 82 GLU HG2 . 25850 1 1024 . 1 1 82 82 GLU HG3 H 1 2.314 0.020 . 2 . . . . A 82 GLU HG3 . 25850 1 1025 . 1 1 82 82 GLU C C 13 177.559 0.100 . 1 . . . . A 82 GLU C . 25850 1 1026 . 1 1 82 82 GLU CA C 13 57.300 0.100 . 1 . . . . A 82 GLU CA . 25850 1 1027 . 1 1 82 82 GLU CB C 13 29.927 0.100 . 1 . . . . A 82 GLU CB . 25850 1 1028 . 1 1 82 82 GLU CG C 13 36.109 0.100 . 1 . . . . A 82 GLU CG . 25850 1 1029 . 1 1 82 82 GLU N N 15 122.552 0.100 . 1 . . . . A 82 GLU N . 25850 1 1030 . 1 1 83 83 GLY H H 1 8.309 0.020 . 1 . . . . A 83 GLY H . 25850 1 1031 . 1 1 83 83 GLY HA2 H 1 4.050 0.020 . 1 . . . . A 83 GLY HA2 . 25850 1 1032 . 1 1 83 83 GLY HA3 H 1 4.050 0.020 . 1 . . . . A 83 GLY HA3 . 25850 1 1033 . 1 1 83 83 GLY C C 13 174.590 0.100 . 1 . . . . A 83 GLY C . 25850 1 1034 . 1 1 83 83 GLY CA C 13 45.530 0.100 . 1 . . . . A 83 GLY CA . 25850 1 1035 . 1 1 83 83 GLY N N 15 109.040 0.100 . 1 . . . . A 83 GLY N . 25850 1 1036 . 1 1 84 84 SER H H 1 8.180 0.020 . 1 . . . . A 84 SER H . 25850 1 1037 . 1 1 84 84 SER HA H 1 4.495 0.020 . 1 . . . . A 84 SER HA . 25850 1 1038 . 1 1 84 84 SER HB2 H 1 3.976 0.020 . 2 . . . . A 84 SER HB2 . 25850 1 1039 . 1 1 84 84 SER HB3 H 1 3.921 0.020 . 2 . . . . A 84 SER HB3 . 25850 1 1040 . 1 1 84 84 SER C C 13 175.217 0.100 . 1 . . . . A 84 SER C . 25850 1 1041 . 1 1 84 84 SER CA C 13 58.580 0.100 . 1 . . . . A 84 SER CA . 25850 1 1042 . 1 1 84 84 SER CB C 13 63.827 0.100 . 1 . . . . A 84 SER CB . 25850 1 1043 . 1 1 84 84 SER N N 15 115.258 0.100 . 1 . . . . A 84 SER N . 25850 1 1044 . 1 1 85 85 GLY H H 1 8.472 0.020 . 1 . . . . A 85 GLY H . 25850 1 1045 . 1 1 85 85 GLY HA2 H 1 3.982 0.020 . 1 . . . . A 85 GLY HA2 . 25850 1 1046 . 1 1 85 85 GLY HA3 H 1 3.982 0.020 . 1 . . . . A 85 GLY HA3 . 25850 1 1047 . 1 1 85 85 GLY C C 13 174.063 0.100 . 1 . . . . A 85 GLY C . 25850 1 1048 . 1 1 85 85 GLY CA C 13 45.395 0.100 . 1 . . . . A 85 GLY CA . 25850 1 1049 . 1 1 85 85 GLY N N 15 110.681 0.100 . 1 . . . . A 85 GLY N . 25850 1 1050 . 1 1 86 86 ASP H H 1 8.272 0.020 . 1 . . . . A 86 ASP H . 25850 1 1051 . 1 1 86 86 ASP HA H 1 4.597 0.020 . 1 . . . . A 86 ASP HA . 25850 1 1052 . 1 1 86 86 ASP HB2 H 1 2.714 0.020 . 2 . . . . A 86 ASP HB2 . 25850 1 1053 . 1 1 86 86 ASP HB3 H 1 2.630 0.020 . 2 . . . . A 86 ASP HB3 . 25850 1 1054 . 1 1 86 86 ASP C C 13 176.761 0.100 . 1 . . . . A 86 ASP C . 25850 1 1055 . 1 1 86 86 ASP CA C 13 54.451 0.100 . 1 . . . . A 86 ASP CA . 25850 1 1056 . 1 1 86 86 ASP CB C 13 41.069 0.100 . 1 . . . . A 86 ASP CB . 25850 1 1057 . 1 1 86 86 ASP N N 15 120.537 0.100 . 1 . . . . A 86 ASP N . 25850 1 1058 . 1 1 87 87 LYS H H 1 8.344 0.020 . 1 . . . . A 87 LYS H . 25850 1 1059 . 1 1 87 87 LYS HA H 1 4.246 0.020 . 1 . . . . A 87 LYS HA . 25850 1 1060 . 1 1 87 87 LYS HB2 H 1 1.877 0.020 . 2 . . . . A 87 LYS HB2 . 25850 1 1061 . 1 1 87 87 LYS HB3 H 1 1.778 0.020 . 2 . . . . A 87 LYS HB3 . 25850 1 1062 . 1 1 87 87 LYS HG2 H 1 1.424 0.020 . 1 . . . . A 87 LYS HG2 . 25850 1 1063 . 1 1 87 87 LYS HG3 H 1 1.424 0.020 . 1 . . . . A 87 LYS HG3 . 25850 1 1064 . 1 1 87 87 LYS HD2 H 1 1.676 0.020 . 1 . . . . A 87 LYS HD2 . 25850 1 1065 . 1 1 87 87 LYS HD3 H 1 1.676 0.020 . 1 . . . . A 87 LYS HD3 . 25850 1 1066 . 1 1 87 87 LYS HE2 H 1 2.950 0.020 . 1 . . . . A 87 LYS HE2 . 25850 1 1067 . 1 1 87 87 LYS HE3 H 1 2.950 0.020 . 1 . . . . A 87 LYS HE3 . 25850 1 1068 . 1 1 87 87 LYS C C 13 177.342 0.100 . 1 . . . . A 87 LYS C . 25850 1 1069 . 1 1 87 87 LYS CA C 13 56.545 0.100 . 1 . . . . A 87 LYS CA . 25850 1 1070 . 1 1 87 87 LYS CB C 13 32.302 0.100 . 1 . . . . A 87 LYS CB . 25850 1 1071 . 1 1 87 87 LYS CG C 13 24.583 0.100 . 1 . . . . A 87 LYS CG . 25850 1 1072 . 1 1 87 87 LYS CD C 13 28.974 0.100 . 1 . . . . A 87 LYS CD . 25850 1 1073 . 1 1 87 87 LYS CE C 13 41.954 0.100 . 1 . . . . A 87 LYS CE . 25850 1 1074 . 1 1 87 87 LYS N N 15 121.608 0.100 . 1 . . . . A 87 LYS N . 25850 1 1075 . 1 1 88 88 GLY H H 1 8.449 0.020 . 1 . . . . A 88 GLY H . 25850 1 1076 . 1 1 88 88 GLY HA2 H 1 3.927 0.020 . 1 . . . . A 88 GLY HA2 . 25850 1 1077 . 1 1 88 88 GLY HA3 H 1 3.927 0.020 . 1 . . . . A 88 GLY HA3 . 25850 1 1078 . 1 1 88 88 GLY C C 13 174.216 0.100 . 1 . . . . A 88 GLY C . 25850 1 1079 . 1 1 88 88 GLY CA C 13 45.339 0.100 . 1 . . . . A 88 GLY CA . 25850 1 1080 . 1 1 88 88 GLY N N 15 108.711 0.100 . 1 . . . . A 88 GLY N . 25850 1 1081 . 1 1 89 89 LYS H H 1 7.958 0.020 . 1 . . . . A 89 LYS H . 25850 1 1082 . 1 1 89 89 LYS HA H 1 4.266 0.020 . 1 . . . . A 89 LYS HA . 25850 1 1083 . 1 1 89 89 LYS HB2 H 1 1.739 0.020 . 2 . . . . A 89 LYS HB2 . 25850 1 1084 . 1 1 89 89 LYS HB3 H 1 1.698 0.020 . 2 . . . . A 89 LYS HB3 . 25850 1 1085 . 1 1 89 89 LYS HG2 H 1 1.294 0.020 . 2 . . . . A 89 LYS HG2 . 25850 1 1086 . 1 1 89 89 LYS HG3 H 1 1.373 0.020 . 2 . . . . A 89 LYS HG3 . 25850 1 1087 . 1 1 89 89 LYS HD2 H 1 1.647 0.020 . 1 . . . . A 89 LYS HD2 . 25850 1 1088 . 1 1 89 89 LYS HD3 H 1 1.647 0.020 . 1 . . . . A 89 LYS HD3 . 25850 1 1089 . 1 1 89 89 LYS HE2 H 1 2.950 0.020 . 1 . . . . A 89 LYS HE2 . 25850 1 1090 . 1 1 89 89 LYS HE3 H 1 2.950 0.020 . 1 . . . . A 89 LYS HE3 . 25850 1 1091 . 1 1 89 89 LYS C C 13 176.464 0.100 . 1 . . . . A 89 LYS C . 25850 1 1092 . 1 1 89 89 LYS CA C 13 56.214 0.100 . 1 . . . . A 89 LYS CA . 25850 1 1093 . 1 1 89 89 LYS CB C 13 32.824 0.100 . 1 . . . . A 89 LYS CB . 25850 1 1094 . 1 1 89 89 LYS CG C 13 24.593 0.100 . 1 . . . . A 89 LYS CG . 25850 1 1095 . 1 1 89 89 LYS CD C 13 29.028 0.100 . 1 . . . . A 89 LYS CD . 25850 1 1096 . 1 1 89 89 LYS CE C 13 42.095 0.100 . 1 . . . . A 89 LYS CE . 25850 1 1097 . 1 1 89 89 LYS N N 15 120.508 0.100 . 1 . . . . A 89 LYS N . 25850 1 1098 . 1 1 90 90 ILE H H 1 8.005 0.020 . 1 . . . . A 90 ILE H . 25850 1 1099 . 1 1 90 90 ILE HA H 1 4.091 0.020 . 1 . . . . A 90 ILE HA . 25850 1 1100 . 1 1 90 90 ILE HB H 1 1.750 0.020 . 1 . . . . A 90 ILE HB . 25850 1 1101 . 1 1 90 90 ILE HG12 H 1 1.349 0.020 . 2 . . . . A 90 ILE HG12 . 25850 1 1102 . 1 1 90 90 ILE HG13 H 1 1.097 0.020 . 2 . . . . A 90 ILE HG13 . 25850 1 1103 . 1 1 90 90 ILE HG21 H 1 0.755 0.020 . 1 . . . . A 90 ILE HG21 . 25850 1 1104 . 1 1 90 90 ILE HG22 H 1 0.755 0.020 . 1 . . . . A 90 ILE HG22 . 25850 1 1105 . 1 1 90 90 ILE HG23 H 1 0.755 0.020 . 1 . . . . A 90 ILE HG23 . 25850 1 1106 . 1 1 90 90 ILE HD11 H 1 0.795 0.020 . 1 . . . . A 90 ILE HD11 . 25850 1 1107 . 1 1 90 90 ILE HD12 H 1 0.795 0.020 . 1 . . . . A 90 ILE HD12 . 25850 1 1108 . 1 1 90 90 ILE HD13 H 1 0.795 0.020 . 1 . . . . A 90 ILE HD13 . 25850 1 1109 . 1 1 90 90 ILE C C 13 175.896 0.100 . 1 . . . . A 90 ILE C . 25850 1 1110 . 1 1 90 90 ILE CA C 13 61.022 0.100 . 1 . . . . A 90 ILE CA . 25850 1 1111 . 1 1 90 90 ILE CB C 13 38.488 0.100 . 1 . . . . A 90 ILE CB . 25850 1 1112 . 1 1 90 90 ILE CG1 C 13 27.059 0.100 . 1 . . . . A 90 ILE CG1 . 25850 1 1113 . 1 1 90 90 ILE CG2 C 13 17.290 0.100 . 1 . . . . A 90 ILE CG2 . 25850 1 1114 . 1 1 90 90 ILE CD1 C 13 12.741 0.100 . 1 . . . . A 90 ILE CD1 . 25850 1 1115 . 1 1 90 90 ILE N N 15 121.127 0.100 . 1 . . . . A 90 ILE N . 25850 1 1116 . 1 1 91 91 PHE H H 1 8.283 0.020 . 1 . . . . A 91 PHE H . 25850 1 1117 . 1 1 91 91 PHE HA H 1 4.615 0.020 . 1 . . . . A 91 PHE HA . 25850 1 1118 . 1 1 91 91 PHE HB2 H 1 3.127 0.020 . 2 . . . . A 91 PHE HB2 . 25850 1 1119 . 1 1 91 91 PHE HB3 H 1 2.976 0.020 . 2 . . . . A 91 PHE HB3 . 25850 1 1120 . 1 1 91 91 PHE HD1 H 1 7.245 0.020 . 1 . . . . A 91 PHE HD1 . 25850 1 1121 . 1 1 91 91 PHE HD2 H 1 7.245 0.020 . 1 . . . . A 91 PHE HD2 . 25850 1 1122 . 1 1 91 91 PHE HE1 H 1 7.325 0.020 . 1 . . . . A 91 PHE HE1 . 25850 1 1123 . 1 1 91 91 PHE HE2 H 1 7.325 0.020 . 1 . . . . A 91 PHE HE2 . 25850 1 1124 . 1 1 91 91 PHE C C 13 175.327 0.100 . 1 . . . . A 91 PHE C . 25850 1 1125 . 1 1 91 91 PHE CA C 13 57.565 0.100 . 1 . . . . A 91 PHE CA . 25850 1 1126 . 1 1 91 91 PHE CB C 13 39.457 0.100 . 1 . . . . A 91 PHE CB . 25850 1 1127 . 1 1 91 91 PHE CD1 C 13 131.667 0.100 . 1 . . . . A 91 PHE CD1 . 25850 1 1128 . 1 1 91 91 PHE CD2 C 13 131.667 0.100 . 1 . . . . A 91 PHE CD2 . 25850 1 1129 . 1 1 91 91 PHE CE1 C 13 131.498 0.100 . 1 . . . . A 91 PHE CE1 . 25850 1 1130 . 1 1 91 91 PHE CE2 C 13 131.498 0.100 . 1 . . . . A 91 PHE CE2 . 25850 1 1131 . 1 1 91 91 PHE N N 15 123.843 0.100 . 1 . . . . A 91 PHE N . 25850 1 1132 . 1 1 92 92 GLN H H 1 8.212 0.020 . 1 . . . . A 92 GLN H . 25850 1 1133 . 1 1 92 92 GLN HA H 1 4.296 0.020 . 1 . . . . A 92 GLN HA . 25850 1 1134 . 1 1 92 92 GLN HB2 H 1 2.030 0.020 . 2 . . . . A 92 GLN HB2 . 25850 1 1135 . 1 1 92 92 GLN HB3 H 1 1.933 0.020 . 2 . . . . A 92 GLN HB3 . 25850 1 1136 . 1 1 92 92 GLN HG2 H 1 2.281 0.020 . 1 . . . . A 92 GLN HG2 . 25850 1 1137 . 1 1 92 92 GLN HG3 H 1 2.281 0.020 . 1 . . . . A 92 GLN HG3 . 25850 1 1138 . 1 1 92 92 GLN HE21 H 1 7.533 0.020 . 2 . . . . A 92 GLN HE21 . 25850 1 1139 . 1 1 92 92 GLN HE22 H 1 6.836 0.020 . 2 . . . . A 92 GLN HE22 . 25850 1 1140 . 1 1 92 92 GLN C C 13 175.338 0.100 . 1 . . . . A 92 GLN C . 25850 1 1141 . 1 1 92 92 GLN CA C 13 55.492 0.100 . 1 . . . . A 92 GLN CA . 25850 1 1142 . 1 1 92 92 GLN CB C 13 29.708 0.100 . 1 . . . . A 92 GLN CB . 25850 1 1143 . 1 1 92 92 GLN CG C 13 33.515 0.100 . 1 . . . . A 92 GLN CG . 25850 1 1144 . 1 1 92 92 GLN N N 15 122.349 0.100 . 1 . . . . A 92 GLN N . 25850 1 1145 . 1 1 92 92 GLN NE2 N 15 112.181 0.100 . 1 . . . . A 92 GLN NE2 . 25850 1 1146 . 1 1 93 93 LYS H H 1 8.364 0.020 . 1 . . . . A 93 LYS H . 25850 1 1147 . 1 1 93 93 LYS HA H 1 4.250 0.020 . 1 . . . . A 93 LYS HA . 25850 1 1148 . 1 1 93 93 LYS HB2 H 1 1.810 0.020 . 2 . . . . A 93 LYS HB2 . 25850 1 1149 . 1 1 93 93 LYS HB3 H 1 1.722 0.020 . 2 . . . . A 93 LYS HB3 . 25850 1 1150 . 1 1 93 93 LYS HG2 H 1 1.428 0.020 . 1 . . . . A 93 LYS HG2 . 25850 1 1151 . 1 1 93 93 LYS HG3 H 1 1.428 0.020 . 1 . . . . A 93 LYS HG3 . 25850 1 1152 . 1 1 93 93 LYS HD2 H 1 1.681 0.020 . 1 . . . . A 93 LYS HD2 . 25850 1 1153 . 1 1 93 93 LYS HD3 H 1 1.681 0.020 . 1 . . . . A 93 LYS HD3 . 25850 1 1154 . 1 1 93 93 LYS HE2 H 1 2.993 0.020 . 1 . . . . A 93 LYS HE2 . 25850 1 1155 . 1 1 93 93 LYS HE3 H 1 2.993 0.020 . 1 . . . . A 93 LYS HE3 . 25850 1 1156 . 1 1 93 93 LYS C C 13 176.492 0.100 . 1 . . . . A 93 LYS C . 25850 1 1157 . 1 1 93 93 LYS CA C 13 56.272 0.100 . 1 . . . . A 93 LYS CA . 25850 1 1158 . 1 1 93 93 LYS CB C 13 33.055 0.100 . 1 . . . . A 93 LYS CB . 25850 1 1159 . 1 1 93 93 LYS CG C 13 24.619 0.100 . 1 . . . . A 93 LYS CG . 25850 1 1160 . 1 1 93 93 LYS CD C 13 29.040 0.100 . 1 . . . . A 93 LYS CD . 25850 1 1161 . 1 1 93 93 LYS CE C 13 42.011 0.100 . 1 . . . . A 93 LYS CE . 25850 1 1162 . 1 1 93 93 LYS N N 15 123.137 0.100 . 1 . . . . A 93 LYS N . 25850 1 1163 . 1 1 94 94 GLU H H 1 8.571 0.020 . 1 . . . . A 94 GLU H . 25850 1 1164 . 1 1 94 94 GLU HA H 1 4.246 0.020 . 1 . . . . A 94 GLU HA . 25850 1 1165 . 1 1 94 94 GLU HB2 H 1 1.959 0.020 . 2 . . . . A 94 GLU HB2 . 25850 1 1166 . 1 1 94 94 GLU HB3 H 1 2.040 0.020 . 2 . . . . A 94 GLU HB3 . 25850 1 1167 . 1 1 94 94 GLU HG2 H 1 2.267 0.020 . 1 . . . . A 94 GLU HG2 . 25850 1 1168 . 1 1 94 94 GLU HG3 H 1 2.267 0.020 . 1 . . . . A 94 GLU HG3 . 25850 1 1169 . 1 1 94 94 GLU C C 13 177.008 0.100 . 1 . . . . A 94 GLU C . 25850 1 1170 . 1 1 94 94 GLU CA C 13 56.848 0.100 . 1 . . . . A 94 GLU CA . 25850 1 1171 . 1 1 94 94 GLU CB C 13 30.054 0.100 . 1 . . . . A 94 GLU CB . 25850 1 1172 . 1 1 94 94 GLU CG C 13 35.974 0.100 . 1 . . . . A 94 GLU CG . 25850 1 1173 . 1 1 94 94 GLU N N 15 122.671 0.100 . 1 . . . . A 94 GLU N . 25850 1 1174 . 1 1 95 95 GLY H H 1 8.490 0.020 . 1 . . . . A 95 GLY H . 25850 1 1175 . 1 1 95 95 GLY HA2 H 1 4.007 0.020 . 2 . . . . A 95 GLY HA2 . 25850 1 1176 . 1 1 95 95 GLY HA3 H 1 3.897 0.020 . 2 . . . . A 95 GLY HA3 . 25850 1 1177 . 1 1 95 95 GLY C C 13 174.070 0.100 . 1 . . . . A 95 GLY C . 25850 1 1178 . 1 1 95 95 GLY CA C 13 45.191 0.100 . 1 . . . . A 95 GLY CA . 25850 1 1179 . 1 1 95 95 GLY N N 15 110.337 0.100 . 1 . . . . A 95 GLY N . 25850 1 1180 . 1 1 96 96 GLU H H 1 8.142 0.020 . 1 . . . . A 96 GLU H . 25850 1 1181 . 1 1 96 96 GLU HA H 1 4.339 0.020 . 1 . . . . A 96 GLU HA . 25850 1 1182 . 1 1 96 96 GLU HB2 H 1 2.063 0.020 . 2 . . . . A 96 GLU HB2 . 25850 1 1183 . 1 1 96 96 GLU HB3 H 1 1.930 0.020 . 2 . . . . A 96 GLU HB3 . 25850 1 1184 . 1 1 96 96 GLU HG2 H 1 2.233 0.020 . 1 . . . . A 96 GLU HG2 . 25850 1 1185 . 1 1 96 96 GLU HG3 H 1 2.233 0.020 . 1 . . . . A 96 GLU HG3 . 25850 1 1186 . 1 1 96 96 GLU C C 13 176.463 0.100 . 1 . . . . A 96 GLU C . 25850 1 1187 . 1 1 96 96 GLU CA C 13 56.204 0.100 . 1 . . . . A 96 GLU CA . 25850 1 1188 . 1 1 96 96 GLU CB C 13 30.433 0.100 . 1 . . . . A 96 GLU CB . 25850 1 1189 . 1 1 96 96 GLU CG C 13 36.249 0.100 . 1 . . . . A 96 GLU CG . 25850 1 1190 . 1 1 96 96 GLU N N 15 120.183 0.100 . 1 . . . . A 96 GLU N . 25850 1 1191 . 1 1 97 97 SER H H 1 8.381 0.020 . 1 . . . . A 97 SER H . 25850 1 1192 . 1 1 97 97 SER HA H 1 4.472 0.020 . 1 . . . . A 97 SER HA . 25850 1 1193 . 1 1 97 97 SER HB2 H 1 3.820 0.020 . 1 . . . . A 97 SER HB2 . 25850 1 1194 . 1 1 97 97 SER HB3 H 1 3.820 0.020 . 1 . . . . A 97 SER HB3 . 25850 1 1195 . 1 1 97 97 SER C C 13 174.162 0.100 . 1 . . . . A 97 SER C . 25850 1 1196 . 1 1 97 97 SER CA C 13 58.070 0.100 . 1 . . . . A 97 SER CA . 25850 1 1197 . 1 1 97 97 SER CB C 13 63.710 0.100 . 1 . . . . A 97 SER CB . 25850 1 1198 . 1 1 97 97 SER N N 15 116.979 0.100 . 1 . . . . A 97 SER N . 25850 1 1199 . 1 1 98 98 ILE H H 1 8.216 0.020 . 1 . . . . A 98 ILE H . 25850 1 1200 . 1 1 98 98 ILE HA H 1 4.201 0.020 . 1 . . . . A 98 ILE HA . 25850 1 1201 . 1 1 98 98 ILE HB H 1 1.865 0.020 . 1 . . . . A 98 ILE HB . 25850 1 1202 . 1 1 98 98 ILE HG12 H 1 1.430 0.020 . 2 . . . . A 98 ILE HG12 . 25850 1 1203 . 1 1 98 98 ILE HG13 H 1 1.159 0.020 . 2 . . . . A 98 ILE HG13 . 25850 1 1204 . 1 1 98 98 ILE HG21 H 1 0.883 0.020 . 1 . . . . A 98 ILE HG21 . 25850 1 1205 . 1 1 98 98 ILE HG22 H 1 0.883 0.020 . 1 . . . . A 98 ILE HG22 . 25850 1 1206 . 1 1 98 98 ILE HG23 H 1 0.883 0.020 . 1 . . . . A 98 ILE HG23 . 25850 1 1207 . 1 1 98 98 ILE HD11 H 1 0.835 0.020 . 1 . . . . A 98 ILE HD11 . 25850 1 1208 . 1 1 98 98 ILE HD12 H 1 0.835 0.020 . 1 . . . . A 98 ILE HD12 . 25850 1 1209 . 1 1 98 98 ILE HD13 H 1 0.835 0.020 . 1 . . . . A 98 ILE HD13 . 25850 1 1210 . 1 1 98 98 ILE C C 13 175.921 0.100 . 1 . . . . A 98 ILE C . 25850 1 1211 . 1 1 98 98 ILE CA C 13 60.947 0.100 . 1 . . . . A 98 ILE CA . 25850 1 1212 . 1 1 98 98 ILE CB C 13 38.616 0.100 . 1 . . . . A 98 ILE CB . 25850 1 1213 . 1 1 98 98 ILE CG1 C 13 27.007 0.100 . 1 . . . . A 98 ILE CG1 . 25850 1 1214 . 1 1 98 98 ILE CG2 C 13 17.520 0.100 . 1 . . . . A 98 ILE CG2 . 25850 1 1215 . 1 1 98 98 ILE CD1 C 13 12.883 0.100 . 1 . . . . A 98 ILE CD1 . 25850 1 1216 . 1 1 98 98 ILE N N 15 122.626 0.100 . 1 . . . . A 98 ILE N . 25850 1 1217 . 1 1 99 99 LEU H H 1 8.326 0.020 . 1 . . . . A 99 LEU H . 25850 1 1218 . 1 1 99 99 LEU HA H 1 4.399 0.020 . 1 . . . . A 99 LEU HA . 25850 1 1219 . 1 1 99 99 LEU HB2 H 1 1.603 0.020 . 1 . . . . A 99 LEU HB2 . 25850 1 1220 . 1 1 99 99 LEU HB3 H 1 1.603 0.020 . 1 . . . . A 99 LEU HB3 . 25850 1 1221 . 1 1 99 99 LEU HG H 1 1.601 0.020 . 1 . . . . A 99 LEU HG . 25850 1 1222 . 1 1 99 99 LEU HD11 H 1 0.902 0.020 . 2 . . . . A 99 LEU HD11 . 25850 1 1223 . 1 1 99 99 LEU HD12 H 1 0.902 0.020 . 2 . . . . A 99 LEU HD12 . 25850 1 1224 . 1 1 99 99 LEU HD13 H 1 0.902 0.020 . 2 . . . . A 99 LEU HD13 . 25850 1 1225 . 1 1 99 99 LEU HD21 H 1 0.842 0.020 . 2 . . . . A 99 LEU HD21 . 25850 1 1226 . 1 1 99 99 LEU HD22 H 1 0.842 0.020 . 2 . . . . A 99 LEU HD22 . 25850 1 1227 . 1 1 99 99 LEU HD23 H 1 0.842 0.020 . 2 . . . . A 99 LEU HD23 . 25850 1 1228 . 1 1 99 99 LEU C C 13 176.093 0.100 . 1 . . . . A 99 LEU C . 25850 1 1229 . 1 1 99 99 LEU CA C 13 54.853 0.100 . 1 . . . . A 99 LEU CA . 25850 1 1230 . 1 1 99 99 LEU CB C 13 42.135 0.100 . 1 . . . . A 99 LEU CB . 25850 1 1231 . 1 1 99 99 LEU CG C 13 26.798 0.100 . 1 . . . . A 99 LEU CG . 25850 1 1232 . 1 1 99 99 LEU CD1 C 13 24.905 0.100 . 1 . . . . A 99 LEU CD1 . 25850 1 1233 . 1 1 99 99 LEU CD2 C 13 23.400 0.100 . 1 . . . . A 99 LEU CD2 . 25850 1 1234 . 1 1 99 99 LEU N N 15 126.765 0.100 . 1 . . . . A 99 LEU N . 25850 1 1235 . 1 1 100 100 GLU H H 1 7.876 0.020 . 1 . . . . A 100 GLU H . 25850 1 1236 . 1 1 100 100 GLU HA H 1 4.096 0.020 . 1 . . . . A 100 GLU HA . 25850 1 1237 . 1 1 100 100 GLU HB2 H 1 1.865 0.020 . 2 . . . . A 100 GLU HB2 . 25850 1 1238 . 1 1 100 100 GLU HB3 H 1 2.018 0.020 . 2 . . . . A 100 GLU HB3 . 25850 1 1239 . 1 1 100 100 GLU HG2 H 1 2.167 0.020 . 1 . . . . A 100 GLU HG2 . 25850 1 1240 . 1 1 100 100 GLU HG3 H 1 2.167 0.020 . 1 . . . . A 100 GLU HG3 . 25850 1 1241 . 1 1 100 100 GLU C C 13 180.861 0.100 . 1 . . . . A 100 GLU C . 25850 1 1242 . 1 1 100 100 GLU CA C 13 57.855 0.100 . 1 . . . . A 100 GLU CA . 25850 1 1243 . 1 1 100 100 GLU CB C 13 31.211 0.100 . 1 . . . . A 100 GLU CB . 25850 1 1244 . 1 1 100 100 GLU CG C 13 36.547 0.100 . 1 . . . . A 100 GLU CG . 25850 1 1245 . 1 1 100 100 GLU N N 15 126.946 0.100 . 1 . . . . A 100 GLU N . 25850 1 stop_ save_